0 B16R2.2256 C(=Cc1ccccc1)Cc2ccccc2 271570a_200016263579_100000210277 [0,0,0,0,0,0|1,0,1]=2 1 B16R2.2256 C(=Cc1ccccn1)Cc2ccccc2 271570a_200016263579_100011216584 [0,0,0,0,0,0|2,0,1]=3 2 B16R2.2256 C(=Cc1cccnc1)Cc2ccccc2 271570a_200016263579_100000752921 [0,0,0,0,0,0|2,0,1]=3 3 B16R2.2256 C(=Cc1cccnn1)Cc2ccccc2 271570a_200016263579_100016991348 [0,0,0,0,0,0|3,0,1]=4 4 B16R2.2256 C(=Cc1ccncc1)Cc2ccccc2 271570a_200016263579_100000035832 [0,0,0,0,0,0|2,0,1]=3 5 B16R2.2256 C(=Cc1ccncn1)Cc2ccccc2 271570a_200016263579_100000703185 [0,0,0,0,0,0|3,0,1]=4 6 B16R2.2256 C(=Cc1ccnnc1)Cc2ccccc2 271570a_200016263579_100000732662 [0,0,0,0,0,0|3,0,1]=4 7 B16R2.2256 C(=Cc1cnccn1)Cc2ccccc2 271570a_200016263579_100000758340 [0,0,0,0,0,0|3,0,1]=4 8 B16R2.2256 C(=Cc1cncnc1)Cc2ccccc2 271570a_200016263579_100011206942 [0,0,0,0,0,0|3,0,1]=4 9 B16R2.2256 C(=Cc1ncccn1)Cc2ccccc2 271570a_200016263579_100000211032 [0,0,0,0,0,0|3,0,1]=4 10 B16R2.2256 C(=NNc1ccccc1)c2ccccc2 4a_100015195140_100015611070 [0,0,0,0,0,0|2,0,1]=3 11 B16R2.2256 C(=NNc1ccccc1)c2ccccn2 4a_100015195140_100000209966 [0,0,0,0,0,0|3,0,1]=4 12 B16R2.2256 C(=NNc1ccccc1)c2cccnc2 4a_100015195140_100000209961 [0,0,0,0,0,0|3,0,1]=4 13 B16R2.2256 C(=NNc1ccccc1)c2ccncc2 4a_100015195140_100000186114 [0,0,0,0,0,0|3,0,1]=4 14 B16R2.2256 C(=NNc1ccccn1)c2ccccc2 4a_100000183288_100015611070 [0,0,0,0,0,0|3,0,1]=4 15 B16R2.2256 C(=NNc1cccnc1)c2ccccc2 4a_100000728903_100015611070 [0,0,0,0,0,0|3,0,1]=4 16 B16R2.2256 C(=NNc1ccncc1)c2ccccc2 4a_100000698918_100015611070 [0,0,0,0,0,0|3,0,1]=4 17 B16R2.2256 C1=CCC(CC1)COCc2ccccc2 34a_100000210713_100015291786 [0,0,0,0,0,0|0,0,4]=4 18 B16R2.2256 C1=CCN(CC1)COCc2ccccc2 2230a_100000698166_100000763385 [0,0,0,0,0,0|1,0,3]=4 19 B16R2.2256 C1=CCN(CC1)COCc2ccccc2 34a_100000698166_100000763385 [0,0,0,0,0,0|1,0,3]=4 20 B16R2.2256 C1=COC(CC1)COCc2ccccc2 34a_100011217868_100015291786 [0,0,0,0,0,0|1,0,3]=4 21 B16R2.2256 c1cc(ccn1)CCSc2ccncc2 62a_100000723409_100000728582 [0,0,0,0,0,0|4,0,0]=4 22 B16R2.2256 c1cc(ccn1)CCSc2ccncc2 62a_100000728582_100000723409 [0,0,0,0,0,0|4,0,0]=4 23 B16R2.2256 c1cc(ccn1)CNCc2cncnc2 207a_100011243677_100000186114 [0,0,0,0,0,0|4,0,0]=4 24 B16R2.2256 c1cc(ccn1)CNCc2cncnc2 2230a_100011243677_100015193705 [0,0,0,0,0,0|4,0,0]=4 25 B16R2.2256 c1cc(ccn1)CSCc2ccncc2 62a_100015193705_100015193705 [0,0,0,0,0,0|2,1,0]=3 26 B16R2.2256 c1cc(ccn1)CSCc2cnccn2 62a_100015193705_100016995436 [0,0,0,0,0,0|3,1,0]=4 27 B16R2.2256 c1cc(ccn1)CSCc2cnccn2 62a_100016995436_100015193705 [0,0,0,0,0,0|3,1,0]=4 28 B16R2.2256 c1cc(ccn1)CSCc2cncnc2 62a_100015193705_100015196519 [0,0,0,0,0,0|3,1,0]=4 29 B16R2.2256 c1cc(ccn1)CSCc2cncnc2 62a_100015196519_100015193705 [0,0,0,0,0,0|3,1,0]=4 30 B16R2.2256 c1ccc(cc1)CCNc2ccccc2 34a_100000106764_100000765856 [0,0,0,0,0,0|2,0,0]=2 31 B16R2.2256 c1ccc(cc1)CCNc2cccnn2 27a_100000106460_100016991348 [0,0,0,0,0,0|4,0,0]=4 32 B16R2.2256 c1ccc(cc1)CCNc2ccncn2 27a_100000106460_100000703185 [0,0,0,0,0,0|4,0,0]=4 33 B16R2.2256 c1ccc(cc1)CCNc2cnccn2 27a_100000106460_100000211759 [0,0,0,0,0,0|4,0,0]=4 34 B16R2.2256 c1ccc(cc1)CCNc2ncccn2 27a_100000106460_100000211032 [0,0,0,0,0,0|4,0,0]=4 35 B16R2.2256 c1ccc(cc1)CCOc2ccccc2 34a_100000210340_100000765856 [0,0,0,0,0,0|2,0,0]=2 36 B16R2.2256 c1ccc(cc1)CCOc2ccccc2 7a_100000210340_100000765856 [0,0,0,0,0,0|2,0,0]=2 37 B16R2.2256 c1ccc(cc1)CCOc2cccnc2 34a_100000210849_100000765856 [0,0,0,0,0,0|3,0,0]=3 38 B16R2.2256 c1ccc(cc1)CCOc2cccnc2 7a_100000210849_100000765856 [0,0,0,0,0,0|3,0,0]=3 39 B16R2.2256 c1ccc(cc1)CCOc2ccncc2 34a_100000212176_100000765856 [0,0,0,0,0,0|3,0,0]=3 40 B16R2.2256 c1ccc(cc1)CCOc2ccnnc2 34a_100015204005_100000765856 [0,0,0,0,0,0|4,0,0]=4 41 B16R2.2256 c1ccc(cc1)CCOc2cncnc2 7a_100000754086_100000765856 [0,0,0,0,0,0|4,0,0]=4 42 B16R2.2256 c1ccc(cc1)CCSc2ccccc2 62a_100000719477_100011218657 [0,0,0,0,0,0|2,0,0]=2 43 B16R2.2256 c1ccc(cc1)CCSc2ccccc2 62a_100000765856_100000041952 [0,0,0,0,0,0|2,0,0]=2 44 B16R2.2256 c1ccc(cc1)CCSc2ccccn2 62a_100000765856_100011216584 [0,0,0,0,0,0|3,0,0]=3 45 B16R2.2256 c1ccc(cc1)CCSc2ccccn2 62a_100011216584_100011218657 [0,0,0,0,0,0|3,0,0]=3 46 B16R2.2256 c1ccc(cc1)CCSc2cccnc2 62a_100000210063_100011218657 [0,0,0,0,0,0|3,0,0]=3 47 B16R2.2256 c1ccc(cc1)CCSc2cccnc2 62a_100000765856_100000210063 [0,0,0,0,0,0|3,0,0]=3 48 B16R2.2256 c1ccc(cc1)CCSc2cccnn2 62a_100000765856_100016991348 [0,0,0,0,0,0|4,0,0]=4 49 B16R2.2256 c1ccc(cc1)CCSc2cccnn2 62a_100016991348_100011218657 [0,0,0,0,0,0|4,0,0]=4 50 B16R2.2256 c1ccc(cc1)CCSc2ccncc2 62a_100000728582_100011218657 [0,0,0,0,0,0|3,0,0]=3 51 B16R2.2256 c1ccc(cc1)CCSc2ccncc2 62a_100000765856_100000728582 [0,0,0,0,0,0|3,0,0]=3 52 B16R2.2256 c1ccc(cc1)CCSc2ccncn2 62a_100000703185_100011218657 [0,0,0,0,0,0|4,0,0]=4 53 B16R2.2256 c1ccc(cc1)CCSc2ccncn2 62a_100000765856_100000703185 [0,0,0,0,0,0|4,0,0]=4 54 B16R2.2256 c1ccc(cc1)CCSc2ccnnc2 62a_100000732662_100011218657 [0,0,0,0,0,0|4,0,0]=4 55 B16R2.2256 c1ccc(cc1)CCSc2ccnnc2 62a_100000765856_100000732662 [0,0,0,0,0,0|4,0,0]=4 56 B16R2.2256 c1ccc(cc1)CCSc2cnccn2 62a_100000211759_100011218657 [0,0,0,0,0,0|4,0,0]=4 57 B16R2.2256 c1ccc(cc1)CCSc2cnccn2 62a_100000765856_100000211759 [0,0,0,0,0,0|4,0,0]=4 58 B16R2.2256 c1ccc(cc1)CCSc2cncnc2 62a_100000765856_100011206942 [0,0,0,0,0,0|4,0,0]=4 59 B16R2.2256 c1ccc(cc1)CCSc2cncnc2 62a_100011206942_100011218657 [0,0,0,0,0,0|4,0,0]=4 60 B16R2.2256 c1ccc(cc1)CCSc2ncccn2 62a_100000211032_100011218657 [0,0,0,0,0,0|4,0,0]=4 61 B16R2.2256 c1ccc(cc1)CCSc2ncccn2 62a_100000765856_100000211032 [0,0,0,0,0,0|4,0,0]=4 62 B16R2.2256 c1ccc(cc1)CNCc2ccccc2 207a_100015324214_100015611070 [0,0,0,0,0,0|1,0,0]=1 63 B16R2.2256 c1ccc(cc1)CNCc2ccccc2 2230a_100015324214_100015291786 [0,0,0,0,0,0|1,0,0]=1 64 B16R2.2256 c1ccc(cc1)CNCc2ccccc2 270004a_100015324214_100015611070 [0,0,0,0,0,0|1,0,0]=1 65 B16R2.2256 c1ccc(cc1)CNCc2ccccc2 34a_100015324214_100015291786 [0,0,0,0,0,0|1,0,0]=1 66 B16R2.2256 c1ccc(cc1)CNCc2ccccn2 207a_100015324214_100000209966 [0,0,0,0,0,0|2,0,0]=2 67 B16R2.2256 c1ccc(cc1)CNCc2ccccn2 2230a_100015324214_100000721315 [0,0,0,0,0,0|2,0,0]=2 68 B16R2.2256 c1ccc(cc1)CNCc2ccccn2 270004a_100000210449_100015611070 [0,0,0,0,0,0|2,0,0]=2 69 B16R2.2256 c1ccc(cc1)CNCc2ccccn2 270004a_100015324214_100000209966 [0,0,0,0,0,0|2,0,0]=2 70 B16R2.2256 c1ccc(cc1)CNCc2ccccn2 34a_100015324214_100000721315 [0,0,0,0,0,0|2,0,0]=2 71 B16R2.2256 c1ccc(cc1)CNCc2cccnc2 207a_100000210453_100015611070 [0,0,0,0,0,0|2,0,0]=2 72 B16R2.2256 c1ccc(cc1)CNCc2cccnc2 207a_100015324214_100000209961 [0,0,0,0,0,0|2,0,0]=2 73 B16R2.2256 c1ccc(cc1)CNCc2cccnc2 2230a_100015324214_100000741622 [0,0,0,0,0,0|2,0,0]=2 74 B16R2.2256 c1ccc(cc1)CNCc2cccnc2 270004a_100000210453_100015611070 [0,0,0,0,0,0|2,0,0]=2 75 B16R2.2256 c1ccc(cc1)CNCc2cccnc2 270004a_100015324214_100000209961 [0,0,0,0,0,0|2,0,0]=2 76 B16R2.2256 c1ccc(cc1)CNCc2cccnc2 34a_100015324214_100000733263 [0,0,0,0,0,0|2,0,0]=2 77 B16R2.2256 c1ccc(cc1)CNCc2cccnn2 2230a_100015324214_100016990269 [0,0,0,0,0,0|3,0,0]=3 78 B16R2.2256 c1ccc(cc1)CNCc2cccnn2 2230a_100159270163_100015291786 [0,0,0,0,0,0|3,0,0]=3 79 B16R2.2256 c1ccc(cc1)CNCc2cccnn2 34a_100015324214_100016990269 [0,0,0,0,0,0|3,0,0]=3 80 B16R2.2256 c1ccc(cc1)CNCc2ccncc2 207a_100015324214_100000186114 [0,0,0,0,0,0|2,0,0]=2 81 B16R2.2256 c1ccc(cc1)CNCc2ccncc2 2230a_100015324214_100015193705 [0,0,0,0,0,0|2,0,0]=2 82 B16R2.2256 c1ccc(cc1)CNCc2ccnnc2 270004a_100015324214_100011934578 [0,0,0,0,0,0|3,0,0]=3 83 B16R2.2256 c1ccc(cc1)CNCc2cnccn2 2230a_100015324214_100016995436 [0,0,0,0,0,0|3,0,0]=3 84 B16R2.2256 c1ccc(cc1)CNCc2cnccn2 270004a_100015324214_100000749867 [0,0,0,0,0,0|3,0,0]=3 85 B16R2.2256 c1ccc(cc1)CNCc2cnccn2 34a_100015324214_100016995436 [0,0,0,0,0,0|3,0,0]=3 86 B16R2.2256 c1ccc(cc1)CNCc2cncnc2 207a_100011243677_100015611070 [0,0,0,0,0,0|3,0,0]=3 87 B16R2.2256 c1ccc(cc1)CNCc2cncnc2 2230a_100011243677_100015291786 [0,0,0,0,0,0|3,0,0]=3 88 B16R2.2256 c1ccc(cc1)CNCc2cncnc2 2230a_100015324214_100015196519 [0,0,0,0,0,0|3,0,0]=3 89 B16R2.2256 c1ccc(cc1)CNCc2cncnc2 270004a_100011243677_100015611070 [0,0,0,0,0,0|3,0,0]=3 90 B16R2.2256 c1ccc(cc1)CNCc2cncnc2 270004a_100015324214_100000749868 [0,0,0,0,0,0|3,0,0]=3 91 B16R2.2256 c1ccc(cc1)CNCc2cncnc2 34a_100015324214_100015196519 [0,0,0,0,0,0|3,0,0]=3 92 B16R2.2256 c1ccc(cc1)CNCc2ncccn2 2230a_100015324214_100000703007 [0,0,0,0,0,0|3,0,0]=3 93 B16R2.2256 c1ccc(cc1)CNCc2ncccn2 270004a_100015324214_100011532527 [0,0,0,0,0,0|3,0,0]=3 94 B16R2.2256 c1ccc(cc1)CNCc2ncccn2 34a_100015324214_100000703007 [0,0,0,0,0,0|3,0,0]=3 95 B16R2.2256 c1ccc(cc1)COCc2ccccc2 34a_100000210790_100015291786 [0,0,0,0,0,0|0,0,0]=0 96 B16R2.2256 c1ccc(cc1)COCc2ccccc2 7a_100000210790_100000211182 [0,0,0,0,0,0|0,0,0]=0 97 B16R2.2256 c1ccc(cc1)COCc2ccccn2 34a_100000210790_100000721315 [0,0,0,0,0,0|1,0,0]=1 98 B16R2.2256 c1ccc(cc1)COCc2ccccn2 7a_100000210790_100000721315 [0,0,0,0,0,0|1,0,0]=1 99 B16R2.2256 c1ccc(cc1)COCc2cccnc2 34a_100000210790_100000733263 [0,0,0,0,0,0|1,0,0]=1 100 B16R2.2256 c1ccc(cc1)COCc2cccnc2 7a_100000210790_100000741622 [0,0,0,0,0,0|1,0,0]=1 101 B16R2.2256 c1ccc(cc1)COCc2cccnn2 34a_100000210790_100016990269 [0,0,0,0,0,0|2,0,0]=2 102 B16R2.2256 c1ccc(cc1)COCc2cccnn2 7a_100000210790_100016990269 [0,0,0,0,0,0|2,0,0]=2 103 B16R2.2256 c1ccc(cc1)COCc2ccncc2 7a_100000210790_100015193705 [0,0,0,0,0,0|1,0,0]=1 104 B16R2.2256 c1ccc(cc1)COCc2cnccn2 34a_100000210790_100016995436 [0,0,0,0,0,0|2,0,0]=2 105 B16R2.2256 c1ccc(cc1)COCc2cnccn2 7a_100000210790_100016995436 [0,0,0,0,0,0|2,0,0]=2 106 B16R2.2256 c1ccc(cc1)COCc2cncnc2 34a_100000210790_100015196519 [0,0,0,0,0,0|2,0,0]=2 107 B16R2.2256 c1ccc(cc1)COCc2cncnc2 7a_100000210790_100015196519 [0,0,0,0,0,0|2,0,0]=2 108 B16R2.2256 c1ccc(cc1)COCc2ncccn2 34a_100000210790_100000703007 [0,0,0,0,0,0|2,0,0]=2 109 B16R2.2256 c1ccc(cc1)COCc2ncccn2 7a_100000210790_100000703007 [0,0,0,0,0,0|2,0,0]=2 110 B16R2.2256 c1ccc(cc1)CSCc2ccccc2 62a_100000211182_100015291786 [0,0,0,0,0,0|0,1,0]=1 111 B16R2.2256 c1ccc(cc1)CSCc2ccccn2 62a_100000211182_100000721315 [0,0,0,0,0,0|1,1,0]=2 112 B16R2.2256 c1ccc(cc1)CSCc2ccccn2 62a_100000721315_100015291786 [0,0,0,0,0,0|1,1,0]=2 113 B16R2.2256 c1ccc(cc1)CSCc2cccnc2 62a_100000211182_100000741622 [0,0,0,0,0,0|1,1,0]=2 114 B16R2.2256 c1ccc(cc1)CSCc2cccnc2 62a_100000741622_100015291786 [0,0,0,0,0,0|1,1,0]=2 115 B16R2.2256 c1ccc(cc1)CSCc2cccnn2 62a_100000211182_100016990269 [0,0,0,0,0,0|2,1,0]=3 116 B16R2.2256 c1ccc(cc1)CSCc2cccnn2 62a_100016990269_100015291786 [0,0,0,0,0,0|2,1,0]=3 117 B16R2.2256 c1ccc(cc1)CSCc2ccncc2 62a_100000211182_100015193705 [0,0,0,0,0,0|1,1,0]=2 118 B16R2.2256 c1ccc(cc1)CSCc2ccncc2 62a_100015193705_100015291786 [0,0,0,0,0,0|1,1,0]=2 119 B16R2.2256 c1ccc(cc1)CSCc2cnccn2 62a_100000211182_100016995436 [0,0,0,0,0,0|2,1,0]=3 120 B16R2.2256 c1ccc(cc1)CSCc2cnccn2 62a_100016995436_100015291786 [0,0,0,0,0,0|2,1,0]=3 121 B16R2.2256 c1ccc(cc1)CSCc2cncnc2 62a_100000211182_100015196519 [0,0,0,0,0,0|2,1,0]=3 122 B16R2.2256 c1ccc(cc1)CSCc2cncnc2 62a_100015196519_100015291786 [0,0,0,0,0,0|2,1,0]=3 123 B16R2.2256 c1ccc(cc1)CSCc2ncccn2 62a_100000211182_100000703007 [0,0,0,0,0,0|2,1,0]=3 124 B16R2.2256 c1ccc(cc1)CSCc2ncccn2 62a_100000703007_100015291786 [0,0,0,0,0,0|2,1,0]=3 125 B16R2.2256 c1ccc(cc1)OCCc2ccccn2 7a_100000210340_100015183660 [0,0,0,0,0,0|3,0,0]=3 126 B16R2.2256 c1ccc(cc1)OCCc2cccnc2 7a_100000210340_200011713674 [0,0,0,0,0,0|3,0,0]=3 127 B16R2.2256 c1ccc(cc1)OCCc2ccncc2 7a_100000210340_100000723409 [0,0,0,0,0,0|3,0,0]=3 128 B16R2.2256 c1ccc(cc1)SCCc2ccccn2 62a_100000719477_100015183660 [0,0,0,0,0,0|3,0,0]=3 129 B16R2.2256 c1ccc(cc1)SCCc2ccccn2 62a_100015183660_100000041952 [0,0,0,0,0,0|3,0,0]=3 130 B16R2.2256 c1ccc(cc1)SCCc2cccnc2 62a_100000719477_200011713674 [0,0,0,0,0,0|3,0,0]=3 131 B16R2.2256 c1ccc(cc1)SCCc2cccnc2 62a_200011713674_100000041952 [0,0,0,0,0,0|3,0,0]=3 132 B16R2.2256 c1ccc(cc1)SCCc2ccncc2 62a_100000719477_100000723409 [0,0,0,0,0,0|3,0,0]=3 133 B16R2.2256 c1ccc(cc1)SCCc2ccncc2 62a_100000723409_100000041952 [0,0,0,0,0,0|3,0,0]=3 134 B16R2.2256 c1ccc(cc1)SCSc2ccccc2 62a_100000719477_100011218342 [0,0,0,0,0,0|3,0,0]=3 135 B16R2.2256 c1ccc(cc1)SCSc2ccccc2 62a_100011218342_100000041952 [0,0,0,0,0,0|3,0,0]=3 136 B16R2.2256 c1ccc(cc1)SCSc2ccccn2 62a_100011216584_100011218342 [0,0,0,0,0,0|4,0,0]=4 137 B16R2.2256 c1ccc(cc1)SCSc2ccccn2 62a_100011218342_100011216584 [0,0,0,0,0,0|4,0,0]=4 138 B16R2.2256 c1ccc(cc1)SCSc2cccnc2 62a_100000210063_100011218342 [0,0,0,0,0,0|4,0,0]=4 139 B16R2.2256 c1ccc(cc1)SCSc2cccnc2 62a_100011218342_100000210063 [0,0,0,0,0,0|4,0,0]=4 140 B16R2.2256 c1ccc(cc1)SCSc2ccncc2 62a_100000728582_100011218342 [0,0,0,0,0,0|4,0,0]=4 141 B16R2.2256 c1ccc(cc1)SCSc2ccncc2 62a_100011218342_100000728582 [0,0,0,0,0,0|4,0,0]=4 142 B16R2.2256 c1ccc(nc1)CCOc2cccnc2 7a_100000210849_100015183660 [0,0,0,0,0,0|4,0,0]=4 143 B16R2.2256 c1ccc(nc1)CCSc2ccccn2 62a_100011216584_100015183660 [0,0,0,0,0,0|4,0,0]=4 144 B16R2.2256 c1ccc(nc1)CCSc2ccccn2 62a_100015183660_100011216584 [0,0,0,0,0,0|4,0,0]=4 145 B16R2.2256 c1ccc(nc1)CCSc2cccnc2 62a_100000210063_100015183660 [0,0,0,0,0,0|4,0,0]=4 146 B16R2.2256 c1ccc(nc1)CCSc2cccnc2 62a_100015183660_100000210063 [0,0,0,0,0,0|4,0,0]=4 147 B16R2.2256 c1ccc(nc1)CCSc2ccncc2 62a_100000728582_100015183660 [0,0,0,0,0,0|4,0,0]=4 148 B16R2.2256 c1ccc(nc1)CCSc2ccncc2 62a_100015183660_100000728582 [0,0,0,0,0,0|4,0,0]=4 149 B16R2.2256 c1ccc(nc1)CNCc2ccccn2 270004a_100000210449_100000209966 [0,0,0,0,0,0|3,0,0]=3 150 B16R2.2256 c1ccc(nc1)CNCc2cccnc2 207a_100000210453_100000209966 [0,0,0,0,0,0|3,0,0]=3 151 B16R2.2256 c1ccc(nc1)CNCc2cccnc2 270004a_100000210449_100000209961 [0,0,0,0,0,0|3,0,0]=3 152 B16R2.2256 c1ccc(nc1)CNCc2cccnc2 270004a_100000210453_100000209966 [0,0,0,0,0,0|3,0,0]=3 153 B16R2.2256 c1ccc(nc1)CNCc2cccnn2 2230a_100159270163_100000721315 [0,0,0,0,0,0|4,0,0]=4 154 B16R2.2256 c1ccc(nc1)CNCc2ccnnc2 270004a_100000210449_100011934578 [0,0,0,0,0,0|4,0,0]=4 155 B16R2.2256 c1ccc(nc1)CNCc2cnccn2 270004a_100000210449_100000749867 [0,0,0,0,0,0|4,0,0]=4 156 B16R2.2256 c1ccc(nc1)CNCc2cncnc2 207a_100011243677_100000209966 [0,0,0,0,0,0|4,0,0]=4 157 B16R2.2256 c1ccc(nc1)CNCc2cncnc2 2230a_100011243677_100000721315 [0,0,0,0,0,0|4,0,0]=4 158 B16R2.2256 c1ccc(nc1)CNCc2cncnc2 270004a_100000210449_100000749868 [0,0,0,0,0,0|4,0,0]=4 159 B16R2.2256 c1ccc(nc1)CNCc2cncnc2 270004a_100011243677_100000209966 [0,0,0,0,0,0|4,0,0]=4 160 B16R2.2256 c1ccc(nc1)CNCc2ncccn2 270004a_100000210449_100011532527 [0,0,0,0,0,0|4,0,0]=4 161 B16R2.2256 c1ccc(nc1)CSCc2ccccn2 62a_100000721315_100000721315 [0,0,0,0,0,0|2,1,0]=3 162 B16R2.2256 c1ccc(nc1)CSCc2cccnc2 62a_100000721315_100000741622 [0,0,0,0,0,0|2,1,0]=3 163 B16R2.2256 c1ccc(nc1)CSCc2cccnc2 62a_100000741622_100000721315 [0,0,0,0,0,0|2,1,0]=3 164 B16R2.2256 c1ccc(nc1)CSCc2cccnn2 62a_100000721315_100016990269 [0,0,0,0,0,0|3,1,0]=4 165 B16R2.2256 c1ccc(nc1)CSCc2cccnn2 62a_100016990269_100000721315 [0,0,0,0,0,0|3,1,0]=4 166 B16R2.2256 c1ccc(nc1)CSCc2ccncc2 62a_100000721315_100015193705 [0,0,0,0,0,0|2,1,0]=3 167 B16R2.2256 c1ccc(nc1)CSCc2ccncc2 62a_100015193705_100000721315 [0,0,0,0,0,0|2,1,0]=3 168 B16R2.2256 c1ccc(nc1)CSCc2cnccn2 62a_100000721315_100016995436 [0,0,0,0,0,0|3,1,0]=4 169 B16R2.2256 c1ccc(nc1)CSCc2cnccn2 62a_100016995436_100000721315 [0,0,0,0,0,0|3,1,0]=4 170 B16R2.2256 c1ccc(nc1)CSCc2cncnc2 62a_100000721315_100015196519 [0,0,0,0,0,0|3,1,0]=4 171 B16R2.2256 c1ccc(nc1)CSCc2cncnc2 62a_100015196519_100000721315 [0,0,0,0,0,0|3,1,0]=4 172 B16R2.2256 c1ccc(nc1)CSCc2ncccn2 62a_100000703007_100000721315 [0,0,0,0,0,0|3,1,0]=4 173 B16R2.2256 c1ccc(nc1)CSCc2ncccn2 62a_100000721315_100000703007 [0,0,0,0,0,0|3,1,0]=4 174 B16R2.2256 c1ccc(nc1)SCCc2cccnc2 62a_100011216584_200011713674 [0,0,0,0,0,0|4,0,0]=4 175 B16R2.2256 c1ccc(nc1)SCCc2cccnc2 62a_200011713674_100011216584 [0,0,0,0,0,0|4,0,0]=4 176 B16R2.2256 c1ccc(nc1)SCCc2ccncc2 62a_100000723409_100011216584 [0,0,0,0,0,0|4,0,0]=4 177 B16R2.2256 c1ccc(nc1)SCCc2ccncc2 62a_100011216584_100000723409 [0,0,0,0,0,0|4,0,0]=4 178 B16R2.2256 c1cnc(nc1)CNCc2cccnc2 270004a_100000210453_100011532527 [0,0,0,0,0,0|4,0,0]=4 179 B16R2.2256 c1cnc(nc1)CSCc2cccnc2 62a_100000703007_100000741622 [0,0,0,0,0,0|3,1,0]=4 180 B16R2.2256 c1cnc(nc1)CSCc2cccnc2 62a_100000741622_100000703007 [0,0,0,0,0,0|3,1,0]=4 181 B16R2.2256 c1cnc(nc1)CSCc2ccncc2 62a_100000703007_100015193705 [0,0,0,0,0,0|3,1,0]=4 182 B16R2.2256 c1cnc(nc1)CSCc2ccncc2 62a_100015193705_100000703007 [0,0,0,0,0,0|3,1,0]=4 183 B16R2.2256 c1cncc(c1)CCOc2cccnc2 7a_100000210849_200011713674 [0,0,0,0,0,0|4,0,0]=4 184 B16R2.2256 c1cncc(c1)CCSc2cccnc2 62a_100000210063_200011713674 [0,0,0,0,0,0|4,0,0]=4 185 B16R2.2256 c1cncc(c1)CCSc2cccnc2 62a_200011713674_100000210063 [0,0,0,0,0,0|4,0,0]=4 186 B16R2.2256 c1cncc(c1)CCSc2ccncc2 62a_100000728582_200011713674 [0,0,0,0,0,0|4,0,0]=4 187 B16R2.2256 c1cncc(c1)CCSc2ccncc2 62a_200011713674_100000728582 [0,0,0,0,0,0|4,0,0]=4 188 B16R2.2256 c1cncc(c1)CNCc2cccnc2 207a_100000210453_100000209961 [0,0,0,0,0,0|3,0,0]=3 189 B16R2.2256 c1cncc(c1)CNCc2cccnc2 270004a_100000210453_100000209961 [0,0,0,0,0,0|3,0,0]=3 190 B16R2.2256 c1cncc(c1)CNCc2cccnn2 2230a_100159270163_100000741622 [0,0,0,0,0,0|4,0,0]=4 191 B16R2.2256 c1cncc(c1)CNCc2ccncc2 207a_100000210453_100000186114 [0,0,0,0,0,0|3,0,0]=3 192 B16R2.2256 c1cncc(c1)CNCc2ccnnc2 270004a_100000210453_100011934578 [0,0,0,0,0,0|4,0,0]=4 193 B16R2.2256 c1cncc(c1)CNCc2cnccn2 270004a_100000210453_100000749867 [0,0,0,0,0,0|4,0,0]=4 194 B16R2.2256 c1cncc(c1)CNCc2cncnc2 207a_100011243677_100000209961 [0,0,0,0,0,0|4,0,0]=4 195 B16R2.2256 c1cncc(c1)CNCc2cncnc2 2230a_100011243677_100000741622 [0,0,0,0,0,0|4,0,0]=4 196 B16R2.2256 c1cncc(c1)CNCc2cncnc2 270004a_100000210453_100000749868 [0,0,0,0,0,0|4,0,0]=4 197 B16R2.2256 c1cncc(c1)CNCc2cncnc2 270004a_100011243677_100000209961 [0,0,0,0,0,0|4,0,0]=4 198 B16R2.2256 c1cncc(c1)CSCc2cccnc2 62a_100000741622_100000741622 [0,0,0,0,0,0|2,1,0]=3 199 B16R2.2256 c1cncc(c1)CSCc2cccnn2 62a_100000741622_100016990269 [0,0,0,0,0,0|3,1,0]=4 200 B16R2.2256 c1cncc(c1)CSCc2cccnn2 62a_100016990269_100000741622 [0,0,0,0,0,0|3,1,0]=4 201 B16R2.2256 c1cncc(c1)CSCc2ccncc2 62a_100000741622_100015193705 [0,0,0,0,0,0|2,1,0]=3 202 B16R2.2256 c1cncc(c1)CSCc2ccncc2 62a_100015193705_100000741622 [0,0,0,0,0,0|2,1,0]=3 203 B16R2.2256 c1cncc(c1)CSCc2cnccn2 62a_100000741622_100016995436 [0,0,0,0,0,0|3,1,0]=4 204 B16R2.2256 c1cncc(c1)CSCc2cnccn2 62a_100016995436_100000741622 [0,0,0,0,0,0|3,1,0]=4 205 B16R2.2256 c1cncc(c1)CSCc2cncnc2 62a_100000741622_100015196519 [0,0,0,0,0,0|3,1,0]=4 206 B16R2.2256 c1cncc(c1)CSCc2cncnc2 62a_100015196519_100000741622 [0,0,0,0,0,0|3,1,0]=4 207 B16R2.2256 c1cncc(c1)OCCc2ccncc2 7a_100000210849_100000723409 [0,0,0,0,0,0|4,0,0]=4 208 B16R2.2256 c1cncc(c1)SCCc2ccncc2 62a_100000210063_100000723409 [0,0,0,0,0,0|4,0,0]=4 209 B16R2.2256 c1cncc(c1)SCCc2ccncc2 62a_100000723409_100000210063 [0,0,0,0,0,0|4,0,0]=4 210 B16R2.2256 c1cnnc(c1)CNCc2ccncc2 2230a_100159270163_100015193705 [0,0,0,0,0,0|4,0,0]=4 211 B16R2.2256 c1cnnc(c1)CSCc2ccncc2 62a_100015193705_100016990269 [0,0,0,0,0,0|3,1,0]=4 212 B16R2.2256 c1cnnc(c1)CSCc2ccncc2 62a_100016990269_100015193705 [0,0,0,0,0,0|3,1,0]=4 213 B17R2.143 CC(Cc1ccccc1)Nc2ccccc2 34a_100000106764_200011218536 [0,1,0,0,0,0|2,0,0]=3 214 B17R2.143 CC(Cc1ccccc1)Oc2ccccc2 34a_100000210340_200011218536 [0,1,0,0,0,0|2,0,0]=3 215 B17R2.143 CC(Cc1ccccc1)Oc2ccccc2 7a_100000210340_200011218536 [0,1,0,0,0,0|2,0,0]=3 216 B17R2.143 CC(Cc1ccccc1)Oc2cccnc2 34a_100000210849_200011218536 [0,1,0,0,0,0|3,0,0]=4 217 B17R2.143 CC(Cc1ccccc1)Oc2cccnc2 7a_100000210849_200011218536 [0,1,0,0,0,0|3,0,0]=4 218 B17R2.143 CC(Cc1ccccc1)Oc2ccncc2 34a_100000212176_200011218536 [0,1,0,0,0,0|3,0,0]=4 219 B17R2.143 CC(Cc1ccccc1)Sc2ccccc2 62a_100000719477_200011218536 [0,1,0,0,0,0|2,0,0]=3 220 B17R2.143 CC(Cc1ccccc1)Sc2ccccc2 62a_200011218536_100000041952 [0,1,0,0,0,0|2,0,0]=3 221 B17R2.143 CC(Cc1ccccc1)Sc2ccccn2 62a_100011216584_200011218536 [0,1,0,0,0,0|3,0,0]=4 222 B17R2.143 CC(Cc1ccccc1)Sc2ccccn2 62a_200011218536_100011216584 [0,1,0,0,0,0|3,0,0]=4 223 B17R2.143 CC(Cc1ccccc1)Sc2cccnc2 62a_100000210063_200011218536 [0,1,0,0,0,0|3,0,0]=4 224 B17R2.143 CC(Cc1ccccc1)Sc2cccnc2 62a_200011218536_100000210063 [0,1,0,0,0,0|3,0,0]=4 225 B17R2.143 CC(Cc1ccccc1)Sc2ccncc2 62a_100000728582_200011218536 [0,1,0,0,0,0|3,0,0]=4 226 B17R2.143 CC(Cc1ccccc1)Sc2ccncc2 62a_200011218536_100000728582 [0,1,0,0,0,0|3,0,0]=4 227 B17R2.143 CN(Cc1ccccc1)Cc2ccccc2 2230a_100000185734_200000210301 [0,1,0,0,0,0|1,0,0]=2 228 B17R2.143 CN(Cc1ccccc1)Cc2ccccc2 2230a_100000186898_100015291786 [0,1,0,0,0,0|1,0,0]=2 229 B17R2.143 CN(Cc1ccccc1)Cc2ccccc2 269982a_100000185734_200000210301 [0,1,0,0,0,0|1,0,0]=2 230 B17R2.143 CN(Cc1ccccc1)Cc2ccccc2 269982a_100000186898_100000211182 [0,1,0,0,0,0|1,0,0]=2 231 B17R2.143 CN(Cc1ccccc1)Cc2ccccc2 270004a_100000186898_100015611070 [0,1,0,0,0,0|1,0,0]=2 232 B17R2.143 CN(Cc1ccccc1)Cc2ccccn2 2230a_100000186898_100000721315 [0,1,0,0,0,0|2,0,0]=3 233 B17R2.143 CN(Cc1ccccc1)Cc2ccccn2 2230a_100000207498_100015291786 [0,1,0,0,0,0|2,0,0]=3 234 B17R2.143 CN(Cc1ccccc1)Cc2ccccn2 269982a_100000186898_100000721315 [0,1,0,0,0,0|2,0,0]=3 235 B17R2.143 CN(Cc1ccccc1)Cc2ccccn2 269982a_100000207498_100000211182 [0,1,0,0,0,0|2,0,0]=3 236 B17R2.143 CN(Cc1ccccc1)Cc2ccccn2 270004a_100000186898_100000209966 [0,1,0,0,0,0|2,0,0]=3 237 B17R2.143 CN(Cc1ccccc1)Cc2ccccn2 270004a_100000207498_100015611070 [0,1,0,0,0,0|2,0,0]=3 238 B17R2.143 CN(Cc1ccccc1)Cc2cccnc2 2230a_100000184577_100015291786 [0,1,0,0,0,0|2,0,0]=3 239 B17R2.143 CN(Cc1ccccc1)Cc2cccnc2 2230a_100000186898_100000741622 [0,1,0,0,0,0|2,0,0]=3 240 B17R2.143 CN(Cc1ccccc1)Cc2cccnc2 269982a_100000184577_100000211182 [0,1,0,0,0,0|2,0,0]=3 241 B17R2.143 CN(Cc1ccccc1)Cc2cccnc2 269982a_100000186898_100000733263 [0,1,0,0,0,0|2,0,0]=3 242 B17R2.143 CN(Cc1ccccc1)Cc2cccnc2 270004a_100000184577_100015611070 [0,1,0,0,0,0|2,0,0]=3 243 B17R2.143 CN(Cc1ccccc1)Cc2cccnc2 270004a_100000186898_100000209961 [0,1,0,0,0,0|2,0,0]=3 244 B17R2.143 CN(Cc1ccccc1)Cc2cccnn2 2230a_100000186898_100016990269 [0,1,0,0,0,0|3,0,0]=4 245 B17R2.143 CN(Cc1ccccc1)Cc2ccncc2 2230a_100000186898_100015193705 [0,1,0,0,0,0|2,0,0]=3 246 B17R2.143 CN(Cc1ccccc1)Cc2ccncc2 2230a_100000187231_100015291786 [0,1,0,0,0,0|2,0,0]=3 247 B17R2.143 CN(Cc1ccccc1)Cc2ccncc2 269982a_100000186794_200000210301 [0,1,0,0,0,0|2,0,0]=3 248 B17R2.143 CN(Cc1ccccc1)Cc2ccncc2 269982a_100000186898_100015193705 [0,1,0,0,0,0|2,0,0]=3 249 B17R2.143 CN(Cc1ccccc1)Cc2ccncc2 269982a_100000187231_100000211182 [0,1,0,0,0,0|2,0,0]=3 250 B17R2.143 CN(Cc1ccccc1)Cc2ccncc2 270004a_100000187231_100015611070 [0,1,0,0,0,0|2,0,0]=3 251 B17R2.143 CN(Cc1ccccc1)Cc2ccnnc2 270004a_100000186898_100011934578 [0,1,0,0,0,0|3,0,0]=4 252 B17R2.143 CN(Cc1ccccc1)Cc2cnccn2 2230a_100000186898_100016995436 [0,1,0,0,0,0|3,0,0]=4 253 B17R2.143 CN(Cc1ccccc1)Cc2cnccn2 2230a_100011269079_100015291786 [0,1,0,0,0,0|3,0,0]=4 254 B17R2.143 CN(Cc1ccccc1)Cc2cnccn2 269982a_100000186898_100016995436 [0,1,0,0,0,0|3,0,0]=4 255 B17R2.143 CN(Cc1ccccc1)Cc2cnccn2 269982a_100011269079_100000211182 [0,1,0,0,0,0|3,0,0]=4 256 B17R2.143 CN(Cc1ccccc1)Cc2cnccn2 270004a_100000186898_100000749867 [0,1,0,0,0,0|3,0,0]=4 257 B17R2.143 CN(Cc1ccccc1)Cc2cnccn2 270004a_100011269079_100015611070 [0,1,0,0,0,0|3,0,0]=4 258 B17R2.143 CN(Cc1ccccc1)Cc2cncnc2 2230a_100000186898_100015196519 [0,1,0,0,0,0|3,0,0]=4 259 B17R2.143 CN(Cc1ccccc1)Cc2cncnc2 269982a_100000186898_100016991940 [0,1,0,0,0,0|3,0,0]=4 260 B17R2.143 CN(Cc1ccccc1)Cc2cncnc2 270004a_100000186898_100000749868 [0,1,0,0,0,0|3,0,0]=4 261 B17R2.143 CN(Cc1ccccc1)Cc2ncccn2 2230a_100000186898_100000703007 [0,1,0,0,0,0|3,0,0]=4 262 B17R2.143 CN(Cc1ccccc1)Cc2ncccn2 2230a_100025716638_100015291786 [0,1,0,0,0,0|3,0,0]=4 263 B17R2.143 CN(Cc1ccccc1)Cc2ncccn2 269982a_100000186898_100000703007 [0,1,0,0,0,0|3,0,0]=4 264 B17R2.143 CN(Cc1ccccc1)Cc2ncccn2 269982a_100025716638_100000211182 [0,1,0,0,0,0|3,0,0]=4 265 B17R2.143 CN(Cc1ccccc1)Cc2ncccn2 270004a_100000186898_100011532527 [0,1,0,0,0,0|3,0,0]=4 266 B17R2.143 CN(Cc1ccccn1)Cc2ccccn2 2230a_100000200734_200000210301 [0,1,0,0,0,0|3,0,0]=4 267 B17R2.143 CN(Cc1ccccn1)Cc2ccccn2 2230a_100000207498_100000721315 [0,1,0,0,0,0|3,0,0]=4 268 B17R2.143 CN(Cc1ccccn1)Cc2ccccn2 269982a_100000200734_200000210301 [0,1,0,0,0,0|3,0,0]=4 269 B17R2.143 CN(Cc1ccccn1)Cc2ccccn2 269982a_100000207498_100000721315 [0,1,0,0,0,0|3,0,0]=4 270 B17R2.143 CN(Cc1ccccn1)Cc2ccccn2 270004a_100000207498_100000209966 [0,1,0,0,0,0|3,0,0]=4 271 B17R2.143 CN(Cc1cccnc1)Cc2ccccn2 2230a_100000184577_100000721315 [0,1,0,0,0,0|3,0,0]=4 272 B17R2.143 CN(Cc1cccnc1)Cc2ccccn2 2230a_100000200736_200000210301 [0,1,0,0,0,0|3,0,0]=4 273 B17R2.143 CN(Cc1cccnc1)Cc2ccccn2 2230a_100000207498_100000741622 [0,1,0,0,0,0|3,0,0]=4 274 B17R2.143 CN(Cc1cccnc1)Cc2ccccn2 269982a_100000184577_100000721315 [0,1,0,0,0,0|3,0,0]=4 275 B17R2.143 CN(Cc1cccnc1)Cc2ccccn2 269982a_100000200736_200000210301 [0,1,0,0,0,0|3,0,0]=4 276 B17R2.143 CN(Cc1cccnc1)Cc2ccccn2 269982a_100000207498_100000733263 [0,1,0,0,0,0|3,0,0]=4 277 B17R2.143 CN(Cc1cccnc1)Cc2ccccn2 270004a_100000184577_100000209966 [0,1,0,0,0,0|3,0,0]=4 278 B17R2.143 CN(Cc1cccnc1)Cc2ccccn2 270004a_100000207498_100000209961 [0,1,0,0,0,0|3,0,0]=4 279 B17R2.143 CN(Cc1cccnc1)Cc2cccnc2 2230a_100000184577_100000741622 [0,1,0,0,0,0|3,0,0]=4 280 B17R2.143 CN(Cc1cccnc1)Cc2cccnc2 2230a_200000185688_200000210301 [0,1,0,0,0,0|3,0,0]=4 281 B17R2.143 CN(Cc1cccnc1)Cc2cccnc2 269982a_100000184577_100000733263 [0,1,0,0,0,0|3,0,0]=4 282 B17R2.143 CN(Cc1cccnc1)Cc2cccnc2 269982a_200000185688_200000210301 [0,1,0,0,0,0|3,0,0]=4 283 B17R2.143 CN(Cc1cccnc1)Cc2cccnc2 270004a_100000184577_100000209961 [0,1,0,0,0,0|3,0,0]=4 284 B17R2.143 CN(Cc1ccncc1)Cc2ccccn2 2230a_100000187231_100000721315 [0,1,0,0,0,0|3,0,0]=4 285 B17R2.143 CN(Cc1ccncc1)Cc2ccccn2 2230a_100000207498_100015193705 [0,1,0,0,0,0|3,0,0]=4 286 B17R2.143 CN(Cc1ccncc1)Cc2ccccn2 269982a_100000187231_100000721315 [0,1,0,0,0,0|3,0,0]=4 287 B17R2.143 CN(Cc1ccncc1)Cc2ccccn2 269982a_100000207498_100015193705 [0,1,0,0,0,0|3,0,0]=4 288 B17R2.143 CN(Cc1ccncc1)Cc2ccccn2 270004a_100000187231_100000209966 [0,1,0,0,0,0|3,0,0]=4 289 B17R2.143 CN(Cc1ccncc1)Cc2cccnc2 2230a_100000184577_100015193705 [0,1,0,0,0,0|3,0,0]=4 290 B17R2.143 CN(Cc1ccncc1)Cc2cccnc2 2230a_100000187231_100000741622 [0,1,0,0,0,0|3,0,0]=4 291 B17R2.143 CN(Cc1ccncc1)Cc2cccnc2 269982a_100000184577_100015193705 [0,1,0,0,0,0|3,0,0]=4 292 B17R2.143 CN(Cc1ccncc1)Cc2cccnc2 269982a_100000187231_100000733263 [0,1,0,0,0,0|3,0,0]=4 293 B17R2.143 CN(Cc1ccncc1)Cc2cccnc2 270004a_100000187231_100000209961 [0,1,0,0,0,0|3,0,0]=4 294 B17R2.143 CN(Cc1ccncc1)Cc2ccncc2 2230a_100000187231_100015193705 [0,1,0,0,0,0|3,0,0]=4 295 B17R2.143 CN(Cc1ccncc1)Cc2ccncc2 269982a_100000187231_100015193705 [0,1,0,0,0,0|3,0,0]=4 296 B17R2.143 CN(Cc1ccncc1)Cc2ccncc2 269982a_200000200768_200000210301 [0,1,0,0,0,0|3,0,0]=4 297 B17R2.143 O=C(C[n+]1ccccc1)Nc2ccccc2 11a_100000106764_200000086051 [0,1,0,0,0,0|3,0,0]=4 298 B17R2.143 O=C(C[n+]1ccccc1)Nc2ccccc2 22a_100000106764_200000086051 [0,1,0,0,0,0|3,0,0]=4 299 B17R2.143 O=C(C[n+]1ccccc1)Nc2ccccc2 527a_100000106764_200000086051 [0,1,0,0,0,0|3,0,0]=4 300 B17R2.143 O=C(Cc1ccccc1)C[n+]2ccccc2 1458a_200000086051_100015291786 [0,1,0,0,0,0|2,0,0]=3 301 B17R2.143 O=C(Cc1ccccc1)Cc2ccccn2 1458a_100000233486_100015291786 [0,1,0,0,0,0|2,0,0]=3 302 B17R2.143 O=C(Cc1ccccc1)Cc2cccnc2 1458a_100000737805_100015291786 [0,1,0,0,0,0|2,0,0]=3 303 B17R2.143 O=C(Cc1ccccc1)Cc2cncnc2 1458a_100000721575_100015291786 [0,1,0,0,0,0|3,0,0]=4 304 B17R2.143 O=C(Cc1ccccn1)C[n+]2ccccc2 1458a_200000086051_100000721315 [0,1,0,0,0,0|3,0,0]=4 305 B17R2.143 O=C(Cc1ccccn1)Cc2ccccn2 1458a_100000233486_100000721315 [0,1,0,0,0,0|3,0,0]=4 306 B17R2.143 O=C(Cc1ccccn1)Nc2ccccc2 11a_100000106764_100000233486 [0,1,0,0,0,0|3,0,0]=4 307 B17R2.143 O=C(Cc1ccccn1)Nc2ccccc2 22a_100000106764_100000233486 [0,1,0,0,0,0|3,0,0]=4 308 B17R2.143 O=C(Cc1cccnc1)C[n+]2ccccc2 1458a_200000086051_100000733263 [0,1,0,0,0,0|3,0,0]=4 309 B17R2.143 O=C(Cc1cccnc1)Cc2ccccn2 1458a_100000233486_100000733263 [0,1,0,0,0,0|3,0,0]=4 310 B17R2.143 O=C(Cc1cccnc1)Cc2ccccn2 1458a_100000737805_100000721315 [0,1,0,0,0,0|3,0,0]=4 311 B17R2.143 O=C(Cc1cccnc1)Cc2cccnc2 1458a_100000737805_100000733263 [0,1,0,0,0,0|3,0,0]=4 312 B17R2.143 O=C(Cc1cccnc1)Nc2ccccc2 11a_100000106764_100000737805 [0,1,0,0,0,0|3,0,0]=4 313 B17R2.143 O=C(Cc1cccnc1)Nc2ccccc2 22a_100000106764_100000737805 [0,1,0,0,0,0|3,0,0]=4 314 B17R2.143 O=C(Cc1cccnc1)Nc2ccccc2 527a_100000106764_100000737805 [0,1,0,0,0,0|3,0,0]=4 315 B17R2.143 O=C(Cc1ccncc1)C[n+]2ccccc2 1458a_200000086051_100000705612 [0,1,0,0,0,0|3,0,0]=4 316 B17R2.143 O=C(Cc1ccncc1)Cc2ccccn2 1458a_100000233486_100000705612 [0,1,0,0,0,0|3,0,0]=4 317 B17R2.143 O=C(Cc1ccncc1)Cc2cccnc2 1458a_100000737805_100000705612 [0,1,0,0,0,0|3,0,0]=4 318 B17R2.143 O=C(Cc1ccncc1)Nc2ccccc2 11a_100000106764_100011201483 [0,1,0,0,0,0|3,0,0]=4 319 B17R2.143 O=C(Cc1ccncc1)Nc2ccccc2 22a_100000106764_100011201483 [0,1,0,0,0,0|3,0,0]=4 320 B17R2.143 [13CH3]N(Cc1ccccc1)Cc2ccccc2 2230a_100000185734_200025704644 [0,1,0,0,0,0|1,0,0]=2 321 B17R2.143 [13CH3]N(Cc1ccccc1)Cc2ccccc2 269982a_100000185734_200025704644 [0,1,0,0,0,0|1,0,0]=2 322 B17R2.143 [13CH3]N(Cc1ccccc1)Cc2ccncc2 269982a_100000186794_200025704644 [0,1,0,0,0,0|2,0,0]=3 323 B17R2.143 [13CH3]N(Cc1ccccn1)Cc2ccccn2 2230a_100000200734_200025704644 [0,1,0,0,0,0|3,0,0]=4 324 B17R2.143 [13CH3]N(Cc1ccccn1)Cc2ccccn2 269982a_100000200734_200025704644 [0,1,0,0,0,0|3,0,0]=4 325 B17R2.143 [13CH3]N(Cc1cccnc1)Cc2ccccn2 2230a_100000200736_200025704644 [0,1,0,0,0,0|3,0,0]=4 326 B17R2.143 [13CH3]N(Cc1cccnc1)Cc2ccccn2 269982a_100000200736_200025704644 [0,1,0,0,0,0|3,0,0]=4 327 B17R2.143 [13CH3]N(Cc1cccnc1)Cc2cccnc2 2230a_200000185688_200025704644 [0,1,0,0,0,0|3,0,0]=4 328 B17R2.143 [13CH3]N(Cc1cccnc1)Cc2cccnc2 269982a_200000185688_200025704644 [0,1,0,0,0,0|3,0,0]=4 329 B17R2.143 [13CH3]N(Cc1ccncc1)Cc2ccncc2 269982a_200000200768_200025704644 [0,1,0,0,0,0|3,0,0]=4 330 B17R2.216 Brc1ccc(cc1)C=CCc2ccccc2 271570a_200016263579_100000752885 [0,1,0,0,0,0|1,0,1]=3 331 B17R2.216 Brc1ccc(cc1)C=NNc2ccccc2 4a_100015195140_100000186029 [0,1,0,0,0,0|2,0,1]=4 332 B17R2.216 Brc1ccc(cc1)CCNc2ccccc2 34a_100000106764_100011740612 [0,1,0,0,0,0|2,0,0]=3 333 B17R2.216 Brc1ccc(cc1)CCOc2ccccc2 34a_100000210340_100011740612 [0,1,0,0,0,0|2,0,0]=3 334 B17R2.216 Brc1ccc(cc1)CCOc2ccccc2 7a_100000210340_100011740612 [0,1,0,0,0,0|2,0,0]=3 335 B17R2.216 Brc1ccc(cc1)CCOc2cccnc2 34a_100000210849_100011740612 [0,1,0,0,0,0|3,0,0]=4 336 B17R2.216 Brc1ccc(cc1)CCOc2cccnc2 7a_100000210849_100011740612 [0,1,0,0,0,0|3,0,0]=4 337 B17R2.216 Brc1ccc(cc1)CCOc2ccncc2 34a_100000212176_100011740612 [0,1,0,0,0,0|3,0,0]=4 338 B17R2.216 Brc1ccc(cc1)CCSc2ccccc2 62a_100000719477_100011740612 [0,1,0,0,0,0|2,0,0]=3 339 B17R2.216 Brc1ccc(cc1)CCSc2ccccc2 62a_100011740612_100000041952 [0,1,0,0,0,0|2,0,0]=3 340 B17R2.216 Brc1ccc(cc1)CCSc2ccccn2 62a_100011216584_100011740612 [0,1,0,0,0,0|3,0,0]=4 341 B17R2.216 Brc1ccc(cc1)CCSc2ccccn2 62a_100011740612_100011216584 [0,1,0,0,0,0|3,0,0]=4 342 B17R2.216 Brc1ccc(cc1)CCSc2cccnc2 62a_100000210063_100011740612 [0,1,0,0,0,0|3,0,0]=4 343 B17R2.216 Brc1ccc(cc1)CCSc2cccnc2 62a_100011740612_100000210063 [0,1,0,0,0,0|3,0,0]=4 344 B17R2.216 Brc1ccc(cc1)CCSc2ccncc2 62a_100000728582_100011740612 [0,1,0,0,0,0|3,0,0]=4 345 B17R2.216 Brc1ccc(cc1)CCSc2ccncc2 62a_100011740612_100000728582 [0,1,0,0,0,0|3,0,0]=4 346 B17R2.216 Brc1ccc(cc1)CNCc2ccccc2 207a_100000174875_100015611070 [0,1,0,0,0,0|1,0,0]=2 347 B17R2.216 Brc1ccc(cc1)CNCc2ccccc2 207a_100015324214_100000186029 [0,1,0,0,0,0|1,0,0]=2 348 B17R2.216 Brc1ccc(cc1)CNCc2ccccc2 2230a_100000174875_100015291786 [0,1,0,0,0,0|1,0,0]=2 349 B17R2.216 Brc1ccc(cc1)CNCc2ccccc2 2230a_100015324214_100011217064 [0,1,0,0,0,0|1,0,0]=2 350 B17R2.216 Brc1ccc(cc1)CNCc2ccccc2 270004a_100000174875_100015611070 [0,1,0,0,0,0|1,0,0]=2 351 B17R2.216 Brc1ccc(cc1)CNCc2ccccc2 270004a_100015324214_100000186029 [0,1,0,0,0,0|1,0,0]=2 352 B17R2.216 Brc1ccc(cc1)CNCc2ccccc2 34a_100000174875_100015291786 [0,1,0,0,0,0|1,0,0]=2 353 B17R2.216 Brc1ccc(cc1)CNCc2ccccc2 34a_100015324214_100000189115 [0,1,0,0,0,0|1,0,0]=2 354 B17R2.216 Brc1ccc(cc1)CNCc2ccccn2 207a_100000174875_100000209966 [0,1,0,0,0,0|2,0,0]=3 355 B17R2.216 Brc1ccc(cc1)CNCc2ccccn2 2230a_100000174875_100000721315 [0,1,0,0,0,0|2,0,0]=3 356 B17R2.216 Brc1ccc(cc1)CNCc2ccccn2 270004a_100000174875_100000209966 [0,1,0,0,0,0|2,0,0]=3 357 B17R2.216 Brc1ccc(cc1)CNCc2ccccn2 270004a_100000210449_100000186029 [0,1,0,0,0,0|2,0,0]=3 358 B17R2.216 Brc1ccc(cc1)CNCc2ccccn2 34a_100000174875_100000721315 [0,1,0,0,0,0|2,0,0]=3 359 B17R2.216 Brc1ccc(cc1)CNCc2cccnc2 207a_100000174875_100000209961 [0,1,0,0,0,0|2,0,0]=3 360 B17R2.216 Brc1ccc(cc1)CNCc2cccnc2 207a_100000210453_100000186029 [0,1,0,0,0,0|2,0,0]=3 361 B17R2.216 Brc1ccc(cc1)CNCc2cccnc2 2230a_100000174875_100000741622 [0,1,0,0,0,0|2,0,0]=3 362 B17R2.216 Brc1ccc(cc1)CNCc2cccnc2 270004a_100000174875_100000209961 [0,1,0,0,0,0|2,0,0]=3 363 B17R2.216 Brc1ccc(cc1)CNCc2cccnc2 270004a_100000210453_100000186029 [0,1,0,0,0,0|2,0,0]=3 364 B17R2.216 Brc1ccc(cc1)CNCc2cccnc2 34a_100000174875_100000733263 [0,1,0,0,0,0|2,0,0]=3 365 B17R2.216 Brc1ccc(cc1)CNCc2cccnn2 2230a_100000174875_100016990269 [0,1,0,0,0,0|3,0,0]=4 366 B17R2.216 Brc1ccc(cc1)CNCc2cccnn2 2230a_100159270163_100011217064 [0,1,0,0,0,0|3,0,0]=4 367 B17R2.216 Brc1ccc(cc1)CNCc2cccnn2 34a_100000174875_100016990269 [0,1,0,0,0,0|3,0,0]=4 368 B17R2.216 Brc1ccc(cc1)CNCc2ccncc2 207a_100000174875_100000186114 [0,1,0,0,0,0|2,0,0]=3 369 B17R2.216 Brc1ccc(cc1)CNCc2ccncc2 2230a_100000174875_100015193705 [0,1,0,0,0,0|2,0,0]=3 370 B17R2.216 Brc1ccc(cc1)CNCc2ccnnc2 270004a_100000174875_100011934578 [0,1,0,0,0,0|3,0,0]=4 371 B17R2.216 Brc1ccc(cc1)CNCc2cnccn2 2230a_100000174875_100016995436 [0,1,0,0,0,0|3,0,0]=4 372 B17R2.216 Brc1ccc(cc1)CNCc2cnccn2 270004a_100000174875_100000749867 [0,1,0,0,0,0|3,0,0]=4 373 B17R2.216 Brc1ccc(cc1)CNCc2cnccn2 34a_100000174875_100016995436 [0,1,0,0,0,0|3,0,0]=4 374 B17R2.216 Brc1ccc(cc1)CNCc2cncnc2 207a_100011243677_100000186029 [0,1,0,0,0,0|3,0,0]=4 375 B17R2.216 Brc1ccc(cc1)CNCc2cncnc2 2230a_100000174875_100015196519 [0,1,0,0,0,0|3,0,0]=4 376 B17R2.216 Brc1ccc(cc1)CNCc2cncnc2 2230a_100011243677_100011217064 [0,1,0,0,0,0|3,0,0]=4 377 B17R2.216 Brc1ccc(cc1)CNCc2cncnc2 270004a_100000174875_100000749868 [0,1,0,0,0,0|3,0,0]=4 378 B17R2.216 Brc1ccc(cc1)CNCc2cncnc2 270004a_100011243677_100000186029 [0,1,0,0,0,0|3,0,0]=4 379 B17R2.216 Brc1ccc(cc1)CNCc2cncnc2 34a_100000174875_100015196519 [0,1,0,0,0,0|3,0,0]=4 380 B17R2.216 Brc1ccc(cc1)CNCc2ncccn2 2230a_100000174875_100000703007 [0,1,0,0,0,0|3,0,0]=4 381 B17R2.216 Brc1ccc(cc1)CNCc2ncccn2 270004a_100000174875_100011532527 [0,1,0,0,0,0|3,0,0]=4 382 B17R2.216 Brc1ccc(cc1)CNCc2ncccn2 34a_100000174875_100000703007 [0,1,0,0,0,0|3,0,0]=4 383 B17R2.216 Brc1ccc(cc1)COCc2ccccc2 34a_100000210790_100000189115 [0,1,0,0,0,0|0,0,0]=1 384 B17R2.216 Brc1ccc(cc1)COCc2ccccc2 34a_100000695286_100015291786 [0,1,0,0,0,0|0,0,0]=1 385 B17R2.216 Brc1ccc(cc1)COCc2ccccc2 7a_100000210790_100011217064 [0,1,0,0,0,0|0,0,0]=1 386 B17R2.216 Brc1ccc(cc1)COCc2ccccn2 34a_100000695286_100000721315 [0,1,0,0,0,0|1,0,0]=2 387 B17R2.216 Brc1ccc(cc1)COCc2cccnc2 34a_100000695286_100000733263 [0,1,0,0,0,0|1,0,0]=2 388 B17R2.216 Brc1ccc(cc1)COCc2cccnn2 34a_100000695286_100016990269 [0,1,0,0,0,0|2,0,0]=3 389 B17R2.216 Brc1ccc(cc1)COCc2cnccn2 34a_100000695286_100016995436 [0,1,0,0,0,0|2,0,0]=3 390 B17R2.216 Brc1ccc(cc1)COCc2cncnc2 34a_100000695286_100015196519 [0,1,0,0,0,0|2,0,0]=3 391 B17R2.216 Brc1ccc(cc1)COCc2ncccn2 34a_100000695286_100000703007 [0,1,0,0,0,0|2,0,0]=3 392 B17R2.216 Brc1ccc(cc1)CSCc2ccccc2 62a_100000189115_100015291786 [0,1,0,0,0,0|0,1,0]=2 393 B17R2.216 Brc1ccc(cc1)CSCc2ccccc2 62a_100000211182_100000189115 [0,1,0,0,0,0|0,1,0]=2 394 B17R2.216 Brc1ccc(cc1)CSCc2ccccn2 62a_100000189115_100000721315 [0,1,0,0,0,0|1,1,0]=3 395 B17R2.216 Brc1ccc(cc1)CSCc2ccccn2 62a_100000721315_100000189115 [0,1,0,0,0,0|1,1,0]=3 396 B17R2.216 Brc1ccc(cc1)CSCc2cccnc2 62a_100000189115_100000741622 [0,1,0,0,0,0|1,1,0]=3 397 B17R2.216 Brc1ccc(cc1)CSCc2cccnc2 62a_100000741622_100000189115 [0,1,0,0,0,0|1,1,0]=3 398 B17R2.216 Brc1ccc(cc1)CSCc2cccnn2 62a_100000189115_100016990269 [0,1,0,0,0,0|2,1,0]=4 399 B17R2.216 Brc1ccc(cc1)CSCc2cccnn2 62a_100016990269_100000189115 [0,1,0,0,0,0|2,1,0]=4 400 B17R2.216 Brc1ccc(cc1)CSCc2ccncc2 62a_100000189115_100015193705 [0,1,0,0,0,0|1,1,0]=3 401 B17R2.216 Brc1ccc(cc1)CSCc2ccncc2 62a_100015193705_100000189115 [0,1,0,0,0,0|1,1,0]=3 402 B17R2.216 Brc1ccc(cc1)CSCc2cnccn2 62a_100000189115_100016995436 [0,1,0,0,0,0|2,1,0]=4 403 B17R2.216 Brc1ccc(cc1)CSCc2cnccn2 62a_100016995436_100000189115 [0,1,0,0,0,0|2,1,0]=4 404 B17R2.216 Brc1ccc(cc1)CSCc2cncnc2 62a_100000189115_100015196519 [0,1,0,0,0,0|2,1,0]=4 405 B17R2.216 Brc1ccc(cc1)CSCc2cncnc2 62a_100015196519_100000189115 [0,1,0,0,0,0|2,1,0]=4 406 B17R2.216 Brc1ccc(cc1)CSCc2ncccn2 62a_100000189115_100000703007 [0,1,0,0,0,0|2,1,0]=4 407 B17R2.216 Brc1ccc(cc1)CSCc2ncccn2 62a_100000703007_100000189115 [0,1,0,0,0,0|2,1,0]=4 408 B17R2.216 Brc1ccc(cc1)NCCc2ccccc2 2230a_100000210018_100000765856 [0,1,0,0,0,0|2,0,0]=3 409 B17R2.216 Brc1ccc(cc1)NCCc2ccccc2 34a_100000210018_100000765856 [0,1,0,0,0,0|2,0,0]=3 410 B17R2.216 Brc1ccc(cc1)NCCc2ccccn2 2230a_100000210018_100015183660 [0,1,0,0,0,0|3,0,0]=4 411 B17R2.216 Brc1ccc(cc1)NCCc2cccnc2 2230a_100000210018_200011713674 [0,1,0,0,0,0|3,0,0]=4 412 B17R2.216 Brc1ccc(cc1)NCCc2ccncc2 2230a_100000210018_100000723409 [0,1,0,0,0,0|3,0,0]=4 413 B17R2.216 Brc1ccc(cc1)NCSc2ccccc2 2230a_100000210018_100011218342 [0,1,0,0,0,0|3,0,0]=4 414 B17R2.216 Brc1ccc(cc1)NN=Cc2ccccc2 4a_100000735608_100015611070 [0,1,0,0,0,0|2,0,1]=4 415 B17R2.216 Brc1ccc(cc1)OCCc2ccccc2 34a_100000185759_100000765856 [0,1,0,0,0,0|2,0,0]=3 416 B17R2.216 Brc1ccc(cc1)OCCc2ccccc2 7a_100000185759_100000765856 [0,1,0,0,0,0|2,0,0]=3 417 B17R2.216 Brc1ccc(cc1)OCCc2ccccn2 7a_100000185759_100015183660 [0,1,0,0,0,0|3,0,0]=4 418 B17R2.216 Brc1ccc(cc1)OCCc2cccnc2 7a_100000185759_200011713674 [0,1,0,0,0,0|3,0,0]=4 419 B17R2.216 Brc1ccc(cc1)OCCc2ccncc2 7a_100000185759_100000723409 [0,1,0,0,0,0|3,0,0]=4 420 B17R2.216 Brc1ccc(cc1)SCCc2ccccc2 62a_100000752885_100011218657 [0,1,0,0,0,0|2,0,0]=3 421 B17R2.216 Brc1ccc(cc1)SCCc2ccccc2 62a_100000765856_100000752885 [0,1,0,0,0,0|2,0,0]=3 422 B17R2.216 Brc1ccc(cc1)SCCc2ccccn2 62a_100000752885_100015183660 [0,1,0,0,0,0|3,0,0]=4 423 B17R2.216 Brc1ccc(cc1)SCCc2ccccn2 62a_100015183660_100000752885 [0,1,0,0,0,0|3,0,0]=4 424 B17R2.216 Brc1ccc(cc1)SCCc2cccnc2 62a_100000752885_200011713674 [0,1,0,0,0,0|3,0,0]=4 425 B17R2.216 Brc1ccc(cc1)SCCc2cccnc2 62a_200011713674_100000752885 [0,1,0,0,0,0|3,0,0]=4 426 B17R2.216 Brc1ccc(cc1)SCCc2ccncc2 62a_100000723409_100000752885 [0,1,0,0,0,0|3,0,0]=4 427 B17R2.216 Brc1ccc(cc1)SCCc2ccncc2 62a_100000752885_100000723409 [0,1,0,0,0,0|3,0,0]=4 428 B17R2.216 Brc1ccc(cc1)SCSc2ccccc2 62a_100000752885_100011218342 [0,1,0,0,0,0|3,0,0]=4 429 B17R2.216 Brc1ccc(cc1)SCSc2ccccc2 62a_100011218342_100000752885 [0,1,0,0,0,0|3,0,0]=4 430 B17R2.216 Brc1ccc(cn1)C=CCc2ccccc2 271570a_200016263579_100009814638 [0,1,0,0,0,0|2,0,1]=4 431 B17R2.216 Brc1ccc(cn1)CNCc2ccccc2 207a_100009817727_100015611070 [0,1,0,0,0,0|2,0,0]=3 432 B17R2.216 Brc1ccc(cn1)CNCc2ccccc2 2230a_100009817727_100015291786 [0,1,0,0,0,0|2,0,0]=3 433 B17R2.216 Brc1ccc(cn1)CNCc2ccccc2 2230a_100015324214_100009831999 [0,1,0,0,0,0|2,0,0]=3 434 B17R2.216 Brc1ccc(cn1)CNCc2ccccc2 270004a_100009817727_100015611070 [0,1,0,0,0,0|2,0,0]=3 435 B17R2.216 Brc1ccc(cn1)CNCc2ccccc2 34a_100009817727_100015291786 [0,1,0,0,0,0|2,0,0]=3 436 B17R2.216 Brc1ccc(cn1)CNCc2ccccc2 34a_100015324214_100009831999 [0,1,0,0,0,0|2,0,0]=3 437 B17R2.216 Brc1ccc(cn1)CNCc2ccccn2 207a_100009817727_100000209966 [0,1,0,0,0,0|3,0,0]=4 438 B17R2.216 Brc1ccc(cn1)CNCc2ccccn2 2230a_100009817727_100000721315 [0,1,0,0,0,0|3,0,0]=4 439 B17R2.216 Brc1ccc(cn1)CNCc2ccccn2 270004a_100009817727_100000209966 [0,1,0,0,0,0|3,0,0]=4 440 B17R2.216 Brc1ccc(cn1)CNCc2ccccn2 34a_100009817727_100000721315 [0,1,0,0,0,0|3,0,0]=4 441 B17R2.216 Brc1ccc(cn1)CNCc2cccnc2 207a_100009817727_100000209961 [0,1,0,0,0,0|3,0,0]=4 442 B17R2.216 Brc1ccc(cn1)CNCc2cccnc2 2230a_100009817727_100000741622 [0,1,0,0,0,0|3,0,0]=4 443 B17R2.216 Brc1ccc(cn1)CNCc2cccnc2 270004a_100009817727_100000209961 [0,1,0,0,0,0|3,0,0]=4 444 B17R2.216 Brc1ccc(cn1)CNCc2cccnc2 34a_100009817727_100000733263 [0,1,0,0,0,0|3,0,0]=4 445 B17R2.216 Brc1ccc(cn1)CNCc2ccncc2 207a_100009817727_100000186114 [0,1,0,0,0,0|3,0,0]=4 446 B17R2.216 Brc1ccc(cn1)CNCc2ccncc2 2230a_100009817727_100015193705 [0,1,0,0,0,0|3,0,0]=4 447 B17R2.216 Brc1ccc(cn1)COCc2ccccc2 34a_100000210790_100009831999 [0,1,0,0,0,0|1,0,0]=2 448 B17R2.216 Brc1ccc(cn1)COCc2ccccc2 34a_100009816760_100015291786 [0,1,0,0,0,0|1,0,0]=2 449 B17R2.216 Brc1ccc(cn1)COCc2ccccc2 7a_100000210790_100009831999 [0,1,0,0,0,0|1,0,0]=2 450 B17R2.216 Brc1ccc(cn1)COCc2ccccc2 7a_100009816760_100000211182 [0,1,0,0,0,0|1,0,0]=2 451 B17R2.216 Brc1ccc(cn1)COCc2ccccn2 34a_100009816760_100000721315 [0,1,0,0,0,0|2,0,0]=3 452 B17R2.216 Brc1ccc(cn1)COCc2ccccn2 7a_100009816760_100000721315 [0,1,0,0,0,0|2,0,0]=3 453 B17R2.216 Brc1ccc(cn1)COCc2cccnc2 34a_100009816760_100000733263 [0,1,0,0,0,0|2,0,0]=3 454 B17R2.216 Brc1ccc(cn1)COCc2cccnc2 7a_100009816760_100000741622 [0,1,0,0,0,0|2,0,0]=3 455 B17R2.216 Brc1ccc(cn1)COCc2cccnn2 34a_100009816760_100016990269 [0,1,0,0,0,0|3,0,0]=4 456 B17R2.216 Brc1ccc(cn1)COCc2cccnn2 7a_100009816760_100016990269 [0,1,0,0,0,0|3,0,0]=4 457 B17R2.216 Brc1ccc(cn1)COCc2ccncc2 7a_100009816760_100015193705 [0,1,0,0,0,0|2,0,0]=3 458 B17R2.216 Brc1ccc(cn1)COCc2cnccn2 34a_100009816760_100016995436 [0,1,0,0,0,0|3,0,0]=4 459 B17R2.216 Brc1ccc(cn1)COCc2cnccn2 7a_100009816760_100016995436 [0,1,0,0,0,0|3,0,0]=4 460 B17R2.216 Brc1ccc(cn1)COCc2cncnc2 34a_100009816760_100015196519 [0,1,0,0,0,0|3,0,0]=4 461 B17R2.216 Brc1ccc(cn1)COCc2cncnc2 7a_100009816760_100015196519 [0,1,0,0,0,0|3,0,0]=4 462 B17R2.216 Brc1ccc(cn1)COCc2ncccn2 34a_100009816760_100000703007 [0,1,0,0,0,0|3,0,0]=4 463 B17R2.216 Brc1ccc(cn1)COCc2ncccn2 7a_100009816760_100000703007 [0,1,0,0,0,0|3,0,0]=4 464 B17R2.216 Brc1ccc(cn1)CSCc2ccccc2 62a_100000211182_100009831999 [0,1,0,0,0,0|1,1,0]=3 465 B17R2.216 Brc1ccc(cn1)CSCc2ccccc2 62a_100009831999_100015291786 [0,1,0,0,0,0|1,1,0]=3 466 B17R2.216 Brc1ccc(cn1)CSCc2ccccn2 62a_100000721315_100009831999 [0,1,0,0,0,0|2,1,0]=4 467 B17R2.216 Brc1ccc(cn1)CSCc2ccccn2 62a_100009831999_100000721315 [0,1,0,0,0,0|2,1,0]=4 468 B17R2.216 Brc1ccc(cn1)CSCc2cccnc2 62a_100000741622_100009831999 [0,1,0,0,0,0|2,1,0]=4 469 B17R2.216 Brc1ccc(cn1)CSCc2cccnc2 62a_100009831999_100000741622 [0,1,0,0,0,0|2,1,0]=4 470 B17R2.216 Brc1ccc(cn1)CSCc2ccncc2 62a_100009831999_100015193705 [0,1,0,0,0,0|2,1,0]=4 471 B17R2.216 Brc1ccc(cn1)CSCc2ccncc2 62a_100015193705_100009831999 [0,1,0,0,0,0|2,1,0]=4 472 B17R2.216 Brc1ccc(cn1)OCCc2ccccc2 34a_100000685995_100000765856 [0,1,0,0,0,0|3,0,0]=4 473 B17R2.216 Brc1ccc(cn1)OCCc2ccccc2 7a_100000685995_100000765856 [0,1,0,0,0,0|3,0,0]=4 474 B17R2.216 Brc1ccc(cn1)SCCc2ccccc2 62a_100000765856_100009814638 [0,1,0,0,0,0|3,0,0]=4 475 B17R2.216 Brc1ccc(cn1)SCCc2ccccc2 62a_100009814638_100011218657 [0,1,0,0,0,0|3,0,0]=4 476 B17R2.216 Brc1ccc(nc1)C=CCc2ccccc2 271570a_200016263579_100000686858 [0,1,0,0,0,0|2,0,1]=4 477 B17R2.216 Brc1ccc(nc1)CNCc2ccccc2 207a_100015324214_100000754260 [0,1,0,0,0,0|2,0,0]=3 478 B17R2.216 Brc1ccc(nc1)CNCc2ccccc2 2230a_100015324214_100000702658 [0,1,0,0,0,0|2,0,0]=3 479 B17R2.216 Brc1ccc(nc1)CNCc2ccccc2 270004a_100015324214_100000754260 [0,1,0,0,0,0|2,0,0]=3 480 B17R2.216 Brc1ccc(nc1)CNCc2ccccc2 34a_100015188789_100015291786 [0,1,0,0,0,0|2,0,0]=3 481 B17R2.216 Brc1ccc(nc1)CNCc2ccccc2 34a_100015324214_100000702658 [0,1,0,0,0,0|2,0,0]=3 482 B17R2.216 Brc1ccc(nc1)CNCc2ccccn2 270004a_100000210449_100000754260 [0,1,0,0,0,0|3,0,0]=4 483 B17R2.216 Brc1ccc(nc1)CNCc2ccccn2 34a_100015188789_100000721315 [0,1,0,0,0,0|3,0,0]=4 484 B17R2.216 Brc1ccc(nc1)CNCc2cccnc2 207a_100000210453_100000754260 [0,1,0,0,0,0|3,0,0]=4 485 B17R2.216 Brc1ccc(nc1)CNCc2cccnc2 270004a_100000210453_100000754260 [0,1,0,0,0,0|3,0,0]=4 486 B17R2.216 Brc1ccc(nc1)CNCc2cccnc2 34a_100015188789_100000733263 [0,1,0,0,0,0|3,0,0]=4 487 B17R2.216 Brc1ccc(nc1)COCc2ccccc2 34a_100000210790_100000702658 [0,1,0,0,0,0|1,0,0]=2 488 B17R2.216 Brc1ccc(nc1)COCc2ccccc2 34a_100000754261_100015291786 [0,1,0,0,0,0|1,0,0]=2 489 B17R2.216 Brc1ccc(nc1)COCc2ccccc2 7a_100000210790_100000702658 [0,1,0,0,0,0|1,0,0]=2 490 B17R2.216 Brc1ccc(nc1)COCc2ccccn2 34a_100000754261_100000721315 [0,1,0,0,0,0|2,0,0]=3 491 B17R2.216 Brc1ccc(nc1)COCc2cccnc2 34a_100000754261_100000733263 [0,1,0,0,0,0|2,0,0]=3 492 B17R2.216 Brc1ccc(nc1)COCc2cccnn2 34a_100000754261_100016990269 [0,1,0,0,0,0|3,0,0]=4 493 B17R2.216 Brc1ccc(nc1)COCc2cnccn2 34a_100000754261_100016995436 [0,1,0,0,0,0|3,0,0]=4 494 B17R2.216 Brc1ccc(nc1)COCc2cncnc2 34a_100000754261_100015196519 [0,1,0,0,0,0|3,0,0]=4 495 B17R2.216 Brc1ccc(nc1)COCc2ncccn2 34a_100000754261_100000703007 [0,1,0,0,0,0|3,0,0]=4 496 B17R2.216 Brc1ccc(nc1)CSCc2ccccc2 62a_100000211182_100000702658 [0,1,0,0,0,0|1,1,0]=3 497 B17R2.216 Brc1ccc(nc1)CSCc2ccccc2 62a_100000702658_100015291786 [0,1,0,0,0,0|1,1,0]=3 498 B17R2.216 Brc1ccc(nc1)CSCc2ccccn2 62a_100000702658_100000721315 [0,1,0,0,0,0|2,1,0]=4 499 B17R2.216 Brc1ccc(nc1)CSCc2ccccn2 62a_100000721315_100000702658 [0,1,0,0,0,0|2,1,0]=4 500 B17R2.216 Brc1ccc(nc1)CSCc2cccnc2 62a_100000702658_100000741622 [0,1,0,0,0,0|2,1,0]=4 501 B17R2.216 Brc1ccc(nc1)CSCc2cccnc2 62a_100000741622_100000702658 [0,1,0,0,0,0|2,1,0]=4 502 B17R2.216 Brc1ccc(nc1)CSCc2ccncc2 62a_100000702658_100015193705 [0,1,0,0,0,0|2,1,0]=4 503 B17R2.216 Brc1ccc(nc1)CSCc2ccncc2 62a_100015193705_100000702658 [0,1,0,0,0,0|2,1,0]=4 504 B17R2.216 Brc1ccc(nc1)NCCc2ccccc2 27a_100000106460_100000686858 [0,1,0,0,0,0|3,0,0]=4 505 B17R2.216 Brc1ccc(nc1)SCCc2ccccc2 62a_100000686858_100011218657 [0,1,0,0,0,0|3,0,0]=4 506 B17R2.216 Brc1ccc(nc1)SCCc2ccccc2 62a_100000765856_100000686858 [0,1,0,0,0,0|3,0,0]=4 507 B17R2.216 Brc1cnc(nc1)CNCc2ccccc2 34a_100015324214_100010064664 [0,1,0,0,0,0|3,0,0]=4 508 B17R2.216 Brc1cnc(nc1)COCc2ccccc2 34a_100000210790_100010064664 [0,1,0,0,0,0|2,0,0]=3 509 B17R2.216 Brc1cnc(nc1)COCc2ccccc2 7a_100000210790_100010064664 [0,1,0,0,0,0|2,0,0]=3 510 B17R2.216 Brc1cnc(nc1)CSCc2ccccc2 62a_100000211182_100010064664 [0,1,0,0,0,0|2,1,0]=4 511 B17R2.216 Brc1cnc(nc1)CSCc2ccccc2 62a_100010064664_100015291786 [0,1,0,0,0,0|2,1,0]=4 512 B17R2.216 C[n+]1ccc(cc1)COCc2ccccc2 34a_100009831711_100015291786 [0,1,0,0,0,0|1,0,0]=2 513 B17R2.216 C[n+]1ccc(cc1)COCc2ccccn2 34a_100009831711_100000721315 [0,1,0,0,0,0|2,0,0]=3 514 B17R2.216 C[n+]1ccc(cc1)COCc2cccnc2 34a_100009831711_100000733263 [0,1,0,0,0,0|2,0,0]=3 515 B17R2.216 C[n+]1ccc(cc1)COCc2cccnn2 34a_100009831711_100016990269 [0,1,0,0,0,0|3,0,0]=4 516 B17R2.216 C[n+]1ccc(cc1)COCc2cnccn2 34a_100009831711_100016995436 [0,1,0,0,0,0|3,0,0]=4 517 B17R2.216 C[n+]1ccc(cc1)COCc2cncnc2 34a_100009831711_100015196519 [0,1,0,0,0,0|3,0,0]=4 518 B17R2.216 C[n+]1ccc(cc1)COCc2ncccn2 34a_100009831711_100000703007 [0,1,0,0,0,0|3,0,0]=4 519 B17R2.216 Cc1ccc(cc1)C=CCc2ccccc2 271570a_200016263579_100000186775 [0,1,0,0,0,0|1,0,1]=3 520 B17R2.216 Cc1ccc(cc1)C=NNc2ccccc2 4a_100015195140_100000211033 [0,1,0,0,0,0|2,0,1]=4 521 B17R2.216 Cc1ccc(cc1)CCNc2ccccc2 34a_100000106764_100011713686 [0,1,0,0,0,0|2,0,0]=3 522 B17R2.216 Cc1ccc(cc1)CCOc2ccccc2 34a_100000210340_100011713686 [0,1,0,0,0,0|2,0,0]=3 523 B17R2.216 Cc1ccc(cc1)CCOc2ccccc2 7a_100000210340_100011713686 [0,1,0,0,0,0|2,0,0]=3 524 B17R2.216 Cc1ccc(cc1)CCOc2cccnc2 34a_100000210849_100011713686 [0,1,0,0,0,0|3,0,0]=4 525 B17R2.216 Cc1ccc(cc1)CCOc2cccnc2 7a_100000210849_100011713686 [0,1,0,0,0,0|3,0,0]=4 526 B17R2.216 Cc1ccc(cc1)CCOc2ccncc2 34a_100000212176_100011713686 [0,1,0,0,0,0|3,0,0]=4 527 B17R2.216 Cc1ccc(cc1)CCSc2ccccc2 62a_100000719477_100011713686 [0,1,0,0,0,0|2,0,0]=3 528 B17R2.216 Cc1ccc(cc1)CCSc2ccccc2 62a_100011713686_100000041952 [0,1,0,0,0,0|2,0,0]=3 529 B17R2.216 Cc1ccc(cc1)CCSc2ccccn2 62a_100011216584_100011713686 [0,1,0,0,0,0|3,0,0]=4 530 B17R2.216 Cc1ccc(cc1)CCSc2ccccn2 62a_100011713686_100011216584 [0,1,0,0,0,0|3,0,0]=4 531 B17R2.216 Cc1ccc(cc1)CCSc2cccnc2 62a_100000210063_100011713686 [0,1,0,0,0,0|3,0,0]=4 532 B17R2.216 Cc1ccc(cc1)CCSc2cccnc2 62a_100011713686_100000210063 [0,1,0,0,0,0|3,0,0]=4 533 B17R2.216 Cc1ccc(cc1)CCSc2ccncc2 62a_100000728582_100011713686 [0,1,0,0,0,0|3,0,0]=4 534 B17R2.216 Cc1ccc(cc1)CCSc2ccncc2 62a_100011713686_100000728582 [0,1,0,0,0,0|3,0,0]=4 535 B17R2.216 Cc1ccc(cc1)CNCc2ccccc2 207a_100000174908_100015611070 [0,1,0,0,0,0|1,0,0]=2 536 B17R2.216 Cc1ccc(cc1)CNCc2ccccc2 207a_100015324214_100000211033 [0,1,0,0,0,0|1,0,0]=2 537 B17R2.216 Cc1ccc(cc1)CNCc2ccccc2 2230a_100000174908_100015291786 [0,1,0,0,0,0|1,0,0]=2 538 B17R2.216 Cc1ccc(cc1)CNCc2ccccc2 2230a_100015324214_100000210814 [0,1,0,0,0,0|1,0,0]=2 539 B17R2.216 Cc1ccc(cc1)CNCc2ccccc2 270004a_100000174908_100015611070 [0,1,0,0,0,0|1,0,0]=2 540 B17R2.216 Cc1ccc(cc1)CNCc2ccccc2 270004a_100015324214_100000211033 [0,1,0,0,0,0|1,0,0]=2 541 B17R2.216 Cc1ccc(cc1)CNCc2ccccc2 34a_100000174908_100015291786 [0,1,0,0,0,0|1,0,0]=2 542 B17R2.216 Cc1ccc(cc1)CNCc2ccccc2 34a_100015324214_100000210814 [0,1,0,0,0,0|1,0,0]=2 543 B17R2.216 Cc1ccc(cc1)CNCc2ccccn2 207a_100000174908_100000209966 [0,1,0,0,0,0|2,0,0]=3 544 B17R2.216 Cc1ccc(cc1)CNCc2ccccn2 2230a_100000174908_100000721315 [0,1,0,0,0,0|2,0,0]=3 545 B17R2.216 Cc1ccc(cc1)CNCc2ccccn2 270004a_100000174908_100000209966 [0,1,0,0,0,0|2,0,0]=3 546 B17R2.216 Cc1ccc(cc1)CNCc2ccccn2 270004a_100000210449_100000211033 [0,1,0,0,0,0|2,0,0]=3 547 B17R2.216 Cc1ccc(cc1)CNCc2ccccn2 34a_100000174908_100000721315 [0,1,0,0,0,0|2,0,0]=3 548 B17R2.216 Cc1ccc(cc1)CNCc2cccnc2 207a_100000174908_100000209961 [0,1,0,0,0,0|2,0,0]=3 549 B17R2.216 Cc1ccc(cc1)CNCc2cccnc2 207a_100000210453_100000211033 [0,1,0,0,0,0|2,0,0]=3 550 B17R2.216 Cc1ccc(cc1)CNCc2cccnc2 2230a_100000174908_100000741622 [0,1,0,0,0,0|2,0,0]=3 551 B17R2.216 Cc1ccc(cc1)CNCc2cccnc2 270004a_100000174908_100000209961 [0,1,0,0,0,0|2,0,0]=3 552 B17R2.216 Cc1ccc(cc1)CNCc2cccnc2 270004a_100000210453_100000211033 [0,1,0,0,0,0|2,0,0]=3 553 B17R2.216 Cc1ccc(cc1)CNCc2cccnc2 34a_100000174908_100000733263 [0,1,0,0,0,0|2,0,0]=3 554 B17R2.216 Cc1ccc(cc1)CNCc2cccnn2 2230a_100000174908_100016990269 [0,1,0,0,0,0|3,0,0]=4 555 B17R2.216 Cc1ccc(cc1)CNCc2cccnn2 2230a_100159270163_100000210814 [0,1,0,0,0,0|3,0,0]=4 556 B17R2.216 Cc1ccc(cc1)CNCc2cccnn2 34a_100000174908_100016990269 [0,1,0,0,0,0|3,0,0]=4 557 B17R2.216 Cc1ccc(cc1)CNCc2ccncc2 207a_100000174908_100000186114 [0,1,0,0,0,0|2,0,0]=3 558 B17R2.216 Cc1ccc(cc1)CNCc2ccncc2 2230a_100000174908_100015193705 [0,1,0,0,0,0|2,0,0]=3 559 B17R2.216 Cc1ccc(cc1)CNCc2ccnnc2 270004a_100000174908_100011934578 [0,1,0,0,0,0|3,0,0]=4 560 B17R2.216 Cc1ccc(cc1)CNCc2cnccn2 2230a_100000174908_100016995436 [0,1,0,0,0,0|3,0,0]=4 561 B17R2.216 Cc1ccc(cc1)CNCc2cnccn2 270004a_100000174908_100000749867 [0,1,0,0,0,0|3,0,0]=4 562 B17R2.216 Cc1ccc(cc1)CNCc2cnccn2 34a_100000174908_100016995436 [0,1,0,0,0,0|3,0,0]=4 563 B17R2.216 Cc1ccc(cc1)CNCc2cncnc2 207a_100011243677_100000211033 [0,1,0,0,0,0|3,0,0]=4 564 B17R2.216 Cc1ccc(cc1)CNCc2cncnc2 2230a_100000174908_100015196519 [0,1,0,0,0,0|3,0,0]=4 565 B17R2.216 Cc1ccc(cc1)CNCc2cncnc2 2230a_100011243677_100000210814 [0,1,0,0,0,0|3,0,0]=4 566 B17R2.216 Cc1ccc(cc1)CNCc2cncnc2 270004a_100000174908_100000749868 [0,1,0,0,0,0|3,0,0]=4 567 B17R2.216 Cc1ccc(cc1)CNCc2cncnc2 270004a_100011243677_100000211033 [0,1,0,0,0,0|3,0,0]=4 568 B17R2.216 Cc1ccc(cc1)CNCc2cncnc2 34a_100000174908_100015196519 [0,1,0,0,0,0|3,0,0]=4 569 B17R2.216 Cc1ccc(cc1)CNCc2ncccn2 2230a_100000174908_100000703007 [0,1,0,0,0,0|3,0,0]=4 570 B17R2.216 Cc1ccc(cc1)CNCc2ncccn2 270004a_100000174908_100011532527 [0,1,0,0,0,0|3,0,0]=4 571 B17R2.216 Cc1ccc(cc1)CNCc2ncccn2 34a_100000174908_100000703007 [0,1,0,0,0,0|3,0,0]=4 572 B17R2.216 Cc1ccc(cc1)COCc2ccccc2 34a_100000210790_100000210814 [0,1,0,0,0,0|0,0,0]=1 573 B17R2.216 Cc1ccc(cc1)COCc2ccccc2 34a_100011215236_100015291786 [0,1,0,0,0,0|0,0,0]=1 574 B17R2.216 Cc1ccc(cc1)COCc2ccccc2 7a_100000210790_100000210814 [0,1,0,0,0,0|0,0,0]=1 575 B17R2.216 Cc1ccc(cc1)COCc2ccccc2 7a_100011215236_100000211182 [0,1,0,0,0,0|0,0,0]=1 576 B17R2.216 Cc1ccc(cc1)COCc2ccccn2 34a_100011215236_100000721315 [0,1,0,0,0,0|1,0,0]=2 577 B17R2.216 Cc1ccc(cc1)COCc2ccccn2 7a_100011215236_100000721315 [0,1,0,0,0,0|1,0,0]=2 578 B17R2.216 Cc1ccc(cc1)COCc2cccnc2 34a_100011215236_100000733263 [0,1,0,0,0,0|1,0,0]=2 579 B17R2.216 Cc1ccc(cc1)COCc2cccnc2 7a_100011215236_100000741622 [0,1,0,0,0,0|1,0,0]=2 580 B17R2.216 Cc1ccc(cc1)COCc2cccnn2 34a_100011215236_100016990269 [0,1,0,0,0,0|2,0,0]=3 581 B17R2.216 Cc1ccc(cc1)COCc2cccnn2 7a_100011215236_100016990269 [0,1,0,0,0,0|2,0,0]=3 582 B17R2.216 Cc1ccc(cc1)COCc2ccncc2 7a_100011215236_100015193705 [0,1,0,0,0,0|1,0,0]=2 583 B17R2.216 Cc1ccc(cc1)COCc2cnccn2 34a_100011215236_100016995436 [0,1,0,0,0,0|2,0,0]=3 584 B17R2.216 Cc1ccc(cc1)COCc2cnccn2 7a_100011215236_100016995436 [0,1,0,0,0,0|2,0,0]=3 585 B17R2.216 Cc1ccc(cc1)COCc2cncnc2 34a_100011215236_100015196519 [0,1,0,0,0,0|2,0,0]=3 586 B17R2.216 Cc1ccc(cc1)COCc2cncnc2 7a_100011215236_100015196519 [0,1,0,0,0,0|2,0,0]=3 587 B17R2.216 Cc1ccc(cc1)COCc2ncccn2 34a_100011215236_100000703007 [0,1,0,0,0,0|2,0,0]=3 588 B17R2.216 Cc1ccc(cc1)COCc2ncccn2 7a_100011215236_100000703007 [0,1,0,0,0,0|2,0,0]=3 589 B17R2.216 Cc1ccc(cc1)CSCc2ccccc2 62a_100000210814_100015291786 [0,1,0,0,0,0|0,1,0]=2 590 B17R2.216 Cc1ccc(cc1)CSCc2ccccc2 62a_100000211182_100000210814 [0,1,0,0,0,0|0,1,0]=2 591 B17R2.216 Cc1ccc(cc1)CSCc2ccccn2 62a_100000210814_100000721315 [0,1,0,0,0,0|1,1,0]=3 592 B17R2.216 Cc1ccc(cc1)CSCc2ccccn2 62a_100000721315_100000210814 [0,1,0,0,0,0|1,1,0]=3 593 B17R2.216 Cc1ccc(cc1)CSCc2cccnc2 62a_100000210814_100000741622 [0,1,0,0,0,0|1,1,0]=3 594 B17R2.216 Cc1ccc(cc1)CSCc2cccnc2 62a_100000741622_100000210814 [0,1,0,0,0,0|1,1,0]=3 595 B17R2.216 Cc1ccc(cc1)CSCc2cccnn2 62a_100000210814_100016990269 [0,1,0,0,0,0|2,1,0]=4 596 B17R2.216 Cc1ccc(cc1)CSCc2cccnn2 62a_100016990269_100000210814 [0,1,0,0,0,0|2,1,0]=4 597 B17R2.216 Cc1ccc(cc1)CSCc2ccncc2 62a_100000210814_100015193705 [0,1,0,0,0,0|1,1,0]=3 598 B17R2.216 Cc1ccc(cc1)CSCc2ccncc2 62a_100015193705_100000210814 [0,1,0,0,0,0|1,1,0]=3 599 B17R2.216 Cc1ccc(cc1)CSCc2cnccn2 62a_100000210814_100016995436 [0,1,0,0,0,0|2,1,0]=4 600 B17R2.216 Cc1ccc(cc1)CSCc2cnccn2 62a_100016995436_100000210814 [0,1,0,0,0,0|2,1,0]=4 601 B17R2.216 Cc1ccc(cc1)CSCc2cncnc2 62a_100000210814_100015196519 [0,1,0,0,0,0|2,1,0]=4 602 B17R2.216 Cc1ccc(cc1)CSCc2cncnc2 62a_100015196519_100000210814 [0,1,0,0,0,0|2,1,0]=4 603 B17R2.216 Cc1ccc(cc1)CSCc2ncccn2 62a_100000210814_100000703007 [0,1,0,0,0,0|2,1,0]=4 604 B17R2.216 Cc1ccc(cc1)CSCc2ncccn2 62a_100000703007_100000210814 [0,1,0,0,0,0|2,1,0]=4 605 B17R2.216 Cc1ccc(cc1)NCCc2ccccc2 34a_100000124888_100000765856 [0,1,0,0,0,0|2,0,0]=3 606 B17R2.216 Cc1ccc(cc1)NN=Cc2ccccc2 4a_100000683527_100015611070 [0,1,0,0,0,0|2,0,1]=4 607 B17R2.216 Cc1ccc(cc1)OCCc2ccccc2 34a_100000210336_100000765856 [0,1,0,0,0,0|2,0,0]=3 608 B17R2.216 Cc1ccc(cc1)OCCc2ccccc2 7a_100000210336_100000765856 [0,1,0,0,0,0|2,0,0]=3 609 B17R2.216 Cc1ccc(cc1)OCCc2ccccn2 7a_100000210336_100015183660 [0,1,0,0,0,0|3,0,0]=4 610 B17R2.216 Cc1ccc(cc1)OCCc2cccnc2 7a_100000210336_200011713674 [0,1,0,0,0,0|3,0,0]=4 611 B17R2.216 Cc1ccc(cc1)OCCc2ccncc2 7a_100000210336_100000723409 [0,1,0,0,0,0|3,0,0]=4 612 B17R2.216 Cc1ccc(cc1)SCCc2ccccc2 62a_100000186775_100011218657 [0,1,0,0,0,0|2,0,0]=3 613 B17R2.216 Cc1ccc(cc1)SCCc2ccccc2 62a_100000765856_100000186775 [0,1,0,0,0,0|2,0,0]=3 614 B17R2.216 Cc1ccc(cc1)SCCc2ccccn2 62a_100000186775_100015183660 [0,1,0,0,0,0|3,0,0]=4 615 B17R2.216 Cc1ccc(cc1)SCCc2ccccn2 62a_100015183660_100000186775 [0,1,0,0,0,0|3,0,0]=4 616 B17R2.216 Cc1ccc(cc1)SCCc2cccnc2 62a_100000186775_200011713674 [0,1,0,0,0,0|3,0,0]=4 617 B17R2.216 Cc1ccc(cc1)SCCc2cccnc2 62a_200011713674_100000186775 [0,1,0,0,0,0|3,0,0]=4 618 B17R2.216 Cc1ccc(cc1)SCCc2ccncc2 62a_100000186775_100000723409 [0,1,0,0,0,0|3,0,0]=4 619 B17R2.216 Cc1ccc(cc1)SCCc2ccncc2 62a_100000723409_100000186775 [0,1,0,0,0,0|3,0,0]=4 620 B17R2.216 Cc1ccc(cc1)SCSc2ccccc2 62a_100000186775_100011218342 [0,1,0,0,0,0|3,0,0]=4 621 B17R2.216 Cc1ccc(cc1)SCSc2ccccc2 62a_100011218342_100000186775 [0,1,0,0,0,0|3,0,0]=4 622 B17R2.216 Cc1ccc(cn1)C=CCc2ccccc2 271570a_200016263579_100000751577 [0,1,0,0,0,0|2,0,1]=4 623 B17R2.216 Cc1ccc(cn1)CNCc2ccccc2 207a_100000740942_100015611070 [0,1,0,0,0,0|2,0,0]=3 624 B17R2.216 Cc1ccc(cn1)CNCc2ccccc2 2230a_100015324214_100016987292 [0,1,0,0,0,0|2,0,0]=3 625 B17R2.216 Cc1ccc(cn1)CNCc2ccccc2 270004a_100000740942_100015611070 [0,1,0,0,0,0|2,0,0]=3 626 B17R2.216 Cc1ccc(cn1)CNCc2ccccc2 270004a_100015324214_100000743784 [0,1,0,0,0,0|2,0,0]=3 627 B17R2.216 Cc1ccc(cn1)CNCc2ccccc2 34a_100000740942_100015291786 [0,1,0,0,0,0|2,0,0]=3 628 B17R2.216 Cc1ccc(cn1)CNCc2ccccc2 34a_100015324214_100016987292 [0,1,0,0,0,0|2,0,0]=3 629 B17R2.216 Cc1ccc(cn1)CNCc2ccccn2 207a_100000740942_100000209966 [0,1,0,0,0,0|3,0,0]=4 630 B17R2.216 Cc1ccc(cn1)CNCc2ccccn2 270004a_100000210449_100000743784 [0,1,0,0,0,0|3,0,0]=4 631 B17R2.216 Cc1ccc(cn1)CNCc2ccccn2 270004a_100000740942_100000209966 [0,1,0,0,0,0|3,0,0]=4 632 B17R2.216 Cc1ccc(cn1)CNCc2ccccn2 34a_100000740942_100000721315 [0,1,0,0,0,0|3,0,0]=4 633 B17R2.216 Cc1ccc(cn1)CNCc2cccnc2 207a_100000740942_100000209961 [0,1,0,0,0,0|3,0,0]=4 634 B17R2.216 Cc1ccc(cn1)CNCc2cccnc2 270004a_100000210453_100000743784 [0,1,0,0,0,0|3,0,0]=4 635 B17R2.216 Cc1ccc(cn1)CNCc2cccnc2 270004a_100000740942_100000209961 [0,1,0,0,0,0|3,0,0]=4 636 B17R2.216 Cc1ccc(cn1)CNCc2cccnc2 34a_100000740942_100000733263 [0,1,0,0,0,0|3,0,0]=4 637 B17R2.216 Cc1ccc(cn1)CNCc2ccncc2 207a_100000740942_100000186114 [0,1,0,0,0,0|3,0,0]=4 638 B17R2.216 Cc1ccc(cn1)COCc2ccccc2 34a_100000210790_100016987292 [0,1,0,0,0,0|1,0,0]=2 639 B17R2.216 Cc1ccc(cn1)COCc2ccccc2 34a_100011248133_100015291786 [0,1,0,0,0,0|1,0,0]=2 640 B17R2.216 Cc1ccc(cn1)COCc2ccccc2 7a_100000210790_100016987292 [0,1,0,0,0,0|1,0,0]=2 641 B17R2.216 Cc1ccc(cn1)COCc2ccccn2 34a_100011248133_100000721315 [0,1,0,0,0,0|2,0,0]=3 642 B17R2.216 Cc1ccc(cn1)COCc2cccnc2 34a_100011248133_100000733263 [0,1,0,0,0,0|2,0,0]=3 643 B17R2.216 Cc1ccc(cn1)COCc2cccnn2 34a_100011248133_100016990269 [0,1,0,0,0,0|3,0,0]=4 644 B17R2.216 Cc1ccc(cn1)COCc2cnccn2 34a_100011248133_100016995436 [0,1,0,0,0,0|3,0,0]=4 645 B17R2.216 Cc1ccc(cn1)COCc2cncnc2 34a_100011248133_100015196519 [0,1,0,0,0,0|3,0,0]=4 646 B17R2.216 Cc1ccc(cn1)COCc2ncccn2 34a_100011248133_100000703007 [0,1,0,0,0,0|3,0,0]=4 647 B17R2.216 Cc1ccc(cn1)CSCc2ccccc2 62a_100000211182_100016987292 [0,1,0,0,0,0|1,1,0]=3 648 B17R2.216 Cc1ccc(cn1)CSCc2ccccc2 62a_100016987292_100015291786 [0,1,0,0,0,0|1,1,0]=3 649 B17R2.216 Cc1ccc(cn1)CSCc2ccccn2 62a_100000721315_100016987292 [0,1,0,0,0,0|2,1,0]=4 650 B17R2.216 Cc1ccc(cn1)CSCc2ccccn2 62a_100016987292_100000721315 [0,1,0,0,0,0|2,1,0]=4 651 B17R2.216 Cc1ccc(cn1)CSCc2cccnc2 62a_100000741622_100016987292 [0,1,0,0,0,0|2,1,0]=4 652 B17R2.216 Cc1ccc(cn1)CSCc2cccnc2 62a_100016987292_100000741622 [0,1,0,0,0,0|2,1,0]=4 653 B17R2.216 Cc1ccc(cn1)CSCc2ccncc2 62a_100015193705_100016987292 [0,1,0,0,0,0|2,1,0]=4 654 B17R2.216 Cc1ccc(cn1)CSCc2ccncc2 62a_100016987292_100015193705 [0,1,0,0,0,0|2,1,0]=4 655 B17R2.216 Cc1ccc(cn1)OCCc2ccccc2 34a_100000745506_100000765856 [0,1,0,0,0,0|3,0,0]=4 656 B17R2.216 Cc1ccc(cn1)OCCc2ccccc2 7a_100000745506_100000765856 [0,1,0,0,0,0|3,0,0]=4 657 B17R2.216 Cc1ccc(cn1)SCCc2ccccc2 62a_100000751577_100011218657 [0,1,0,0,0,0|3,0,0]=4 658 B17R2.216 Cc1ccc(cn1)SCCc2ccccc2 62a_100000765856_100000751577 [0,1,0,0,0,0|3,0,0]=4 659 B17R2.216 Cc1ccc(nc1)C=CCc2ccccc2 271570a_200016263579_100000754016 [0,1,0,0,0,0|2,0,1]=4 660 B17R2.216 Cc1ccc(nc1)CNCc2ccccc2 207a_100015324214_100000050478 [0,1,0,0,0,0|2,0,0]=3 661 B17R2.216 Cc1ccc(nc1)CNCc2ccccc2 2230a_100015324214_100000691093 [0,1,0,0,0,0|2,0,0]=3 662 B17R2.216 Cc1ccc(nc1)CNCc2ccccc2 270004a_100015324214_100000050478 [0,1,0,0,0,0|2,0,0]=3 663 B17R2.216 Cc1ccc(nc1)CNCc2ccccc2 34a_100015187455_100015291786 [0,1,0,0,0,0|2,0,0]=3 664 B17R2.216 Cc1ccc(nc1)CNCc2ccccc2 34a_100015324214_100000691093 [0,1,0,0,0,0|2,0,0]=3 665 B17R2.216 Cc1ccc(nc1)CNCc2ccccn2 270004a_100000210449_100000050478 [0,1,0,0,0,0|3,0,0]=4 666 B17R2.216 Cc1ccc(nc1)CNCc2ccccn2 34a_100015187455_100000721315 [0,1,0,0,0,0|3,0,0]=4 667 B17R2.216 Cc1ccc(nc1)CNCc2cccnc2 207a_100000210453_100000050478 [0,1,0,0,0,0|3,0,0]=4 668 B17R2.216 Cc1ccc(nc1)CNCc2cccnc2 270004a_100000210453_100000050478 [0,1,0,0,0,0|3,0,0]=4 669 B17R2.216 Cc1ccc(nc1)CNCc2cccnc2 34a_100015187455_100000733263 [0,1,0,0,0,0|3,0,0]=4 670 B17R2.216 Cc1ccc(nc1)COCc2ccccc2 34a_100000210790_100000691093 [0,1,0,0,0,0|1,0,0]=2 671 B17R2.216 Cc1ccc(nc1)COCc2ccccc2 34a_100012001401_100015291786 [0,1,0,0,0,0|1,0,0]=2 672 B17R2.216 Cc1ccc(nc1)COCc2ccccc2 7a_100000210790_100000691093 [0,1,0,0,0,0|1,0,0]=2 673 B17R2.216 Cc1ccc(nc1)COCc2ccccn2 34a_100012001401_100000721315 [0,1,0,0,0,0|2,0,0]=3 674 B17R2.216 Cc1ccc(nc1)COCc2cccnc2 34a_100012001401_100000733263 [0,1,0,0,0,0|2,0,0]=3 675 B17R2.216 Cc1ccc(nc1)COCc2cccnn2 34a_100012001401_100016990269 [0,1,0,0,0,0|3,0,0]=4 676 B17R2.216 Cc1ccc(nc1)COCc2cnccn2 34a_100012001401_100016995436 [0,1,0,0,0,0|3,0,0]=4 677 B17R2.216 Cc1ccc(nc1)COCc2cncnc2 34a_100012001401_100015196519 [0,1,0,0,0,0|3,0,0]=4 678 B17R2.216 Cc1ccc(nc1)COCc2ncccn2 34a_100012001401_100000703007 [0,1,0,0,0,0|3,0,0]=4 679 B17R2.216 Cc1ccc(nc1)CSCc2ccccc2 62a_100000211182_100000691093 [0,1,0,0,0,0|1,1,0]=3 680 B17R2.216 Cc1ccc(nc1)CSCc2ccccc2 62a_100000691093_100015291786 [0,1,0,0,0,0|1,1,0]=3 681 B17R2.216 Cc1ccc(nc1)CSCc2ccccn2 62a_100000691093_100000721315 [0,1,0,0,0,0|2,1,0]=4 682 B17R2.216 Cc1ccc(nc1)CSCc2ccccn2 62a_100000721315_100000691093 [0,1,0,0,0,0|2,1,0]=4 683 B17R2.216 Cc1ccc(nc1)CSCc2cccnc2 62a_100000691093_100000741622 [0,1,0,0,0,0|2,1,0]=4 684 B17R2.216 Cc1ccc(nc1)CSCc2cccnc2 62a_100000741622_100000691093 [0,1,0,0,0,0|2,1,0]=4 685 B17R2.216 Cc1ccc(nc1)CSCc2ccncc2 62a_100000691093_100015193705 [0,1,0,0,0,0|2,1,0]=4 686 B17R2.216 Cc1ccc(nc1)CSCc2ccncc2 62a_100015193705_100000691093 [0,1,0,0,0,0|2,1,0]=4 687 B17R2.216 Cc1ccc(nc1)OCCc2ccccc2 34a_100000759353_100000765856 [0,1,0,0,0,0|3,0,0]=4 688 B17R2.216 Cc1ccc(nc1)SCCc2ccccc2 62a_100000765856_100000754016 [0,1,0,0,0,0|3,0,0]=4 689 B17R2.216 Cc1ccc(nc1)SCCc2ccccc2 62a_100011192072_100011218657 [0,1,0,0,0,0|3,0,0]=4 690 B17R2.216 Cc1cnc(cn1)CNCc2ccccc2 2230a_100015324214_100000752025 [0,1,0,0,0,0|3,0,0]=4 691 B17R2.216 Cc1cnc(cn1)CNCc2ccccc2 270004a_100015324214_100000685221 [0,1,0,0,0,0|3,0,0]=4 692 B17R2.216 Cc1cnc(cn1)CNCc2ccccc2 34a_100132314150_100015291786 [0,1,0,0,0,0|3,0,0]=4 693 B17R2.216 Cc1cnc(cn1)COCc2ccccc2 34a_100011273949_100015291786 [0,1,0,0,0,0|2,0,0]=3 694 B17R2.216 Cc1cnc(cn1)COCc2ccccc2 7a_100000210790_100000752025 [0,1,0,0,0,0|2,0,0]=3 695 B17R2.216 Cc1cnc(cn1)COCc2ccccn2 34a_100011273949_100000721315 [0,1,0,0,0,0|3,0,0]=4 696 B17R2.216 Cc1cnc(cn1)COCc2cccnc2 34a_100011273949_100000733263 [0,1,0,0,0,0|3,0,0]=4 697 B17R2.216 Cc1cnc(cn1)CSCc2ccccc2 62a_100000211182_100000752025 [0,1,0,0,0,0|2,1,0]=4 698 B17R2.216 Cc1cnc(cn1)CSCc2ccccc2 62a_100000752025_100015291786 [0,1,0,0,0,0|2,1,0]=4 699 B17R2.216 Cc1cnc(nc1)CNCc2ccccc2 2230a_100015324214_100000685645 [0,1,0,0,0,0|3,0,0]=4 700 B17R2.216 Cc1cnc(nc1)CNCc2ccccc2 34a_100015324214_100000685645 [0,1,0,0,0,0|3,0,0]=4 701 B17R2.216 Cc1cnc(nc1)COCc2ccccc2 34a_100000210790_100000685645 [0,1,0,0,0,0|2,0,0]=3 702 B17R2.216 Cc1cnc(nc1)COCc2ccccc2 7a_100000210790_100000685645 [0,1,0,0,0,0|2,0,0]=3 703 B17R2.216 Cc1cnc(nc1)CSCc2ccccc2 62a_100000211182_100000685645 [0,1,0,0,0,0|2,1,0]=4 704 B17R2.216 Cc1cnc(nc1)CSCc2ccccc2 62a_100000685645_100015291786 [0,1,0,0,0,0|2,1,0]=4 705 B17R2.216 Cc1ncc(cn1)CNCc2ccccc2 270004a_100015324214_100011202771 [0,1,0,0,0,0|3,0,0]=4 706 B17R2.216 Cc1ncc(cn1)COCc2ccccc2 34a_100011746891_100015291786 [0,1,0,0,0,0|2,0,0]=3 707 B17R2.216 Cc1ncc(cn1)COCc2ccccn2 34a_100011746891_100000721315 [0,1,0,0,0,0|3,0,0]=4 708 B17R2.216 Cc1ncc(cn1)COCc2cccnc2 34a_100011746891_100000733263 [0,1,0,0,0,0|3,0,0]=4 709 B17R2.216 Clc1ccc(cc1)C=CCc2ccccc2 271570a_200016263579_100000755918 [0,1,0,0,0,0|1,0,1]=3 710 B17R2.216 Clc1ccc(cc1)C=NNc2ccccc2 4a_100015195140_100000189385 [0,1,0,0,0,0|2,0,1]=4 711 B17R2.216 Clc1ccc(cc1)CCNc2ccccc2 34a_100000106764_100011713675 [0,1,0,0,0,0|2,0,0]=3 712 B17R2.216 Clc1ccc(cc1)CCOc2ccccc2 34a_100000210340_100011713675 [0,1,0,0,0,0|2,0,0]=3 713 B17R2.216 Clc1ccc(cc1)CCOc2ccccc2 7a_100000210340_100011713675 [0,1,0,0,0,0|2,0,0]=3 714 B17R2.216 Clc1ccc(cc1)CCOc2cccnc2 34a_100000210849_100011713675 [0,1,0,0,0,0|3,0,0]=4 715 B17R2.216 Clc1ccc(cc1)CCOc2cccnc2 7a_100000210849_100011713675 [0,1,0,0,0,0|3,0,0]=4 716 B17R2.216 Clc1ccc(cc1)CCOc2ccncc2 34a_100000212176_100011713675 [0,1,0,0,0,0|3,0,0]=4 717 B17R2.216 Clc1ccc(cc1)CCSc2ccccc2 62a_100000719477_100011713675 [0,1,0,0,0,0|2,0,0]=3 718 B17R2.216 Clc1ccc(cc1)CCSc2ccccc2 62a_100011713675_100000041952 [0,1,0,0,0,0|2,0,0]=3 719 B17R2.216 Clc1ccc(cc1)CCSc2ccccn2 62a_100011216584_100011713675 [0,1,0,0,0,0|3,0,0]=4 720 B17R2.216 Clc1ccc(cc1)CCSc2ccccn2 62a_100011713675_100011216584 [0,1,0,0,0,0|3,0,0]=4 721 B17R2.216 Clc1ccc(cc1)CCSc2cccnc2 62a_100000210063_100011713675 [0,1,0,0,0,0|3,0,0]=4 722 B17R2.216 Clc1ccc(cc1)CCSc2cccnc2 62a_100011713675_100000210063 [0,1,0,0,0,0|3,0,0]=4 723 B17R2.216 Clc1ccc(cc1)CCSc2ccncc2 62a_100000728582_100011713675 [0,1,0,0,0,0|3,0,0]=4 724 B17R2.216 Clc1ccc(cc1)CCSc2ccncc2 62a_100011713675_100000728582 [0,1,0,0,0,0|3,0,0]=4 725 B17R2.216 Clc1ccc(cc1)CNCc2ccccc2 207a_100000174871_100015611070 [0,1,0,0,0,0|1,0,0]=2 726 B17R2.216 Clc1ccc(cc1)CNCc2ccccc2 207a_100015324214_100000189385 [0,1,0,0,0,0|1,0,0]=2 727 B17R2.216 Clc1ccc(cc1)CNCc2ccccc2 2230a_100000174871_100015291786 [0,1,0,0,0,0|1,0,0]=2 728 B17R2.216 Clc1ccc(cc1)CNCc2ccccc2 2230a_100015324214_100000694040 [0,1,0,0,0,0|1,0,0]=2 729 B17R2.216 Clc1ccc(cc1)CNCc2ccccc2 270004a_100000174871_100015611070 [0,1,0,0,0,0|1,0,0]=2 730 B17R2.216 Clc1ccc(cc1)CNCc2ccccc2 270004a_100015324214_100000189385 [0,1,0,0,0,0|1,0,0]=2 731 B17R2.216 Clc1ccc(cc1)CNCc2ccccc2 34a_100000174871_100015291786 [0,1,0,0,0,0|1,0,0]=2 732 B17R2.216 Clc1ccc(cc1)CNCc2ccccc2 34a_100015324214_100000694040 [0,1,0,0,0,0|1,0,0]=2 733 B17R2.216 Clc1ccc(cc1)CNCc2ccccn2 207a_100000174871_100000209966 [0,1,0,0,0,0|2,0,0]=3 734 B17R2.216 Clc1ccc(cc1)CNCc2ccccn2 2230a_100000174871_100000721315 [0,1,0,0,0,0|2,0,0]=3 735 B17R2.216 Clc1ccc(cc1)CNCc2ccccn2 270004a_100000174871_100000209966 [0,1,0,0,0,0|2,0,0]=3 736 B17R2.216 Clc1ccc(cc1)CNCc2ccccn2 270004a_100000210449_100000189385 [0,1,0,0,0,0|2,0,0]=3 737 B17R2.216 Clc1ccc(cc1)CNCc2ccccn2 34a_100000174871_100000721315 [0,1,0,0,0,0|2,0,0]=3 738 B17R2.216 Clc1ccc(cc1)CNCc2cccnc2 207a_100000174871_100000209961 [0,1,0,0,0,0|2,0,0]=3 739 B17R2.216 Clc1ccc(cc1)CNCc2cccnc2 207a_100000210453_100000189385 [0,1,0,0,0,0|2,0,0]=3 740 B17R2.216 Clc1ccc(cc1)CNCc2cccnc2 2230a_100000174871_100000741622 [0,1,0,0,0,0|2,0,0]=3 741 B17R2.216 Clc1ccc(cc1)CNCc2cccnc2 270004a_100000174871_100000209961 [0,1,0,0,0,0|2,0,0]=3 742 B17R2.216 Clc1ccc(cc1)CNCc2cccnc2 270004a_100000210453_100000189385 [0,1,0,0,0,0|2,0,0]=3 743 B17R2.216 Clc1ccc(cc1)CNCc2cccnc2 34a_100000174871_100000733263 [0,1,0,0,0,0|2,0,0]=3 744 B17R2.216 Clc1ccc(cc1)CNCc2cccnn2 2230a_100000174871_100016990269 [0,1,0,0,0,0|3,0,0]=4 745 B17R2.216 Clc1ccc(cc1)CNCc2cccnn2 2230a_100159270163_100000694040 [0,1,0,0,0,0|3,0,0]=4 746 B17R2.216 Clc1ccc(cc1)CNCc2cccnn2 34a_100000174871_100016990269 [0,1,0,0,0,0|3,0,0]=4 747 B17R2.216 Clc1ccc(cc1)CNCc2ccncc2 207a_100000174871_100000186114 [0,1,0,0,0,0|2,0,0]=3 748 B17R2.216 Clc1ccc(cc1)CNCc2ccncc2 2230a_100000174871_100015193705 [0,1,0,0,0,0|2,0,0]=3 749 B17R2.216 Clc1ccc(cc1)CNCc2ccnnc2 270004a_100000174871_100011934578 [0,1,0,0,0,0|3,0,0]=4 750 B17R2.216 Clc1ccc(cc1)CNCc2cnccn2 2230a_100000174871_100016995436 [0,1,0,0,0,0|3,0,0]=4 751 B17R2.216 Clc1ccc(cc1)CNCc2cnccn2 270004a_100000174871_100000749867 [0,1,0,0,0,0|3,0,0]=4 752 B17R2.216 Clc1ccc(cc1)CNCc2cnccn2 34a_100000174871_100016995436 [0,1,0,0,0,0|3,0,0]=4 753 B17R2.216 Clc1ccc(cc1)CNCc2cncnc2 207a_100011243677_100000189385 [0,1,0,0,0,0|3,0,0]=4 754 B17R2.216 Clc1ccc(cc1)CNCc2cncnc2 2230a_100000174871_100015196519 [0,1,0,0,0,0|3,0,0]=4 755 B17R2.216 Clc1ccc(cc1)CNCc2cncnc2 2230a_100011243677_100000694040 [0,1,0,0,0,0|3,0,0]=4 756 B17R2.216 Clc1ccc(cc1)CNCc2cncnc2 270004a_100000174871_100000749868 [0,1,0,0,0,0|3,0,0]=4 757 B17R2.216 Clc1ccc(cc1)CNCc2cncnc2 270004a_100011243677_100000189385 [0,1,0,0,0,0|3,0,0]=4 758 B17R2.216 Clc1ccc(cc1)CNCc2cncnc2 34a_100000174871_100015196519 [0,1,0,0,0,0|3,0,0]=4 759 B17R2.216 Clc1ccc(cc1)CNCc2ncccn2 2230a_100000174871_100000703007 [0,1,0,0,0,0|3,0,0]=4 760 B17R2.216 Clc1ccc(cc1)CNCc2ncccn2 270004a_100000174871_100011532527 [0,1,0,0,0,0|3,0,0]=4 761 B17R2.216 Clc1ccc(cc1)CNCc2ncccn2 34a_100000174871_100000703007 [0,1,0,0,0,0|3,0,0]=4 762 B17R2.216 Clc1ccc(cc1)COCc2ccccc2 34a_100000210790_100000694040 [0,1,0,0,0,0|0,0,0]=1 763 B17R2.216 Clc1ccc(cc1)COCc2ccccc2 34a_100000211118_100015291786 [0,1,0,0,0,0|0,0,0]=1 764 B17R2.216 Clc1ccc(cc1)COCc2ccccc2 7a_100000210790_100000187161 [0,1,0,0,0,0|0,0,0]=1 765 B17R2.216 Clc1ccc(cc1)COCc2ccccc2 7a_100000211118_100000211182 [0,1,0,0,0,0|0,0,0]=1 766 B17R2.216 Clc1ccc(cc1)COCc2ccccn2 34a_100000211118_100000721315 [0,1,0,0,0,0|1,0,0]=2 767 B17R2.216 Clc1ccc(cc1)COCc2ccccn2 7a_100000211118_100000721315 [0,1,0,0,0,0|1,0,0]=2 768 B17R2.216 Clc1ccc(cc1)COCc2cccnc2 34a_100000211118_100000733263 [0,1,0,0,0,0|1,0,0]=2 769 B17R2.216 Clc1ccc(cc1)COCc2cccnc2 7a_100000211118_100000741622 [0,1,0,0,0,0|1,0,0]=2 770 B17R2.216 Clc1ccc(cc1)COCc2cccnn2 34a_100000211118_100016990269 [0,1,0,0,0,0|2,0,0]=3 771 B17R2.216 Clc1ccc(cc1)COCc2cccnn2 7a_100000211118_100016990269 [0,1,0,0,0,0|2,0,0]=3 772 B17R2.216 Clc1ccc(cc1)COCc2ccncc2 7a_100000211118_100015193705 [0,1,0,0,0,0|1,0,0]=2 773 B17R2.216 Clc1ccc(cc1)COCc2cnccn2 34a_100000211118_100016995436 [0,1,0,0,0,0|2,0,0]=3 774 B17R2.216 Clc1ccc(cc1)COCc2cnccn2 7a_100000211118_100016995436 [0,1,0,0,0,0|2,0,0]=3 775 B17R2.216 Clc1ccc(cc1)COCc2cncnc2 34a_100000211118_100015196519 [0,1,0,0,0,0|2,0,0]=3 776 B17R2.216 Clc1ccc(cc1)COCc2cncnc2 7a_100000211118_100015196519 [0,1,0,0,0,0|2,0,0]=3 777 B17R2.216 Clc1ccc(cc1)COCc2ncccn2 34a_100000211118_100000703007 [0,1,0,0,0,0|2,0,0]=3 778 B17R2.216 Clc1ccc(cc1)COCc2ncccn2 7a_100000211118_100000703007 [0,1,0,0,0,0|2,0,0]=3 779 B17R2.216 Clc1ccc(cc1)CSCc2ccccc2 62a_100000187161_100015291786 [0,1,0,0,0,0|0,1,0]=2 780 B17R2.216 Clc1ccc(cc1)CSCc2ccccc2 62a_100000211182_100000187161 [0,1,0,0,0,0|0,1,0]=2 781 B17R2.216 Clc1ccc(cc1)CSCc2ccccn2 62a_100000187161_100000721315 [0,1,0,0,0,0|1,1,0]=3 782 B17R2.216 Clc1ccc(cc1)CSCc2ccccn2 62a_100000721315_100000187161 [0,1,0,0,0,0|1,1,0]=3 783 B17R2.216 Clc1ccc(cc1)CSCc2cccnc2 62a_100000187161_100000741622 [0,1,0,0,0,0|1,1,0]=3 784 B17R2.216 Clc1ccc(cc1)CSCc2cccnc2 62a_100000741622_100000187161 [0,1,0,0,0,0|1,1,0]=3 785 B17R2.216 Clc1ccc(cc1)CSCc2cccnn2 62a_100000187161_100016990269 [0,1,0,0,0,0|2,1,0]=4 786 B17R2.216 Clc1ccc(cc1)CSCc2cccnn2 62a_100016990269_100000187161 [0,1,0,0,0,0|2,1,0]=4 787 B17R2.216 Clc1ccc(cc1)CSCc2ccncc2 62a_100000187161_100015193705 [0,1,0,0,0,0|1,1,0]=3 788 B17R2.216 Clc1ccc(cc1)CSCc2ccncc2 62a_100015193705_100000187161 [0,1,0,0,0,0|1,1,0]=3 789 B17R2.216 Clc1ccc(cc1)CSCc2cnccn2 62a_100000187161_100016995436 [0,1,0,0,0,0|2,1,0]=4 790 B17R2.216 Clc1ccc(cc1)CSCc2cnccn2 62a_100016995436_100000187161 [0,1,0,0,0,0|2,1,0]=4 791 B17R2.216 Clc1ccc(cc1)CSCc2cncnc2 62a_100000187161_100015196519 [0,1,0,0,0,0|2,1,0]=4 792 B17R2.216 Clc1ccc(cc1)CSCc2cncnc2 62a_100015196519_100000187161 [0,1,0,0,0,0|2,1,0]=4 793 B17R2.216 Clc1ccc(cc1)CSCc2ncccn2 62a_100000187161_100000703007 [0,1,0,0,0,0|2,1,0]=4 794 B17R2.216 Clc1ccc(cc1)CSCc2ncccn2 62a_100000703007_100000187161 [0,1,0,0,0,0|2,1,0]=4 795 B17R2.216 Clc1ccc(cc1)NCCc2ccccc2 2230a_100000210052_100000765856 [0,1,0,0,0,0|2,0,0]=3 796 B17R2.216 Clc1ccc(cc1)NCCc2ccccc2 34a_100000210052_100000765856 [0,1,0,0,0,0|2,0,0]=3 797 B17R2.216 Clc1ccc(cc1)NCCc2ccccn2 2230a_100000210052_100015183660 [0,1,0,0,0,0|3,0,0]=4 798 B17R2.216 Clc1ccc(cc1)NCCc2cccnc2 2230a_100000210052_200011713674 [0,1,0,0,0,0|3,0,0]=4 799 B17R2.216 Clc1ccc(cc1)NCCc2ccncc2 2230a_100000210052_100000723409 [0,1,0,0,0,0|3,0,0]=4 800 B17R2.216 Clc1ccc(cc1)NCSc2ccccc2 2230a_100000210052_100011218342 [0,1,0,0,0,0|3,0,0]=4 801 B17R2.216 Clc1ccc(cc1)NN=Cc2ccccc2 4a_100000683521_100015611070 [0,1,0,0,0,0|2,0,1]=4 802 B17R2.216 Clc1ccc(cc1)OCCc2ccccc2 34a_100000210216_100000765856 [0,1,0,0,0,0|2,0,0]=3 803 B17R2.216 Clc1ccc(cc1)OCCc2ccccc2 7a_100000210216_100000765856 [0,1,0,0,0,0|2,0,0]=3 804 B17R2.216 Clc1ccc(cc1)OCCc2ccccn2 7a_100000210216_100015183660 [0,1,0,0,0,0|3,0,0]=4 805 B17R2.216 Clc1ccc(cc1)OCCc2cccnc2 7a_100000210216_200011713674 [0,1,0,0,0,0|3,0,0]=4 806 B17R2.216 Clc1ccc(cc1)OCCc2ccncc2 7a_100000210216_100000723409 [0,1,0,0,0,0|3,0,0]=4 807 B17R2.216 Clc1ccc(cc1)SCCc2ccccc2 62a_100000755918_100011218657 [0,1,0,0,0,0|2,0,0]=3 808 B17R2.216 Clc1ccc(cc1)SCCc2ccccc2 62a_100000765856_100000755918 [0,1,0,0,0,0|2,0,0]=3 809 B17R2.216 Clc1ccc(cc1)SCCc2ccccn2 62a_100000755918_100015183660 [0,1,0,0,0,0|3,0,0]=4 810 B17R2.216 Clc1ccc(cc1)SCCc2ccccn2 62a_100015183660_100000755918 [0,1,0,0,0,0|3,0,0]=4 811 B17R2.216 Clc1ccc(cc1)SCCc2cccnc2 62a_100000755918_200011713674 [0,1,0,0,0,0|3,0,0]=4 812 B17R2.216 Clc1ccc(cc1)SCCc2cccnc2 62a_200011713674_100000755918 [0,1,0,0,0,0|3,0,0]=4 813 B17R2.216 Clc1ccc(cc1)SCCc2ccncc2 62a_100000723409_100000755918 [0,1,0,0,0,0|3,0,0]=4 814 B17R2.216 Clc1ccc(cc1)SCCc2ccncc2 62a_100000755918_100000723409 [0,1,0,0,0,0|3,0,0]=4 815 B17R2.216 Clc1ccc(cc1)SCSc2ccccc2 62a_100000755918_100011218342 [0,1,0,0,0,0|3,0,0]=4 816 B17R2.216 Clc1ccc(cc1)SCSc2ccccc2 62a_100011218342_100000755918 [0,1,0,0,0,0|3,0,0]=4 817 B17R2.216 Clc1ccc(cn1)C=CCc2ccccc2 271570a_200016263579_100000034144 [0,1,0,0,0,0|2,0,1]=4 818 B17R2.216 Clc1ccc(cn1)CNCc2ccccc2 207a_100000735879_100015611070 [0,1,0,0,0,0|2,0,0]=3 819 B17R2.216 Clc1ccc(cn1)CNCc2ccccc2 2230a_100000735879_100015291786 [0,1,0,0,0,0|2,0,0]=3 820 B17R2.216 Clc1ccc(cn1)CNCc2ccccc2 2230a_100015324214_100000735431 [0,1,0,0,0,0|2,0,0]=3 821 B17R2.216 Clc1ccc(cn1)CNCc2ccccc2 270004a_100000735879_100015611070 [0,1,0,0,0,0|2,0,0]=3 822 B17R2.216 Clc1ccc(cn1)CNCc2ccccc2 34a_100000735879_100015291786 [0,1,0,0,0,0|2,0,0]=3 823 B17R2.216 Clc1ccc(cn1)CNCc2ccccc2 34a_100015324214_100000735431 [0,1,0,0,0,0|2,0,0]=3 824 B17R2.216 Clc1ccc(cn1)CNCc2ccccn2 207a_100000735879_100000209966 [0,1,0,0,0,0|3,0,0]=4 825 B17R2.216 Clc1ccc(cn1)CNCc2ccccn2 2230a_100000735879_100000721315 [0,1,0,0,0,0|3,0,0]=4 826 B17R2.216 Clc1ccc(cn1)CNCc2ccccn2 270004a_100000735879_100000209966 [0,1,0,0,0,0|3,0,0]=4 827 B17R2.216 Clc1ccc(cn1)CNCc2ccccn2 34a_100000735879_100000721315 [0,1,0,0,0,0|3,0,0]=4 828 B17R2.216 Clc1ccc(cn1)CNCc2cccnc2 207a_100000735879_100000209961 [0,1,0,0,0,0|3,0,0]=4 829 B17R2.216 Clc1ccc(cn1)CNCc2cccnc2 2230a_100000735879_100000741622 [0,1,0,0,0,0|3,0,0]=4 830 B17R2.216 Clc1ccc(cn1)CNCc2cccnc2 270004a_100000735879_100000209961 [0,1,0,0,0,0|3,0,0]=4 831 B17R2.216 Clc1ccc(cn1)CNCc2cccnc2 34a_100000735879_100000733263 [0,1,0,0,0,0|3,0,0]=4 832 B17R2.216 Clc1ccc(cn1)CNCc2ccncc2 207a_100000735879_100000186114 [0,1,0,0,0,0|3,0,0]=4 833 B17R2.216 Clc1ccc(cn1)CNCc2ccncc2 2230a_100000735879_100015193705 [0,1,0,0,0,0|3,0,0]=4 834 B17R2.216 Clc1ccc(cn1)COCc2ccccc2 34a_100000210790_100000735431 [0,1,0,0,0,0|1,0,0]=2 835 B17R2.216 Clc1ccc(cn1)COCc2ccccc2 34a_100000755211_100015291786 [0,1,0,0,0,0|1,0,0]=2 836 B17R2.216 Clc1ccc(cn1)COCc2ccccc2 7a_100000210790_100000735431 [0,1,0,0,0,0|1,0,0]=2 837 B17R2.216 Clc1ccc(cn1)COCc2ccccc2 7a_100000755211_100000211182 [0,1,0,0,0,0|1,0,0]=2 838 B17R2.216 Clc1ccc(cn1)COCc2ccccn2 34a_100000755211_100000721315 [0,1,0,0,0,0|2,0,0]=3 839 B17R2.216 Clc1ccc(cn1)COCc2ccccn2 7a_100000755211_100000721315 [0,1,0,0,0,0|2,0,0]=3 840 B17R2.216 Clc1ccc(cn1)COCc2cccnc2 34a_100000755211_100000733263 [0,1,0,0,0,0|2,0,0]=3 841 B17R2.216 Clc1ccc(cn1)COCc2cccnc2 7a_100000755211_100000741622 [0,1,0,0,0,0|2,0,0]=3 842 B17R2.216 Clc1ccc(cn1)COCc2cccnn2 34a_100000755211_100016990269 [0,1,0,0,0,0|3,0,0]=4 843 B17R2.216 Clc1ccc(cn1)COCc2cccnn2 7a_100000755211_100016990269 [0,1,0,0,0,0|3,0,0]=4 844 B17R2.216 Clc1ccc(cn1)COCc2ccncc2 7a_100000755211_100015193705 [0,1,0,0,0,0|2,0,0]=3 845 B17R2.216 Clc1ccc(cn1)COCc2cnccn2 34a_100000755211_100016995436 [0,1,0,0,0,0|3,0,0]=4 846 B17R2.216 Clc1ccc(cn1)COCc2cnccn2 7a_100000755211_100016995436 [0,1,0,0,0,0|3,0,0]=4 847 B17R2.216 Clc1ccc(cn1)COCc2cncnc2 34a_100000755211_100015196519 [0,1,0,0,0,0|3,0,0]=4 848 B17R2.216 Clc1ccc(cn1)COCc2cncnc2 7a_100000755211_100015196519 [0,1,0,0,0,0|3,0,0]=4 849 B17R2.216 Clc1ccc(cn1)COCc2ncccn2 34a_100000755211_100000703007 [0,1,0,0,0,0|3,0,0]=4 850 B17R2.216 Clc1ccc(cn1)COCc2ncccn2 7a_100000755211_100000703007 [0,1,0,0,0,0|3,0,0]=4 851 B17R2.216 Clc1ccc(cn1)CSCc2ccccc2 62a_100000211182_100000735431 [0,1,0,0,0,0|1,1,0]=3 852 B17R2.216 Clc1ccc(cn1)CSCc2ccccc2 62a_100000735431_100015291786 [0,1,0,0,0,0|1,1,0]=3 853 B17R2.216 Clc1ccc(cn1)CSCc2ccccn2 62a_100000721315_100000735431 [0,1,0,0,0,0|2,1,0]=4 854 B17R2.216 Clc1ccc(cn1)CSCc2ccccn2 62a_100000735431_100000721315 [0,1,0,0,0,0|2,1,0]=4 855 B17R2.216 Clc1ccc(cn1)CSCc2cccnc2 62a_100000735431_100000741622 [0,1,0,0,0,0|2,1,0]=4 856 B17R2.216 Clc1ccc(cn1)CSCc2cccnc2 62a_100000741622_100000735431 [0,1,0,0,0,0|2,1,0]=4 857 B17R2.216 Clc1ccc(cn1)CSCc2ccncc2 62a_100000735431_100015193705 [0,1,0,0,0,0|2,1,0]=4 858 B17R2.216 Clc1ccc(cn1)CSCc2ccncc2 62a_100015193705_100000735431 [0,1,0,0,0,0|2,1,0]=4 859 B17R2.216 Clc1ccc(cn1)OCCc2ccccc2 34a_100000744096_100000765856 [0,1,0,0,0,0|3,0,0]=4 860 B17R2.216 Clc1ccc(cn1)OCCc2ccccc2 7a_100000744096_100000765856 [0,1,0,0,0,0|3,0,0]=4 861 B17R2.216 Clc1ccc(cn1)SCCc2ccccc2 62a_100000034144_100011218657 [0,1,0,0,0,0|3,0,0]=4 862 B17R2.216 Clc1ccc(cn1)SCCc2ccccc2 62a_100000765856_100000034144 [0,1,0,0,0,0|3,0,0]=4 863 B17R2.216 Clc1ccc(nc1)C=CCc2ccccc2 271570a_200016263579_100011356976 [0,1,0,0,0,0|2,0,1]=4 864 B17R2.216 Clc1ccc(nc1)CNCc2ccccc2 207a_100015324214_100011361569 [0,1,0,0,0,0|2,0,0]=3 865 B17R2.216 Clc1ccc(nc1)CNCc2ccccc2 2230a_100015324214_100012066911 [0,1,0,0,0,0|2,0,0]=3 866 B17R2.216 Clc1ccc(nc1)CNCc2ccccc2 270004a_100000697193_100015611070 [0,1,0,0,0,0|2,0,0]=3 867 B17R2.216 Clc1ccc(nc1)CNCc2ccccc2 270004a_100015324214_100011361569 [0,1,0,0,0,0|2,0,0]=3 868 B17R2.216 Clc1ccc(nc1)CNCc2ccccc2 34a_100000697193_100015291786 [0,1,0,0,0,0|2,0,0]=3 869 B17R2.216 Clc1ccc(nc1)CNCc2ccccc2 34a_100015324214_100012066911 [0,1,0,0,0,0|2,0,0]=3 870 B17R2.216 Clc1ccc(nc1)CNCc2ccccn2 270004a_100000210449_100011361569 [0,1,0,0,0,0|3,0,0]=4 871 B17R2.216 Clc1ccc(nc1)CNCc2ccccn2 270004a_100000697193_100000209966 [0,1,0,0,0,0|3,0,0]=4 872 B17R2.216 Clc1ccc(nc1)CNCc2ccccn2 34a_100000697193_100000721315 [0,1,0,0,0,0|3,0,0]=4 873 B17R2.216 Clc1ccc(nc1)CNCc2cccnc2 207a_100000210453_100011361569 [0,1,0,0,0,0|3,0,0]=4 874 B17R2.216 Clc1ccc(nc1)CNCc2cccnc2 270004a_100000210453_100011361569 [0,1,0,0,0,0|3,0,0]=4 875 B17R2.216 Clc1ccc(nc1)CNCc2cccnc2 270004a_100000697193_100000209961 [0,1,0,0,0,0|3,0,0]=4 876 B17R2.216 Clc1ccc(nc1)CNCc2cccnc2 34a_100000697193_100000733263 [0,1,0,0,0,0|3,0,0]=4 877 B17R2.216 Clc1ccc(nc1)COCc2ccccc2 34a_100000210790_100012066911 [0,1,0,0,0,0|1,0,0]=2 878 B17R2.216 Clc1ccc(nc1)COCc2ccccc2 34a_100000703999_100015291786 [0,1,0,0,0,0|1,0,0]=2 879 B17R2.216 Clc1ccc(nc1)COCc2ccccc2 7a_100000210790_100012066911 [0,1,0,0,0,0|1,0,0]=2 880 B17R2.216 Clc1ccc(nc1)COCc2ccccn2 34a_100000703999_100000721315 [0,1,0,0,0,0|2,0,0]=3 881 B17R2.216 Clc1ccc(nc1)COCc2cccnc2 34a_100000703999_100000733263 [0,1,0,0,0,0|2,0,0]=3 882 B17R2.216 Clc1ccc(nc1)COCc2cccnn2 34a_100000703999_100016990269 [0,1,0,0,0,0|3,0,0]=4 883 B17R2.216 Clc1ccc(nc1)COCc2cnccn2 34a_100000703999_100016995436 [0,1,0,0,0,0|3,0,0]=4 884 B17R2.216 Clc1ccc(nc1)COCc2cncnc2 34a_100000703999_100015196519 [0,1,0,0,0,0|3,0,0]=4 885 B17R2.216 Clc1ccc(nc1)COCc2ncccn2 34a_100000703999_100000703007 [0,1,0,0,0,0|3,0,0]=4 886 B17R2.216 Clc1ccc(nc1)CSCc2ccccc2 62a_100000211182_100000697101 [0,1,0,0,0,0|1,1,0]=3 887 B17R2.216 Clc1ccc(nc1)CSCc2ccccc2 62a_100012066911_100015291786 [0,1,0,0,0,0|1,1,0]=3 888 B17R2.216 Clc1ccc(nc1)CSCc2ccccn2 62a_100000721315_100000697101 [0,1,0,0,0,0|2,1,0]=4 889 B17R2.216 Clc1ccc(nc1)CSCc2ccccn2 62a_100012066911_100000721315 [0,1,0,0,0,0|2,1,0]=4 890 B17R2.216 Clc1ccc(nc1)CSCc2cccnc2 62a_100000741622_100000697101 [0,1,0,0,0,0|2,1,0]=4 891 B17R2.216 Clc1ccc(nc1)CSCc2cccnc2 62a_100012066911_100000741622 [0,1,0,0,0,0|2,1,0]=4 892 B17R2.216 Clc1ccc(nc1)CSCc2ccncc2 62a_100012066911_100015193705 [0,1,0,0,0,0|2,1,0]=4 893 B17R2.216 Clc1ccc(nc1)CSCc2ccncc2 62a_100015193705_100000697101 [0,1,0,0,0,0|2,1,0]=4 894 B17R2.216 Clc1ccc(nc1)OCCc2ccccc2 34a_100011215309_100000765856 [0,1,0,0,0,0|3,0,0]=4 895 B17R2.216 Clc1ccc(nc1)SCCc2ccccc2 62a_100000765856_100011356976 [0,1,0,0,0,0|3,0,0]=4 896 B17R2.216 Clc1ccc(nc1)SCCc2ccccc2 62a_100011356976_100011218657 [0,1,0,0,0,0|3,0,0]=4 897 B17R2.216 Clc1ccc(nn1)CNCc2ccccc2 2230a_100015324214_100016992710 [0,1,0,0,0,0|3,0,0]=4 898 B17R2.216 Clc1ccc(nn1)CNCc2ccccc2 270004a_100015324214_100000044651 [0,1,0,0,0,0|3,0,0]=4 899 B17R2.216 Clc1ccc(nn1)CNCc2ccccc2 34a_100015324214_100016992710 [0,1,0,0,0,0|3,0,0]=4 900 B17R2.216 Clc1ccc(nn1)COCc2ccccc2 34a_100000210790_100016992710 [0,1,0,0,0,0|2,0,0]=3 901 B17R2.216 Clc1ccc(nn1)COCc2ccccc2 7a_100000210790_100016992710 [0,1,0,0,0,0|2,0,0]=3 902 B17R2.216 Clc1ccc(nn1)CSCc2ccccc2 62a_100000211182_100016992710 [0,1,0,0,0,0|2,1,0]=4 903 B17R2.216 Clc1ccc(nn1)CSCc2ccccc2 62a_100016992710_100015291786 [0,1,0,0,0,0|2,1,0]=4 904 B17R2.216 Clc1cnc(cn1)CNCc2ccccc2 270004a_100015324214_100012001714 [0,1,0,0,0,0|3,0,0]=4 905 B17R2.216 Clc1cnc(cn1)COCc2ccccc2 34a_100012002382_100015291786 [0,1,0,0,0,0|2,0,0]=3 906 B17R2.216 Clc1cnc(cn1)COCc2ccccn2 34a_100012002382_100000721315 [0,1,0,0,0,0|3,0,0]=4 907 B17R2.216 Clc1cnc(cn1)COCc2cccnc2 34a_100012002382_100000733263 [0,1,0,0,0,0|3,0,0]=4 908 B17R2.216 Clc1ncc(cn1)COCc2ccccc2 34a_100009855073_100015291786 [0,1,0,0,0,0|2,0,0]=3 909 B17R2.216 Clc1ncc(cn1)COCc2ccccc2 7a_100009855073_100000211182 [0,1,0,0,0,0|2,0,0]=3 910 B17R2.216 Clc1ncc(cn1)COCc2ccccn2 34a_100009855073_100000721315 [0,1,0,0,0,0|3,0,0]=4 911 B17R2.216 Clc1ncc(cn1)COCc2ccccn2 7a_100009855073_100000721315 [0,1,0,0,0,0|3,0,0]=4 912 B17R2.216 Clc1ncc(cn1)COCc2cccnc2 34a_100009855073_100000733263 [0,1,0,0,0,0|3,0,0]=4 913 B17R2.216 Clc1ncc(cn1)COCc2cccnc2 7a_100009855073_100000741622 [0,1,0,0,0,0|3,0,0]=4 914 B17R2.216 Clc1ncc(cn1)COCc2ccncc2 7a_100009855073_100015193705 [0,1,0,0,0,0|3,0,0]=4 915 B17R2.216 Fc1ccc(cc1)C=CCc2ccccc2 271570a_200016263579_100000211213 [0,1,0,0,0,0|1,0,1]=3 916 B17R2.216 Fc1ccc(cc1)C=NNc2ccccc2 4a_100015195140_100000210084 [0,1,0,0,0,0|2,0,1]=4 917 B17R2.216 Fc1ccc(cc1)CCNc2ccccc2 34a_100000106764_100011217392 [0,1,0,0,0,0|2,0,0]=3 918 B17R2.216 Fc1ccc(cc1)CCOc2ccccc2 34a_100000210340_100011217392 [0,1,0,0,0,0|2,0,0]=3 919 B17R2.216 Fc1ccc(cc1)CCOc2ccccc2 7a_100000210340_100011217392 [0,1,0,0,0,0|2,0,0]=3 920 B17R2.216 Fc1ccc(cc1)CCOc2cccnc2 34a_100000210849_100011217392 [0,1,0,0,0,0|3,0,0]=4 921 B17R2.216 Fc1ccc(cc1)CCOc2cccnc2 7a_100000210849_100011217392 [0,1,0,0,0,0|3,0,0]=4 922 B17R2.216 Fc1ccc(cc1)CCOc2ccncc2 34a_100000212176_100011217392 [0,1,0,0,0,0|3,0,0]=4 923 B17R2.216 Fc1ccc(cc1)CCSc2ccccc2 62a_100000719477_100011217392 [0,1,0,0,0,0|2,0,0]=3 924 B17R2.216 Fc1ccc(cc1)CCSc2ccccc2 62a_100011217392_100000041952 [0,1,0,0,0,0|2,0,0]=3 925 B17R2.216 Fc1ccc(cc1)CCSc2ccccn2 62a_100011216584_100011217392 [0,1,0,0,0,0|3,0,0]=4 926 B17R2.216 Fc1ccc(cc1)CCSc2ccccn2 62a_100011217392_100011216584 [0,1,0,0,0,0|3,0,0]=4 927 B17R2.216 Fc1ccc(cc1)CCSc2cccnc2 62a_100000210063_100011217392 [0,1,0,0,0,0|3,0,0]=4 928 B17R2.216 Fc1ccc(cc1)CCSc2cccnc2 62a_100011217392_100000210063 [0,1,0,0,0,0|3,0,0]=4 929 B17R2.216 Fc1ccc(cc1)CCSc2ccncc2 62a_100000728582_100011217392 [0,1,0,0,0,0|3,0,0]=4 930 B17R2.216 Fc1ccc(cc1)CCSc2ccncc2 62a_100011217392_100000728582 [0,1,0,0,0,0|3,0,0]=4 931 B17R2.216 Fc1ccc(cc1)CNCc2ccccc2 207a_100000174882_100015611070 [0,1,0,0,0,0|1,0,0]=2 932 B17R2.216 Fc1ccc(cc1)CNCc2ccccc2 207a_100015324214_100000210084 [0,1,0,0,0,0|1,0,0]=2 933 B17R2.216 Fc1ccc(cc1)CNCc2ccccc2 2230a_100000174882_100015291786 [0,1,0,0,0,0|1,0,0]=2 934 B17R2.216 Fc1ccc(cc1)CNCc2ccccc2 2230a_100015324214_100000198546 [0,1,0,0,0,0|1,0,0]=2 935 B17R2.216 Fc1ccc(cc1)CNCc2ccccc2 270004a_100000174882_100015611070 [0,1,0,0,0,0|1,0,0]=2 936 B17R2.216 Fc1ccc(cc1)CNCc2ccccc2 270004a_100015324214_100000210084 [0,1,0,0,0,0|1,0,0]=2 937 B17R2.216 Fc1ccc(cc1)CNCc2ccccc2 34a_100000174882_100015291786 [0,1,0,0,0,0|1,0,0]=2 938 B17R2.216 Fc1ccc(cc1)CNCc2ccccc2 34a_100015324214_100000198546 [0,1,0,0,0,0|1,0,0]=2 939 B17R2.216 Fc1ccc(cc1)CNCc2ccccn2 207a_100000174882_100000209966 [0,1,0,0,0,0|2,0,0]=3 940 B17R2.216 Fc1ccc(cc1)CNCc2ccccn2 2230a_100000174882_100000721315 [0,1,0,0,0,0|2,0,0]=3 941 B17R2.216 Fc1ccc(cc1)CNCc2ccccn2 270004a_100000174882_100000209966 [0,1,0,0,0,0|2,0,0]=3 942 B17R2.216 Fc1ccc(cc1)CNCc2ccccn2 270004a_100000210449_100000210084 [0,1,0,0,0,0|2,0,0]=3 943 B17R2.216 Fc1ccc(cc1)CNCc2ccccn2 34a_100000174882_100000721315 [0,1,0,0,0,0|2,0,0]=3 944 B17R2.216 Fc1ccc(cc1)CNCc2cccnc2 207a_100000174882_100000209961 [0,1,0,0,0,0|2,0,0]=3 945 B17R2.216 Fc1ccc(cc1)CNCc2cccnc2 207a_100000210453_100000210084 [0,1,0,0,0,0|2,0,0]=3 946 B17R2.216 Fc1ccc(cc1)CNCc2cccnc2 2230a_100000174882_100000741622 [0,1,0,0,0,0|2,0,0]=3 947 B17R2.216 Fc1ccc(cc1)CNCc2cccnc2 270004a_100000174882_100000209961 [0,1,0,0,0,0|2,0,0]=3 948 B17R2.216 Fc1ccc(cc1)CNCc2cccnc2 270004a_100000210453_100000210084 [0,1,0,0,0,0|2,0,0]=3 949 B17R2.216 Fc1ccc(cc1)CNCc2cccnc2 34a_100000174882_100000733263 [0,1,0,0,0,0|2,0,0]=3 950 B17R2.216 Fc1ccc(cc1)CNCc2cccnn2 2230a_100000174882_100016990269 [0,1,0,0,0,0|3,0,0]=4 951 B17R2.216 Fc1ccc(cc1)CNCc2cccnn2 2230a_100159270163_100000198546 [0,1,0,0,0,0|3,0,0]=4 952 B17R2.216 Fc1ccc(cc1)CNCc2cccnn2 34a_100000174882_100016990269 [0,1,0,0,0,0|3,0,0]=4 953 B17R2.216 Fc1ccc(cc1)CNCc2ccncc2 207a_100000174882_100000186114 [0,1,0,0,0,0|2,0,0]=3 954 B17R2.216 Fc1ccc(cc1)CNCc2ccncc2 2230a_100000174882_100015193705 [0,1,0,0,0,0|2,0,0]=3 955 B17R2.216 Fc1ccc(cc1)CNCc2ccnnc2 270004a_100000174882_100011934578 [0,1,0,0,0,0|3,0,0]=4 956 B17R2.216 Fc1ccc(cc1)CNCc2cnccn2 2230a_100000174882_100016995436 [0,1,0,0,0,0|3,0,0]=4 957 B17R2.216 Fc1ccc(cc1)CNCc2cnccn2 270004a_100000174882_100000749867 [0,1,0,0,0,0|3,0,0]=4 958 B17R2.216 Fc1ccc(cc1)CNCc2cnccn2 34a_100000174882_100016995436 [0,1,0,0,0,0|3,0,0]=4 959 B17R2.216 Fc1ccc(cc1)CNCc2cncnc2 207a_100011243677_100000210084 [0,1,0,0,0,0|3,0,0]=4 960 B17R2.216 Fc1ccc(cc1)CNCc2cncnc2 2230a_100000174882_100015196519 [0,1,0,0,0,0|3,0,0]=4 961 B17R2.216 Fc1ccc(cc1)CNCc2cncnc2 2230a_100011243677_100000198546 [0,1,0,0,0,0|3,0,0]=4 962 B17R2.216 Fc1ccc(cc1)CNCc2cncnc2 270004a_100000174882_100000749868 [0,1,0,0,0,0|3,0,0]=4 963 B17R2.216 Fc1ccc(cc1)CNCc2cncnc2 270004a_100011243677_100000210084 [0,1,0,0,0,0|3,0,0]=4 964 B17R2.216 Fc1ccc(cc1)CNCc2cncnc2 34a_100000174882_100015196519 [0,1,0,0,0,0|3,0,0]=4 965 B17R2.216 Fc1ccc(cc1)CNCc2ncccn2 2230a_100000174882_100000703007 [0,1,0,0,0,0|3,0,0]=4 966 B17R2.216 Fc1ccc(cc1)CNCc2ncccn2 270004a_100000174882_100011532527 [0,1,0,0,0,0|3,0,0]=4 967 B17R2.216 Fc1ccc(cc1)CNCc2ncccn2 34a_100000174882_100000703007 [0,1,0,0,0,0|3,0,0]=4 968 B17R2.216 Fc1ccc(cc1)COCc2ccccc2 34a_100000210790_100000198546 [0,1,0,0,0,0|0,0,0]=1 969 B17R2.216 Fc1ccc(cc1)COCc2ccccc2 34a_100000210977_100015291786 [0,1,0,0,0,0|0,0,0]=1 970 B17R2.216 Fc1ccc(cc1)COCc2ccccc2 7a_100000210790_100000198546 [0,1,0,0,0,0|0,0,0]=1 971 B17R2.216 Fc1ccc(cc1)COCc2ccccc2 7a_100000210977_100000211182 [0,1,0,0,0,0|0,0,0]=1 972 B17R2.216 Fc1ccc(cc1)COCc2ccccn2 34a_100000210977_100000721315 [0,1,0,0,0,0|1,0,0]=2 973 B17R2.216 Fc1ccc(cc1)COCc2ccccn2 7a_100000210977_100000721315 [0,1,0,0,0,0|1,0,0]=2 974 B17R2.216 Fc1ccc(cc1)COCc2cccnc2 34a_100000210977_100000733263 [0,1,0,0,0,0|1,0,0]=2 975 B17R2.216 Fc1ccc(cc1)COCc2cccnc2 7a_100000210977_100000741622 [0,1,0,0,0,0|1,0,0]=2 976 B17R2.216 Fc1ccc(cc1)COCc2cccnn2 34a_100000210977_100016990269 [0,1,0,0,0,0|2,0,0]=3 977 B17R2.216 Fc1ccc(cc1)COCc2cccnn2 7a_100000210977_100016990269 [0,1,0,0,0,0|2,0,0]=3 978 B17R2.216 Fc1ccc(cc1)COCc2ccncc2 7a_100000210977_100015193705 [0,1,0,0,0,0|1,0,0]=2 979 B17R2.216 Fc1ccc(cc1)COCc2cnccn2 34a_100000210977_100016995436 [0,1,0,0,0,0|2,0,0]=3 980 B17R2.216 Fc1ccc(cc1)COCc2cnccn2 7a_100000210977_100016995436 [0,1,0,0,0,0|2,0,0]=3 981 B17R2.216 Fc1ccc(cc1)COCc2cncnc2 34a_100000210977_100015196519 [0,1,0,0,0,0|2,0,0]=3 982 B17R2.216 Fc1ccc(cc1)COCc2cncnc2 7a_100000210977_100015196519 [0,1,0,0,0,0|2,0,0]=3 983 B17R2.216 Fc1ccc(cc1)COCc2ncccn2 34a_100000210977_100000703007 [0,1,0,0,0,0|2,0,0]=3 984 B17R2.216 Fc1ccc(cc1)COCc2ncccn2 7a_100000210977_100000703007 [0,1,0,0,0,0|2,0,0]=3 985 B17R2.216 Fc1ccc(cc1)CSCc2ccccc2 62a_100000198546_100015291786 [0,1,0,0,0,0|0,1,0]=2 986 B17R2.216 Fc1ccc(cc1)CSCc2ccccc2 62a_100000211182_100000187164 [0,1,0,0,0,0|0,1,0]=2 987 B17R2.216 Fc1ccc(cc1)CSCc2ccccn2 62a_100000198546_100000721315 [0,1,0,0,0,0|1,1,0]=3 988 B17R2.216 Fc1ccc(cc1)CSCc2ccccn2 62a_100000721315_100000187164 [0,1,0,0,0,0|1,1,0]=3 989 B17R2.216 Fc1ccc(cc1)CSCc2cccnc2 62a_100000198546_100000741622 [0,1,0,0,0,0|1,1,0]=3 990 B17R2.216 Fc1ccc(cc1)CSCc2cccnc2 62a_100000741622_100000187164 [0,1,0,0,0,0|1,1,0]=3 991 B17R2.216 Fc1ccc(cc1)CSCc2cccnn2 62a_100000198546_100016990269 [0,1,0,0,0,0|2,1,0]=4 992 B17R2.216 Fc1ccc(cc1)CSCc2cccnn2 62a_100016990269_100000187164 [0,1,0,0,0,0|2,1,0]=4 993 B17R2.216 Fc1ccc(cc1)CSCc2ccncc2 62a_100000198546_100015193705 [0,1,0,0,0,0|1,1,0]=3 994 B17R2.216 Fc1ccc(cc1)CSCc2ccncc2 62a_100015193705_100000187164 [0,1,0,0,0,0|1,1,0]=3 995 B17R2.216 Fc1ccc(cc1)CSCc2cnccn2 62a_100000198546_100016995436 [0,1,0,0,0,0|2,1,0]=4 996 B17R2.216 Fc1ccc(cc1)CSCc2cnccn2 62a_100016995436_100000187164 [0,1,0,0,0,0|2,1,0]=4 997 B17R2.216 Fc1ccc(cc1)CSCc2cncnc2 62a_100000198546_100015196519 [0,1,0,0,0,0|2,1,0]=4 998 B17R2.216 Fc1ccc(cc1)CSCc2cncnc2 62a_100015196519_100000187164 [0,1,0,0,0,0|2,1,0]=4 999 B17R2.216 Fc1ccc(cc1)CSCc2ncccn2 62a_100000198546_100000703007 [0,1,0,0,0,0|2,1,0]=4 1000 B17R2.216 Fc1ccc(cc1)CSCc2ncccn2 62a_100000703007_100000187164 [0,1,0,0,0,0|2,1,0]=4 1001 B17R2.216 Fc1ccc(cc1)NCCc2ccccc2 34a_100000185862_100000765856 [0,1,0,0,0,0|2,0,0]=3 1002 B17R2.216 Fc1ccc(cc1)NN=Cc2ccccc2 4a_100000728448_100015611070 [0,1,0,0,0,0|2,0,1]=4 1003 B17R2.216 Fc1ccc(cc1)OCCc2ccccc2 34a_100000210339_100000765856 [0,1,0,0,0,0|2,0,0]=3 1004 B17R2.216 Fc1ccc(cc1)SCCc2ccccc2 62a_100000211213_100011218657 [0,1,0,0,0,0|2,0,0]=3 1005 B17R2.216 Fc1ccc(cc1)SCCc2ccccc2 62a_100000765856_100000211213 [0,1,0,0,0,0|2,0,0]=3 1006 B17R2.216 Fc1ccc(cc1)SCCc2ccccn2 62a_100000211213_100015183660 [0,1,0,0,0,0|3,0,0]=4 1007 B17R2.216 Fc1ccc(cc1)SCCc2ccccn2 62a_100015183660_100000211213 [0,1,0,0,0,0|3,0,0]=4 1008 B17R2.216 Fc1ccc(cc1)SCCc2cccnc2 62a_100000211213_200011713674 [0,1,0,0,0,0|3,0,0]=4 1009 B17R2.216 Fc1ccc(cc1)SCCc2cccnc2 62a_200011713674_100000211213 [0,1,0,0,0,0|3,0,0]=4 1010 B17R2.216 Fc1ccc(cc1)SCCc2ccncc2 62a_100000211213_100000723409 [0,1,0,0,0,0|3,0,0]=4 1011 B17R2.216 Fc1ccc(cc1)SCCc2ccncc2 62a_100000723409_100000211213 [0,1,0,0,0,0|3,0,0]=4 1012 B17R2.216 Fc1ccc(cc1)SCSc2ccccc2 62a_100000211213_100011218342 [0,1,0,0,0,0|3,0,0]=4 1013 B17R2.216 Fc1ccc(cc1)SCSc2ccccc2 62a_100011218342_100000211213 [0,1,0,0,0,0|3,0,0]=4 1014 B17R2.216 Fc1ccc(cn1)C=CCc2ccccc2 271570a_200016263579_100000748661 [0,1,0,0,0,0|2,0,1]=4 1015 B17R2.216 Fc1ccc(cn1)CNCc2ccccc2 2230a_100000101913_100015291786 [0,1,0,0,0,0|2,0,0]=3 1016 B17R2.216 Fc1ccc(cn1)CNCc2ccccc2 2230a_100015324214_100009820150 [0,1,0,0,0,0|2,0,0]=3 1017 B17R2.216 Fc1ccc(cn1)CNCc2ccccc2 270004a_100000101913_100015611070 [0,1,0,0,0,0|2,0,0]=3 1018 B17R2.216 Fc1ccc(cn1)CNCc2ccccc2 34a_100000101913_100015291786 [0,1,0,0,0,0|2,0,0]=3 1019 B17R2.216 Fc1ccc(cn1)CNCc2ccccc2 34a_100015324214_100000099788 [0,1,0,0,0,0|2,0,0]=3 1020 B17R2.216 Fc1ccc(cn1)CNCc2ccccn2 2230a_100000101913_100000721315 [0,1,0,0,0,0|3,0,0]=4 1021 B17R2.216 Fc1ccc(cn1)CNCc2ccccn2 270004a_100000101913_100000209966 [0,1,0,0,0,0|3,0,0]=4 1022 B17R2.216 Fc1ccc(cn1)CNCc2ccccn2 34a_100000101913_100000721315 [0,1,0,0,0,0|3,0,0]=4 1023 B17R2.216 Fc1ccc(cn1)CNCc2cccnc2 2230a_100000101913_100000741622 [0,1,0,0,0,0|3,0,0]=4 1024 B17R2.216 Fc1ccc(cn1)CNCc2cccnc2 270004a_100000101913_100000209961 [0,1,0,0,0,0|3,0,0]=4 1025 B17R2.216 Fc1ccc(cn1)CNCc2cccnc2 34a_100000101913_100000733263 [0,1,0,0,0,0|3,0,0]=4 1026 B17R2.216 Fc1ccc(cn1)CNCc2ccncc2 2230a_100000101913_100015193705 [0,1,0,0,0,0|3,0,0]=4 1027 B17R2.216 Fc1ccc(cn1)COCc2ccccc2 34a_100000079959_100015291786 [0,1,0,0,0,0|1,0,0]=2 1028 B17R2.216 Fc1ccc(cn1)COCc2ccccc2 34a_100000210790_100000099788 [0,1,0,0,0,0|1,0,0]=2 1029 B17R2.216 Fc1ccc(cn1)COCc2ccccc2 7a_100000210790_100009820150 [0,1,0,0,0,0|1,0,0]=2 1030 B17R2.216 Fc1ccc(cn1)COCc2ccccn2 34a_100000079959_100000721315 [0,1,0,0,0,0|2,0,0]=3 1031 B17R2.216 Fc1ccc(cn1)COCc2cccnc2 34a_100000079959_100000733263 [0,1,0,0,0,0|2,0,0]=3 1032 B17R2.216 Fc1ccc(cn1)COCc2cccnn2 34a_100000079959_100016990269 [0,1,0,0,0,0|3,0,0]=4 1033 B17R2.216 Fc1ccc(cn1)COCc2cnccn2 34a_100000079959_100016995436 [0,1,0,0,0,0|3,0,0]=4 1034 B17R2.216 Fc1ccc(cn1)COCc2cncnc2 34a_100000079959_100015196519 [0,1,0,0,0,0|3,0,0]=4 1035 B17R2.216 Fc1ccc(cn1)COCc2ncccn2 34a_100000079959_100000703007 [0,1,0,0,0,0|3,0,0]=4 1036 B17R2.216 Fc1ccc(cn1)CSCc2ccccc2 62a_100000211182_100000099788 [0,1,0,0,0,0|1,1,0]=3 1037 B17R2.216 Fc1ccc(cn1)CSCc2ccccc2 62a_100009820150_100015291786 [0,1,0,0,0,0|1,1,0]=3 1038 B17R2.216 Fc1ccc(cn1)CSCc2ccccn2 62a_100000721315_100000099788 [0,1,0,0,0,0|2,1,0]=4 1039 B17R2.216 Fc1ccc(cn1)CSCc2ccccn2 62a_100009820150_100000721315 [0,1,0,0,0,0|2,1,0]=4 1040 B17R2.216 Fc1ccc(cn1)CSCc2cccnc2 62a_100000741622_100000099788 [0,1,0,0,0,0|2,1,0]=4 1041 B17R2.216 Fc1ccc(cn1)CSCc2cccnc2 62a_100009820150_100000741622 [0,1,0,0,0,0|2,1,0]=4 1042 B17R2.216 Fc1ccc(cn1)CSCc2ccncc2 62a_100009820150_100015193705 [0,1,0,0,0,0|2,1,0]=4 1043 B17R2.216 Fc1ccc(cn1)CSCc2ccncc2 62a_100015193705_100000099788 [0,1,0,0,0,0|2,1,0]=4 1044 B17R2.216 Fc1ccc(cn1)OCCc2ccccc2 34a_100000688820_100000765856 [0,1,0,0,0,0|3,0,0]=4 1045 B17R2.216 Fc1ccc(cn1)OCCc2ccccc2 7a_100000688820_100000765856 [0,1,0,0,0,0|3,0,0]=4 1046 B17R2.216 Fc1ccc(cn1)SCCc2ccccc2 62a_100000042367_100011218657 [0,1,0,0,0,0|3,0,0]=4 1047 B17R2.216 Fc1ccc(cn1)SCCc2ccccc2 62a_100000765856_100000042367 [0,1,0,0,0,0|3,0,0]=4 1048 B17R2.216 Fc1ccc(nc1)C=CCc2ccccc2 271570a_200016263579_100000744514 [0,1,0,0,0,0|2,0,1]=4 1049 B17R2.216 Fc1ccc(nc1)CNCc2ccccc2 207a_100015324214_100011934744 [0,1,0,0,0,0|2,0,0]=3 1050 B17R2.216 Fc1ccc(nc1)CNCc2ccccc2 2230a_100015324214_100000703193 [0,1,0,0,0,0|2,0,0]=3 1051 B17R2.216 Fc1ccc(nc1)CNCc2ccccc2 270004a_100015324214_100011934744 [0,1,0,0,0,0|2,0,0]=3 1052 B17R2.216 Fc1ccc(nc1)CNCc2ccccc2 34a_100015324214_100000703193 [0,1,0,0,0,0|2,0,0]=3 1053 B17R2.216 Fc1ccc(nc1)CNCc2ccccc2 34a_100020620131_100015291786 [0,1,0,0,0,0|2,0,0]=3 1054 B17R2.216 Fc1ccc(nc1)CNCc2ccccn2 270004a_100000210449_100011934744 [0,1,0,0,0,0|3,0,0]=4 1055 B17R2.216 Fc1ccc(nc1)CNCc2ccccn2 34a_100020620131_100000721315 [0,1,0,0,0,0|3,0,0]=4 1056 B17R2.216 Fc1ccc(nc1)CNCc2cccnc2 207a_100000210453_100011934744 [0,1,0,0,0,0|3,0,0]=4 1057 B17R2.216 Fc1ccc(nc1)CNCc2cccnc2 270004a_100000210453_100011934744 [0,1,0,0,0,0|3,0,0]=4 1058 B17R2.216 Fc1ccc(nc1)CNCc2cccnc2 34a_100020620131_100000733263 [0,1,0,0,0,0|3,0,0]=4 1059 B17R2.216 Fc1ccc(nc1)COCc2ccccc2 34a_100000210790_100000703193 [0,1,0,0,0,0|1,0,0]=2 1060 B17R2.216 Fc1ccc(nc1)COCc2ccccc2 34a_100011999454_100015291786 [0,1,0,0,0,0|1,0,0]=2 1061 B17R2.216 Fc1ccc(nc1)COCc2ccccc2 7a_100000210790_100000703193 [0,1,0,0,0,0|1,0,0]=2 1062 B17R2.216 Fc1ccc(nc1)COCc2ccccn2 34a_100011999454_100000721315 [0,1,0,0,0,0|2,0,0]=3 1063 B17R2.216 Fc1ccc(nc1)COCc2cccnc2 34a_100011999454_100000733263 [0,1,0,0,0,0|2,0,0]=3 1064 B17R2.216 Fc1ccc(nc1)COCc2cccnn2 34a_100011999454_100016990269 [0,1,0,0,0,0|3,0,0]=4 1065 B17R2.216 Fc1ccc(nc1)COCc2cnccn2 34a_100011999454_100016995436 [0,1,0,0,0,0|3,0,0]=4 1066 B17R2.216 Fc1ccc(nc1)COCc2cncnc2 34a_100011999454_100015196519 [0,1,0,0,0,0|3,0,0]=4 1067 B17R2.216 Fc1ccc(nc1)COCc2ncccn2 34a_100011999454_100000703007 [0,1,0,0,0,0|3,0,0]=4 1068 B17R2.216 Fc1ccc(nc1)CSCc2ccccc2 62a_100000211182_100000703193 [0,1,0,0,0,0|1,1,0]=3 1069 B17R2.216 Fc1ccc(nc1)CSCc2ccccc2 62a_100000703193_100015291786 [0,1,0,0,0,0|1,1,0]=3 1070 B17R2.216 Fc1ccc(nc1)CSCc2ccccn2 62a_100000703193_100000721315 [0,1,0,0,0,0|2,1,0]=4 1071 B17R2.216 Fc1ccc(nc1)CSCc2ccccn2 62a_100000721315_100000703193 [0,1,0,0,0,0|2,1,0]=4 1072 B17R2.216 Fc1ccc(nc1)CSCc2cccnc2 62a_100000703193_100000741622 [0,1,0,0,0,0|2,1,0]=4 1073 B17R2.216 Fc1ccc(nc1)CSCc2cccnc2 62a_100000741622_100000703193 [0,1,0,0,0,0|2,1,0]=4 1074 B17R2.216 Fc1ccc(nc1)CSCc2ccncc2 62a_100000703193_100015193705 [0,1,0,0,0,0|2,1,0]=4 1075 B17R2.216 Fc1ccc(nc1)CSCc2ccncc2 62a_100015193705_100000703193 [0,1,0,0,0,0|2,1,0]=4 1076 B17R2.216 Fc1ccc(nc1)OCCc2ccccc2 34a_100000742473_100000765856 [0,1,0,0,0,0|3,0,0]=4 1077 B17R2.216 Fc1ccc(nc1)SCCc2ccccc2 62a_100000744514_100011218657 [0,1,0,0,0,0|3,0,0]=4 1078 B17R2.216 Fc1ccc(nc1)SCCc2ccccc2 62a_100000765856_100000744514 [0,1,0,0,0,0|3,0,0]=4 1079 B17R2.216 Ic1ccc(cc1)C=NNc2ccccc2 4a_100015195140_100000188517 [0,1,0,0,0,0|2,0,1]=4 1080 B17R2.216 Ic1ccc(cc1)CNCc2ccccc2 207a_100015324214_100000188517 [0,1,0,0,0,0|1,0,0]=2 1081 B17R2.216 Ic1ccc(cc1)CNCc2ccccc2 207a_100016989417_100015611070 [0,1,0,0,0,0|1,0,0]=2 1082 B17R2.216 Ic1ccc(cc1)CNCc2ccccc2 2230a_100015324214_100000189116 [0,1,0,0,0,0|1,0,0]=2 1083 B17R2.216 Ic1ccc(cc1)CNCc2ccccc2 2230a_100016989417_100015291786 [0,1,0,0,0,0|1,0,0]=2 1084 B17R2.216 Ic1ccc(cc1)CNCc2ccccc2 270004a_100016989417_100015611070 [0,1,0,0,0,0|1,0,0]=2 1085 B17R2.216 Ic1ccc(cc1)CNCc2ccccc2 34a_100015324214_100000189116 [0,1,0,0,0,0|1,0,0]=2 1086 B17R2.216 Ic1ccc(cc1)CNCc2ccccc2 34a_100016989417_100015291786 [0,1,0,0,0,0|1,0,0]=2 1087 B17R2.216 Ic1ccc(cc1)CNCc2ccccn2 207a_100016989417_100000209966 [0,1,0,0,0,0|2,0,0]=3 1088 B17R2.216 Ic1ccc(cc1)CNCc2ccccn2 2230a_100016989417_100000721315 [0,1,0,0,0,0|2,0,0]=3 1089 B17R2.216 Ic1ccc(cc1)CNCc2ccccn2 270004a_100016989417_100000209966 [0,1,0,0,0,0|2,0,0]=3 1090 B17R2.216 Ic1ccc(cc1)CNCc2ccccn2 34a_100016989417_100000721315 [0,1,0,0,0,0|2,0,0]=3 1091 B17R2.216 Ic1ccc(cc1)CNCc2cccnc2 207a_100000210453_100000188517 [0,1,0,0,0,0|2,0,0]=3 1092 B17R2.216 Ic1ccc(cc1)CNCc2cccnc2 207a_100016989417_100000209961 [0,1,0,0,0,0|2,0,0]=3 1093 B17R2.216 Ic1ccc(cc1)CNCc2cccnc2 2230a_100016989417_100000741622 [0,1,0,0,0,0|2,0,0]=3 1094 B17R2.216 Ic1ccc(cc1)CNCc2cccnc2 270004a_100016989417_100000209961 [0,1,0,0,0,0|2,0,0]=3 1095 B17R2.216 Ic1ccc(cc1)CNCc2cccnc2 34a_100016989417_100000733263 [0,1,0,0,0,0|2,0,0]=3 1096 B17R2.216 Ic1ccc(cc1)CNCc2cccnn2 2230a_100016989417_100016990269 [0,1,0,0,0,0|3,0,0]=4 1097 B17R2.216 Ic1ccc(cc1)CNCc2cccnn2 2230a_100159270163_100000189116 [0,1,0,0,0,0|3,0,0]=4 1098 B17R2.216 Ic1ccc(cc1)CNCc2cccnn2 34a_100016989417_100016990269 [0,1,0,0,0,0|3,0,0]=4 1099 B17R2.216 Ic1ccc(cc1)CNCc2ccncc2 207a_100016989417_100000186114 [0,1,0,0,0,0|2,0,0]=3 1100 B17R2.216 Ic1ccc(cc1)CNCc2ccncc2 2230a_100016989417_100015193705 [0,1,0,0,0,0|2,0,0]=3 1101 B17R2.216 Ic1ccc(cc1)CNCc2ccnnc2 270004a_100016989417_100011934578 [0,1,0,0,0,0|3,0,0]=4 1102 B17R2.216 Ic1ccc(cc1)CNCc2cnccn2 2230a_100016989417_100016995436 [0,1,0,0,0,0|3,0,0]=4 1103 B17R2.216 Ic1ccc(cc1)CNCc2cnccn2 270004a_100016989417_100000749867 [0,1,0,0,0,0|3,0,0]=4 1104 B17R2.216 Ic1ccc(cc1)CNCc2cnccn2 34a_100016989417_100016995436 [0,1,0,0,0,0|3,0,0]=4 1105 B17R2.216 Ic1ccc(cc1)CNCc2cncnc2 207a_100011243677_100000188517 [0,1,0,0,0,0|3,0,0]=4 1106 B17R2.216 Ic1ccc(cc1)CNCc2cncnc2 2230a_100011243677_100000189116 [0,1,0,0,0,0|3,0,0]=4 1107 B17R2.216 Ic1ccc(cc1)CNCc2cncnc2 2230a_100016989417_100015196519 [0,1,0,0,0,0|3,0,0]=4 1108 B17R2.216 Ic1ccc(cc1)CNCc2cncnc2 270004a_100016989417_100000749868 [0,1,0,0,0,0|3,0,0]=4 1109 B17R2.216 Ic1ccc(cc1)CNCc2cncnc2 34a_100016989417_100015196519 [0,1,0,0,0,0|3,0,0]=4 1110 B17R2.216 Ic1ccc(cc1)CNCc2ncccn2 2230a_100016989417_100000703007 [0,1,0,0,0,0|3,0,0]=4 1111 B17R2.216 Ic1ccc(cc1)CNCc2ncccn2 270004a_100016989417_100011532527 [0,1,0,0,0,0|3,0,0]=4 1112 B17R2.216 Ic1ccc(cc1)CNCc2ncccn2 34a_100016989417_100000703007 [0,1,0,0,0,0|3,0,0]=4 1113 B17R2.216 Ic1ccc(cc1)COCc2ccccc2 34a_100000210790_100000189116 [0,1,0,0,0,0|0,0,0]=1 1114 B17R2.216 Ic1ccc(cc1)COCc2ccccc2 34a_100000690907_100015291786 [0,1,0,0,0,0|0,0,0]=1 1115 B17R2.216 Ic1ccc(cc1)COCc2ccccc2 7a_100000210790_100000189116 [0,1,0,0,0,0|0,0,0]=1 1116 B17R2.216 Ic1ccc(cc1)COCc2ccccc2 7a_100000690907_100000211182 [0,1,0,0,0,0|0,0,0]=1 1117 B17R2.216 Ic1ccc(cc1)COCc2ccccn2 34a_100000690907_100000721315 [0,1,0,0,0,0|1,0,0]=2 1118 B17R2.216 Ic1ccc(cc1)COCc2ccccn2 7a_100000690907_100000721315 [0,1,0,0,0,0|1,0,0]=2 1119 B17R2.216 Ic1ccc(cc1)COCc2cccnc2 34a_100000690907_100000733263 [0,1,0,0,0,0|1,0,0]=2 1120 B17R2.216 Ic1ccc(cc1)COCc2cccnc2 7a_100000690907_100000741622 [0,1,0,0,0,0|1,0,0]=2 1121 B17R2.216 Ic1ccc(cc1)COCc2cccnn2 34a_100000690907_100016990269 [0,1,0,0,0,0|2,0,0]=3 1122 B17R2.216 Ic1ccc(cc1)COCc2cccnn2 7a_100000690907_100016990269 [0,1,0,0,0,0|2,0,0]=3 1123 B17R2.216 Ic1ccc(cc1)COCc2ccncc2 7a_100000690907_100015193705 [0,1,0,0,0,0|1,0,0]=2 1124 B17R2.216 Ic1ccc(cc1)COCc2cnccn2 34a_100000690907_100016995436 [0,1,0,0,0,0|2,0,0]=3 1125 B17R2.216 Ic1ccc(cc1)COCc2cnccn2 7a_100000690907_100016995436 [0,1,0,0,0,0|2,0,0]=3 1126 B17R2.216 Ic1ccc(cc1)COCc2cncnc2 34a_100000690907_100015196519 [0,1,0,0,0,0|2,0,0]=3 1127 B17R2.216 Ic1ccc(cc1)COCc2cncnc2 7a_100000690907_100015196519 [0,1,0,0,0,0|2,0,0]=3 1128 B17R2.216 Ic1ccc(cc1)COCc2ncccn2 34a_100000690907_100000703007 [0,1,0,0,0,0|2,0,0]=3 1129 B17R2.216 Ic1ccc(cc1)COCc2ncccn2 7a_100000690907_100000703007 [0,1,0,0,0,0|2,0,0]=3 1130 B17R2.216 Ic1ccc(cc1)CSCc2ccccc2 62a_100000189116_100015291786 [0,1,0,0,0,0|0,1,0]=2 1131 B17R2.216 Ic1ccc(cc1)CSCc2ccccc2 62a_100000211182_100000189116 [0,1,0,0,0,0|0,1,0]=2 1132 B17R2.216 Ic1ccc(cc1)CSCc2ccccn2 62a_100000189116_100000721315 [0,1,0,0,0,0|1,1,0]=3 1133 B17R2.216 Ic1ccc(cc1)CSCc2ccccn2 62a_100000721315_100000189116 [0,1,0,0,0,0|1,1,0]=3 1134 B17R2.216 Ic1ccc(cc1)CSCc2cccnc2 62a_100000189116_100000741622 [0,1,0,0,0,0|1,1,0]=3 1135 B17R2.216 Ic1ccc(cc1)CSCc2cccnc2 62a_100000741622_100000189116 [0,1,0,0,0,0|1,1,0]=3 1136 B17R2.216 Ic1ccc(cc1)CSCc2cccnn2 62a_100000189116_100016990269 [0,1,0,0,0,0|2,1,0]=4 1137 B17R2.216 Ic1ccc(cc1)CSCc2cccnn2 62a_100016990269_100000189116 [0,1,0,0,0,0|2,1,0]=4 1138 B17R2.216 Ic1ccc(cc1)CSCc2ccncc2 62a_100000189116_100015193705 [0,1,0,0,0,0|1,1,0]=3 1139 B17R2.216 Ic1ccc(cc1)CSCc2ccncc2 62a_100015193705_100000189116 [0,1,0,0,0,0|1,1,0]=3 1140 B17R2.216 Ic1ccc(cc1)CSCc2cnccn2 62a_100000189116_100016995436 [0,1,0,0,0,0|2,1,0]=4 1141 B17R2.216 Ic1ccc(cc1)CSCc2cnccn2 62a_100016995436_100000189116 [0,1,0,0,0,0|2,1,0]=4 1142 B17R2.216 Ic1ccc(cc1)CSCc2cncnc2 62a_100000189116_100015196519 [0,1,0,0,0,0|2,1,0]=4 1143 B17R2.216 Ic1ccc(cc1)CSCc2cncnc2 62a_100015196519_100000189116 [0,1,0,0,0,0|2,1,0]=4 1144 B17R2.216 Ic1ccc(cc1)CSCc2ncccn2 62a_100000189116_100000703007 [0,1,0,0,0,0|2,1,0]=4 1145 B17R2.216 Ic1ccc(cc1)CSCc2ncccn2 62a_100000703007_100000189116 [0,1,0,0,0,0|2,1,0]=4 1146 B17R2.216 Ic1ccc(cc1)NCCc2ccccc2 34a_100000185761_100000765856 [0,1,0,0,0,0|2,0,0]=3 1147 B17R2.216 Ic1ccc(cc1)NN=Cc2ccccc2 4a_100016988836_100015611070 [0,1,0,0,0,0|2,0,1]=4 1148 B17R2.216 Ic1ccc(cc1)OCCc2ccccc2 34a_100000212066_100000765856 [0,1,0,0,0,0|2,0,0]=3 1149 B17R2.216 Ic1ccc(cc1)OCCc2ccccc2 7a_100000212066_100000765856 [0,1,0,0,0,0|2,0,0]=3 1150 B17R2.216 Ic1ccc(cc1)OCCc2ccccn2 7a_100000212066_100015183660 [0,1,0,0,0,0|3,0,0]=4 1151 B17R2.216 Ic1ccc(cc1)OCCc2cccnc2 7a_100000212066_200011713674 [0,1,0,0,0,0|3,0,0]=4 1152 B17R2.216 Ic1ccc(cc1)OCCc2ccncc2 7a_100000212066_100000723409 [0,1,0,0,0,0|3,0,0]=4 1153 B17R2.216 Ic1ccc(cn1)OCCc2ccccc2 34a_100000687607_100000765856 [0,1,0,0,0,0|3,0,0]=4 1154 B17R2.216 Ic1ccc(cn1)OCCc2ccccc2 7a_100000687607_100000765856 [0,1,0,0,0,0|3,0,0]=4 1155 B17R2.216 Nc1ccc(cc1)C=CCc2ccccc2 271570a_200016263579_100000185761 [0,1,0,0,0,0|1,0,1]=3 1156 B17R2.216 Nc1ccc(cc1)COCc2ccccc2 34a_100011215238_100015291786 [0,1,0,0,0,0|0,0,0]=1 1157 B17R2.216 Nc1ccc(cc1)COCc2ccccn2 34a_100011215238_100000721315 [0,1,0,0,0,0|1,0,0]=2 1158 B17R2.216 Nc1ccc(cc1)COCc2cccnc2 34a_100011215238_100000733263 [0,1,0,0,0,0|1,0,0]=2 1159 B17R2.216 Nc1ccc(cc1)COCc2cccnn2 34a_100011215238_100016990269 [0,1,0,0,0,0|2,0,0]=3 1160 B17R2.216 Nc1ccc(cc1)COCc2cnccn2 34a_100011215238_100016995436 [0,1,0,0,0,0|2,0,0]=3 1161 B17R2.216 Nc1ccc(cc1)COCc2cncnc2 34a_100011215238_100015196519 [0,1,0,0,0,0|2,0,0]=3 1162 B17R2.216 Nc1ccc(cc1)COCc2ncccn2 34a_100011215238_100000703007 [0,1,0,0,0,0|2,0,0]=3 1163 B17R2.216 Nc1ccc(cc1)OCCc2ccccc2 34a_100000185829_100000765856 [0,1,0,0,0,0|2,0,0]=3 1164 B17R2.216 Nc1ccc(cc1)SCCc2ccccc2 62a_100000185761_100011218657 [0,1,0,0,0,0|2,0,0]=3 1165 B17R2.216 Nc1ccc(cc1)SCCc2ccccc2 62a_100000765856_100000185761 [0,1,0,0,0,0|2,0,0]=3 1166 B17R2.216 Nc1ccc(cc1)SCCc2ccccn2 62a_100000185761_100015183660 [0,1,0,0,0,0|3,0,0]=4 1167 B17R2.216 Nc1ccc(cc1)SCCc2ccccn2 62a_100015183660_100000185761 [0,1,0,0,0,0|3,0,0]=4 1168 B17R2.216 Nc1ccc(cc1)SCCc2cccnc2 62a_100000185761_200011713674 [0,1,0,0,0,0|3,0,0]=4 1169 B17R2.216 Nc1ccc(cc1)SCCc2cccnc2 62a_200011713674_100000185761 [0,1,0,0,0,0|3,0,0]=4 1170 B17R2.216 Nc1ccc(cc1)SCCc2ccncc2 62a_100000185761_100000723409 [0,1,0,0,0,0|3,0,0]=4 1171 B17R2.216 Nc1ccc(cc1)SCCc2ccncc2 62a_100000723409_100000185761 [0,1,0,0,0,0|3,0,0]=4 1172 B17R2.216 Nc1ccc(cc1)SCSc2ccccc2 62a_100000185761_100011218342 [0,1,0,0,0,0|3,0,0]=4 1173 B17R2.216 Nc1ccc(cc1)SCSc2ccccc2 62a_100011218342_100000185761 [0,1,0,0,0,0|3,0,0]=4 1174 B17R2.216 Nc1ccc(cn1)C=CCc2ccccc2 271570a_200016263579_100000187370 [0,1,0,0,0,0|2,0,1]=4 1175 B17R2.216 Nc1ccc(cn1)COCc2ccccc2 34a_100000704267_100015291786 [0,1,0,0,0,0|1,0,0]=2 1176 B17R2.216 Nc1ccc(cn1)COCc2ccccn2 34a_100000704267_100000721315 [0,1,0,0,0,0|2,0,0]=3 1177 B17R2.216 Nc1ccc(cn1)COCc2cccnc2 34a_100000704267_100000733263 [0,1,0,0,0,0|2,0,0]=3 1178 B17R2.216 Nc1ccc(cn1)COCc2cccnn2 34a_100000704267_100016990269 [0,1,0,0,0,0|3,0,0]=4 1179 B17R2.216 Nc1ccc(cn1)COCc2cnccn2 34a_100000704267_100016995436 [0,1,0,0,0,0|3,0,0]=4 1180 B17R2.216 Nc1ccc(cn1)COCc2cncnc2 34a_100000704267_100015196519 [0,1,0,0,0,0|3,0,0]=4 1181 B17R2.216 Nc1ccc(cn1)COCc2ncccn2 34a_100000704267_100000703007 [0,1,0,0,0,0|3,0,0]=4 1182 B17R2.216 Nc1ccc(cn1)OCCc2ccccc2 34a_100015188713_100000765856 [0,1,0,0,0,0|3,0,0]=4 1183 B17R2.216 Nc1ccc(cn1)OCCc2ccccc2 7a_100015188713_100000765856 [0,1,0,0,0,0|3,0,0]=4 1184 B17R2.216 Nc1ccc(cn1)SCCc2ccccc2 62a_100000187370_100011218657 [0,1,0,0,0,0|3,0,0]=4 1185 B17R2.216 Nc1ccc(cn1)SCCc2ccccc2 62a_100000765856_100000187370 [0,1,0,0,0,0|3,0,0]=4 1186 B17R2.216 Nc1ccc(nc1)C=CCc2ccccc2 271570a_200016263579_100000744251 [0,1,0,0,0,0|2,0,1]=4 1187 B17R2.216 Nc1ccc(nc1)COCc2ccccc2 34a_100011998161_100015291786 [0,1,0,0,0,0|1,0,0]=2 1188 B17R2.216 Nc1ccc(nc1)COCc2ccccn2 34a_100011998161_100000721315 [0,1,0,0,0,0|2,0,0]=3 1189 B17R2.216 Nc1ccc(nc1)COCc2cccnc2 34a_100011998161_100000733263 [0,1,0,0,0,0|2,0,0]=3 1190 B17R2.216 Nc1ccc(nc1)COCc2cccnn2 34a_100011998161_100016990269 [0,1,0,0,0,0|3,0,0]=4 1191 B17R2.216 Nc1ccc(nc1)COCc2cnccn2 34a_100011998161_100016995436 [0,1,0,0,0,0|3,0,0]=4 1192 B17R2.216 Nc1ccc(nc1)COCc2cncnc2 34a_100011998161_100015196519 [0,1,0,0,0,0|3,0,0]=4 1193 B17R2.216 Nc1ccc(nc1)COCc2ncccn2 34a_100011998161_100000703007 [0,1,0,0,0,0|3,0,0]=4 1194 B17R2.216 Nc1ccc(nc1)OCCc2ccccc2 34a_100000729260_100000765856 [0,1,0,0,0,0|3,0,0]=4 1195 B17R2.216 Nc1ccc(nc1)SCCc2ccccc2 62a_100000737798_100011218657 [0,1,0,0,0,0|3,0,0]=4 1196 B17R2.216 Nc1ccc(nc1)SCCc2ccccc2 62a_100000765856_100000737798 [0,1,0,0,0,0|3,0,0]=4 1197 B17R2.216 O=c1ccc(c[nH]1)C=CCc2ccccc2 271570a_200016263579_100000212171 [0,1,0,0,0,0|2,0,1]=4 1198 B17R2.216 O=c1ccc(c[nH]1)COCc2ccccc2 34a_100011999846_100015291786 [0,1,0,0,0,0|1,0,0]=2 1199 B17R2.216 O=c1ccc(c[nH]1)COCc2ccccn2 34a_100011999846_100000721315 [0,1,0,0,0,0|2,0,0]=3 1200 B17R2.216 O=c1ccc(c[nH]1)COCc2cccnc2 34a_100011999846_100000733263 [0,1,0,0,0,0|2,0,0]=3 1201 B17R2.216 O=c1ccc(c[nH]1)COCc2cccnn2 34a_100011999846_100016990269 [0,1,0,0,0,0|3,0,0]=4 1202 B17R2.216 O=c1ccc(c[nH]1)COCc2cnccn2 34a_100011999846_100016995436 [0,1,0,0,0,0|3,0,0]=4 1203 B17R2.216 O=c1ccc(c[nH]1)COCc2cncnc2 34a_100011999846_100015196519 [0,1,0,0,0,0|3,0,0]=4 1204 B17R2.216 O=c1ccc(c[nH]1)COCc2ncccn2 34a_100011999846_100000703007 [0,1,0,0,0,0|3,0,0]=4 1205 B17R2.216 O=c1ccc(c[nH]1)OCCc2ccccc2 34a_100000075641_100000765856 [0,1,0,0,0,0|3,0,0]=4 1206 B17R2.216 O=c1ccc(c[nH]1)SCCc2ccccc2 62a_100000212171_100011218657 [0,1,0,0,0,0|3,0,0]=4 1207 B17R2.216 O=c1ccc(c[nH]1)SCCc2ccccc2 62a_100000765856_100000212171 [0,1,0,0,0,0|3,0,0]=4 1208 B17R2.216 O=c1ccc(n[nH]1)CNCc2ccccc2 207a_100015324214_100011361533 [0,1,0,0,0,0|3,0,0]=4 1209 B17R2.216 O=c1ccc(n[nH]1)CNCc2ccccc2 270004a_100015324214_100011361533 [0,1,0,0,0,0|3,0,0]=4 1210 B17R2.216 Oc1ccc(cc1)C=CCc2ccccc2 271570a_200016263579_100000185759 [0,1,0,0,0,0|1,0,1]=3 1211 B17R2.216 Oc1ccc(cc1)C=NNc2ccccc2 4a_100015195140_100000185832 [0,1,0,0,0,0|2,0,1]=4 1212 B17R2.216 Oc1ccc(cc1)CCOc2ccccc2 7a_100000210340_100009816426 [0,1,0,0,0,0|2,0,0]=3 1213 B17R2.216 Oc1ccc(cc1)CCOc2cccnc2 7a_100000210849_100009816426 [0,1,0,0,0,0|3,0,0]=4 1214 B17R2.216 Oc1ccc(cc1)CCSc2ccccc2 62a_100000719477_100009816426 [0,1,0,0,0,0|2,0,0]=3 1215 B17R2.216 Oc1ccc(cc1)CCSc2ccccc2 62a_100009816426_100000041952 [0,1,0,0,0,0|2,0,0]=3 1216 B17R2.216 Oc1ccc(cc1)CCSc2ccccn2 62a_100009816426_100011216584 [0,1,0,0,0,0|3,0,0]=4 1217 B17R2.216 Oc1ccc(cc1)CCSc2ccccn2 62a_100011216584_100009816426 [0,1,0,0,0,0|3,0,0]=4 1218 B17R2.216 Oc1ccc(cc1)CCSc2cccnc2 62a_100000210063_100009816426 [0,1,0,0,0,0|3,0,0]=4 1219 B17R2.216 Oc1ccc(cc1)CCSc2cccnc2 62a_100009816426_100000210063 [0,1,0,0,0,0|3,0,0]=4 1220 B17R2.216 Oc1ccc(cc1)CCSc2ccncc2 62a_100000728582_100009816426 [0,1,0,0,0,0|3,0,0]=4 1221 B17R2.216 Oc1ccc(cc1)CCSc2ccncc2 62a_100009816426_100000728582 [0,1,0,0,0,0|3,0,0]=4 1222 B17R2.216 Oc1ccc(cc1)CNCc2ccccc2 271570a_203496583355_100000195849 [0,1,0,0,0,0|1,0,0]=2 1223 B17R2.216 Oc1ccc(cc1)CNCc2ccccc2 34a_100000185549_100015291786 [0,1,0,0,0,0|1,0,0]=2 1224 B17R2.216 Oc1ccc(cc1)CNCc2ccccn2 34a_100000185549_100000721315 [0,1,0,0,0,0|2,0,0]=3 1225 B17R2.216 Oc1ccc(cc1)CNCc2cccnc2 34a_100000185549_100000733263 [0,1,0,0,0,0|2,0,0]=3 1226 B17R2.216 Oc1ccc(cc1)CNCc2cccnn2 34a_100000185549_100016990269 [0,1,0,0,0,0|3,0,0]=4 1227 B17R2.216 Oc1ccc(cc1)CNCc2cnccn2 34a_100000185549_100016995436 [0,1,0,0,0,0|3,0,0]=4 1228 B17R2.216 Oc1ccc(cc1)CNCc2cncnc2 34a_100000185549_100015196519 [0,1,0,0,0,0|3,0,0]=4 1229 B17R2.216 Oc1ccc(cc1)CNCc2ncccn2 34a_100000185549_100000703007 [0,1,0,0,0,0|3,0,0]=4 1230 B17R2.216 Oc1ccc(cc1)NCCc2ccccc2 34a_100000185829_100000765856 [0,1,0,0,0,0|2,0,0]=3 1231 B17R2.216 Oc1ccc(cc1)SCCc2ccccc2 62a_100000765856_100000185759 [0,1,0,0,0,0|2,0,0]=3 1232 B17R2.216 Oc1ccc(cc1)SCCc2ccccn2 62a_100015183660_100000185759 [0,1,0,0,0,0|3,0,0]=4 1233 B17R2.216 Oc1ccc(cc1)SCCc2cccnc2 62a_200011713674_100000185759 [0,1,0,0,0,0|3,0,0]=4 1234 B17R2.216 Oc1ccc(cc1)SCCc2ccncc2 62a_100000723409_100000185759 [0,1,0,0,0,0|3,0,0]=4 1235 B17R2.216 Oc1ccc(cc1)SCSc2ccccc2 62a_100011218342_100000185759 [0,1,0,0,0,0|3,0,0]=4 1236 B17R2.216 Oc1ccc(cn1)CNCc2ccccc2 207a_100015324214_100011361521 [0,1,0,0,0,0|2,0,0]=3 1237 B17R2.216 Oc1ccc(cn1)CNCc2ccccc2 2230a_100000757128_100015291786 [0,1,0,0,0,0|2,0,0]=3 1238 B17R2.216 Oc1ccc(cn1)CNCc2ccccn2 2230a_100000757128_100000721315 [0,1,0,0,0,0|3,0,0]=4 1239 B17R2.216 Oc1ccc(cn1)CNCc2cccnc2 207a_100000210453_100011361521 [0,1,0,0,0,0|3,0,0]=4 1240 B17R2.216 Oc1ccc(cn1)CNCc2cccnc2 2230a_100000757128_100000741622 [0,1,0,0,0,0|3,0,0]=4 1241 B17R2.216 Oc1ccc(cn1)CNCc2ccncc2 2230a_100000757128_100015193705 [0,1,0,0,0,0|3,0,0]=4 1242 B17R2.216 Oc1ccc(nc1)C=CCc2ccccc2 271570a_200016263579_100000685995 [0,1,0,0,0,0|2,0,1]=4 1243 B17R2.216 Oc1ccc(nc1)SCCc2ccccc2 62a_100000685995_100011218657 [0,1,0,0,0,0|3,0,0]=4 1244 B17R2.216 Oc1ccc(nc1)SCCc2ccccc2 62a_100000765856_100000744096 [0,1,0,0,0,0|3,0,0]=4 1245 B17R2.216 [O-][n+]1ccc(cc1)C=CCc2ccccc2 271570a_200016263579_100000039755 [0,1,0,0,0,0|2,0,1]=4 1246 B17R2.216 [O-][n+]1ccc(cc1)COCc2ccccc2 34a_100000031831_100015291786 [0,1,0,0,0,0|1,0,0]=2 1247 B17R2.216 [O-][n+]1ccc(cc1)COCc2ccccc2 7a_100000031831_100000211182 [0,1,0,0,0,0|1,0,0]=2 1248 B17R2.216 [O-][n+]1ccc(cc1)COCc2ccccn2 34a_100000031831_100000721315 [0,1,0,0,0,0|2,0,0]=3 1249 B17R2.216 [O-][n+]1ccc(cc1)COCc2ccccn2 7a_100000031831_100000721315 [0,1,0,0,0,0|2,0,0]=3 1250 B17R2.216 [O-][n+]1ccc(cc1)COCc2cccnc2 34a_100000031831_100000733263 [0,1,0,0,0,0|2,0,0]=3 1251 B17R2.216 [O-][n+]1ccc(cc1)COCc2cccnc2 7a_100000031831_100000741622 [0,1,0,0,0,0|2,0,0]=3 1252 B17R2.216 [O-][n+]1ccc(cc1)COCc2cccnn2 34a_100000031831_100016990269 [0,1,0,0,0,0|3,0,0]=4 1253 B17R2.216 [O-][n+]1ccc(cc1)COCc2cccnn2 7a_100000031831_100016990269 [0,1,0,0,0,0|3,0,0]=4 1254 B17R2.216 [O-][n+]1ccc(cc1)COCc2ccncc2 7a_100000031831_100015193705 [0,1,0,0,0,0|2,0,0]=3 1255 B17R2.216 [O-][n+]1ccc(cc1)COCc2cnccn2 34a_100000031831_100016995436 [0,1,0,0,0,0|3,0,0]=4 1256 B17R2.216 [O-][n+]1ccc(cc1)COCc2cnccn2 7a_100000031831_100016995436 [0,1,0,0,0,0|3,0,0]=4 1257 B17R2.216 [O-][n+]1ccc(cc1)COCc2cncnc2 34a_100000031831_100015196519 [0,1,0,0,0,0|3,0,0]=4 1258 B17R2.216 [O-][n+]1ccc(cc1)COCc2cncnc2 7a_100000031831_100015196519 [0,1,0,0,0,0|3,0,0]=4 1259 B17R2.216 [O-][n+]1ccc(cc1)COCc2ncccn2 34a_100000031831_100000703007 [0,1,0,0,0,0|3,0,0]=4 1260 B17R2.216 [O-][n+]1ccc(cc1)COCc2ncccn2 7a_100000031831_100000703007 [0,1,0,0,0,0|3,0,0]=4 1261 B17R2.216 [O-][n+]1ccc(cc1)SCCc2ccccc2 62a_100000765856_100000039755 [0,1,0,0,0,0|3,0,0]=4 1262 B17R2.2342 CC(=NNc1ccccc1)c2ccccc2 4a_100015195140_100000185851 [0,1,0,0,0,0|2,0,1]=4 1263 B17R2.2342 CC(CNc1ccccc1)c2ccccc2 34a_100000106764_100000756946 [0,1,0,0,0,0|2,0,0]=3 1264 B17R2.2342 CC(COc1ccccc1)c2ccccc2 34a_100000210340_100000756946 [0,1,0,0,0,0|2,0,0]=3 1265 B17R2.2342 CC(COc1ccccc1)c2ccccc2 7a_100000210340_100000756946 [0,1,0,0,0,0|2,0,0]=3 1266 B17R2.2342 CC(COc1cccnc1)c2ccccc2 34a_100000210849_100000756946 [0,1,0,0,0,0|3,0,0]=4 1267 B17R2.2342 CC(COc1cccnc1)c2ccccc2 7a_100000210849_100000756946 [0,1,0,0,0,0|3,0,0]=4 1268 B17R2.2342 CC(COc1ccncc1)c2ccccc2 34a_100000212176_100000756946 [0,1,0,0,0,0|3,0,0]=4 1269 B17R2.2342 CC(CSc1ccccc1)c2ccccc2 62a_100000719477_100000756946 [0,1,0,0,0,0|2,0,0]=3 1270 B17R2.2342 CC(CSc1ccccc1)c2ccccc2 62a_100000756946_100000041952 [0,1,0,0,0,0|2,0,0]=3 1271 B17R2.2342 CC(CSc1ccccn1)c2ccccc2 62a_100000756946_100011216584 [0,1,0,0,0,0|3,0,0]=4 1272 B17R2.2342 CC(CSc1ccccn1)c2ccccc2 62a_100011216584_100000756946 [0,1,0,0,0,0|3,0,0]=4 1273 B17R2.2342 CC(CSc1cccnc1)c2ccccc2 62a_100000210063_100000756946 [0,1,0,0,0,0|3,0,0]=4 1274 B17R2.2342 CC(CSc1cccnc1)c2ccccc2 62a_100000756946_100000210063 [0,1,0,0,0,0|3,0,0]=4 1275 B17R2.2342 CC(CSc1ccncc1)c2ccccc2 62a_100000728582_100000756946 [0,1,0,0,0,0|3,0,0]=4 1276 B17R2.2342 CC(CSc1ccncc1)c2ccccc2 62a_100000756946_100000728582 [0,1,0,0,0,0|3,0,0]=4 1277 B17R2.2342 CC(NCc1ccccc1)c2ccccc2 2230a_100015324214_100000230085 [0,1,0,0,0,0|1,0,0]=2 1278 B17R2.2342 CC(NCc1ccccc1)c2ccccc2 269862a_100015324214_100000185851 [0,1,0,0,0,0|1,0,0]=2 1279 B17R2.2342 CC(NCc1ccccc1)c2ccccc2 34a_100015324214_100000211855 [0,1,0,0,0,0|1,0,0]=2 1280 B17R2.2342 CC(NCc1ccccc1)c2ccccn2 207a_100000181244_100015611070 [0,1,0,0,0,0|2,0,0]=3 1281 B17R2.2342 CC(NCc1ccccc1)c2ccccn2 2230a_100000181244_100015291786 [0,1,0,0,0,0|2,0,0]=3 1282 B17R2.2342 CC(NCc1ccccc1)c2ccccn2 269862a_100015324214_100000210467 [0,1,0,0,0,0|2,0,0]=3 1283 B17R2.2342 CC(NCc1ccccc1)c2ccccn2 270004a_100000181244_100015611070 [0,1,0,0,0,0|2,0,0]=3 1284 B17R2.2342 CC(NCc1ccccc1)c2cccnc2 207a_100000195435_100015611070 [0,1,0,0,0,0|2,0,0]=3 1285 B17R2.2342 CC(NCc1ccccc1)c2cccnc2 2230a_100000195435_100015291786 [0,1,0,0,0,0|2,0,0]=3 1286 B17R2.2342 CC(NCc1ccccc1)c2cccnc2 269862a_100015324214_100000210468 [0,1,0,0,0,0|2,0,0]=3 1287 B17R2.2342 CC(NCc1ccccc1)c2cccnc2 270004a_100000195435_100015611070 [0,1,0,0,0,0|2,0,0]=3 1288 B17R2.2342 CC(NCc1ccccc1)c2cccnn2 269862a_100015324214_100009866853 [0,1,0,0,0,0|3,0,0]=4 1289 B17R2.2342 CC(NCc1ccccc1)c2ccncc2 207a_100000181269_100015611070 [0,1,0,0,0,0|2,0,0]=3 1290 B17R2.2342 CC(NCc1ccccc1)c2ccncc2 2230a_100000181269_100015291786 [0,1,0,0,0,0|2,0,0]=3 1291 B17R2.2342 CC(NCc1ccccc1)c2ccncc2 269862a_100015324214_100000185792 [0,1,0,0,0,0|2,0,0]=3 1292 B17R2.2342 CC(NCc1ccccc1)c2ccncc2 270004a_100000181269_100015611070 [0,1,0,0,0,0|2,0,0]=3 1293 B17R2.2342 CC(NCc1ccccc1)c2ccnnc2 269862a_100015324214_100012182992 [0,1,0,0,0,0|3,0,0]=4 1294 B17R2.2342 CC(NCc1ccccc1)c2cnccn2 2230a_100015324214_200000703233 [0,1,0,0,0,0|3,0,0]=4 1295 B17R2.2342 CC(NCc1ccccc1)c2cnccn2 269862a_100015324214_100000751083 [0,1,0,0,0,0|3,0,0]=4 1296 B17R2.2342 CC(NCc1ccccc1)c2cncnc2 269862a_100015324214_100000757475 [0,1,0,0,0,0|3,0,0]=4 1297 B17R2.2342 CC(NCc1ccccc1)c2ncccn2 2230a_100020641698_100015291786 [0,1,0,0,0,0|3,0,0]=4 1298 B17R2.2342 CC(NCc1ccccc1)c2ncccn2 270004a_100015324214_100011350828 [0,1,0,0,0,0|3,0,0]=4 1299 B17R2.2342 CC(NCc1ccccc1)c2ncccn2 270004a_100020641698_100015611070 [0,1,0,0,0,0|3,0,0]=4 1300 B17R2.2342 CC(NCc1ccccn1)c2ccccn2 207a_100000181244_100000209966 [0,1,0,0,0,0|3,0,0]=4 1301 B17R2.2342 CC(NCc1ccccn1)c2ccccn2 2230a_100000181244_100000721315 [0,1,0,0,0,0|3,0,0]=4 1302 B17R2.2342 CC(NCc1ccccn1)c2ccccn2 270004a_100000181244_100000209966 [0,1,0,0,0,0|3,0,0]=4 1303 B17R2.2342 CC(NCc1ccccn1)c2cccnc2 207a_100000195435_100000209966 [0,1,0,0,0,0|3,0,0]=4 1304 B17R2.2342 CC(NCc1ccccn1)c2cccnc2 2230a_100000195435_100000721315 [0,1,0,0,0,0|3,0,0]=4 1305 B17R2.2342 CC(NCc1ccccn1)c2cccnc2 270004a_100000195435_100000209966 [0,1,0,0,0,0|3,0,0]=4 1306 B17R2.2342 CC(NCc1ccccn1)c2ccncc2 207a_100000181269_100000209966 [0,1,0,0,0,0|3,0,0]=4 1307 B17R2.2342 CC(NCc1ccccn1)c2ccncc2 2230a_100000181269_100000721315 [0,1,0,0,0,0|3,0,0]=4 1308 B17R2.2342 CC(NCc1ccccn1)c2ccncc2 270004a_100000181269_100000209966 [0,1,0,0,0,0|3,0,0]=4 1309 B17R2.2342 CC(NCc1cccnc1)c2ccccc2 269862a_100000210453_100000185851 [0,1,0,0,0,0|2,0,0]=3 1310 B17R2.2342 CC(NCc1cccnc1)c2ccccn2 207a_100000181244_100000209961 [0,1,0,0,0,0|3,0,0]=4 1311 B17R2.2342 CC(NCc1cccnc1)c2ccccn2 2230a_100000181244_100000741622 [0,1,0,0,0,0|3,0,0]=4 1312 B17R2.2342 CC(NCc1cccnc1)c2ccccn2 269862a_100000210453_100000210467 [0,1,0,0,0,0|3,0,0]=4 1313 B17R2.2342 CC(NCc1cccnc1)c2ccccn2 270004a_100000181244_100000209961 [0,1,0,0,0,0|3,0,0]=4 1314 B17R2.2342 CC(NCc1cccnc1)c2cccnc2 207a_100000195435_100000209961 [0,1,0,0,0,0|3,0,0]=4 1315 B17R2.2342 CC(NCc1cccnc1)c2cccnc2 2230a_100000195435_100000741622 [0,1,0,0,0,0|3,0,0]=4 1316 B17R2.2342 CC(NCc1cccnc1)c2cccnc2 269862a_100000210453_100000210468 [0,1,0,0,0,0|3,0,0]=4 1317 B17R2.2342 CC(NCc1cccnc1)c2cccnc2 270004a_100000195435_100000209961 [0,1,0,0,0,0|3,0,0]=4 1318 B17R2.2342 CC(NCc1cccnc1)c2ccncc2 207a_100000181269_100000209961 [0,1,0,0,0,0|3,0,0]=4 1319 B17R2.2342 CC(NCc1cccnc1)c2ccncc2 2230a_100000181269_100000741622 [0,1,0,0,0,0|3,0,0]=4 1320 B17R2.2342 CC(NCc1cccnc1)c2ccncc2 269862a_100000210453_100000185792 [0,1,0,0,0,0|3,0,0]=4 1321 B17R2.2342 CC(NCc1cccnc1)c2ccncc2 270004a_100000181269_100000209961 [0,1,0,0,0,0|3,0,0]=4 1322 B17R2.2342 CC(NCc1cccnn1)c2ccccc2 2230a_100159270163_100000230085 [0,1,0,0,0,0|3,0,0]=4 1323 B17R2.2342 CC(NCc1cccnn1)c2ccccc2 269862a_100159270163_100000185851 [0,1,0,0,0,0|3,0,0]=4 1324 B17R2.2342 CC(NCc1ccncc1)c2ccccc2 269862a_100000210450_100000185851 [0,1,0,0,0,0|2,0,0]=3 1325 B17R2.2342 CC(NCc1ccncc1)c2ccccn2 207a_100000181244_100000186114 [0,1,0,0,0,0|3,0,0]=4 1326 B17R2.2342 CC(NCc1ccncc1)c2ccccn2 2230a_100000181244_100015193705 [0,1,0,0,0,0|3,0,0]=4 1327 B17R2.2342 CC(NCc1ccncc1)c2ccccn2 269862a_100000210450_100000210467 [0,1,0,0,0,0|3,0,0]=4 1328 B17R2.2342 CC(NCc1ccncc1)c2cccnc2 207a_100000195435_100000186114 [0,1,0,0,0,0|3,0,0]=4 1329 B17R2.2342 CC(NCc1ccncc1)c2cccnc2 2230a_100000195435_100015193705 [0,1,0,0,0,0|3,0,0]=4 1330 B17R2.2342 CC(NCc1ccncc1)c2cccnc2 269862a_100000210450_100000210468 [0,1,0,0,0,0|3,0,0]=4 1331 B17R2.2342 CC(NCc1ccncc1)c2ccncc2 207a_100000181269_100000186114 [0,1,0,0,0,0|3,0,0]=4 1332 B17R2.2342 CC(NCc1ccncc1)c2ccncc2 2230a_100000181269_100015193705 [0,1,0,0,0,0|3,0,0]=4 1333 B17R2.2342 CC(NCc1ccncc1)c2ccncc2 269862a_100000210450_100000185792 [0,1,0,0,0,0|3,0,0]=4 1334 B17R2.2342 CC(NCc1cncnc1)c2ccccc2 2230a_100011243677_100000230085 [0,1,0,0,0,0|3,0,0]=4 1335 B17R2.2342 CC(NCc1cncnc1)c2ccccc2 269862a_100011243677_100000185851 [0,1,0,0,0,0|3,0,0]=4 1336 B17R2.2342 CC(OCc1ccccc1)c2ccccc2 34a_100000210790_100000211855 [0,1,0,0,0,0|0,0,0]=1 1337 B17R2.2342 CC(OCc1ccccc1)c2ccccc2 7a_100000210790_100000230085 [0,1,0,0,0,0|0,0,0]=1 1338 B17R2.2342 CC(OCc1ccccc1)c2cnccn2 7a_100000210790_200000703233 [0,1,0,0,0,0|2,0,0]=3 1339 B17R2.2342 CC(SCc1ccccc1)c2ccccc2 62a_100000211182_100000230085 [0,1,0,0,0,0|0,1,0]=2 1340 B17R2.2342 CC(SCc1ccccc1)c2ccccc2 62a_100000230085_100015291786 [0,1,0,0,0,0|0,1,0]=2 1341 B17R2.2342 CC(SCc1ccccc1)c2cnccn2 62a_100000211182_200000703233 [0,1,0,0,0,0|2,1,0]=4 1342 B17R2.2342 CC(SCc1ccccc1)c2cnccn2 62a_200000703233_100015291786 [0,1,0,0,0,0|2,1,0]=4 1343 B17R2.2342 CC(SCc1ccccn1)c2ccccc2 62a_100000230085_100000721315 [0,1,0,0,0,0|1,1,0]=3 1344 B17R2.2342 CC(SCc1ccccn1)c2ccccc2 62a_100000721315_100000230085 [0,1,0,0,0,0|1,1,0]=3 1345 B17R2.2342 CC(SCc1cccnc1)c2ccccc2 62a_100000230085_100000741622 [0,1,0,0,0,0|1,1,0]=3 1346 B17R2.2342 CC(SCc1cccnc1)c2ccccc2 62a_100000741622_100000230085 [0,1,0,0,0,0|1,1,0]=3 1347 B17R2.2342 CC(SCc1cccnn1)c2ccccc2 62a_100000230085_100016990269 [0,1,0,0,0,0|2,1,0]=4 1348 B17R2.2342 CC(SCc1cccnn1)c2ccccc2 62a_100016990269_100000230085 [0,1,0,0,0,0|2,1,0]=4 1349 B17R2.2342 CC(SCc1ccncc1)c2ccccc2 62a_100000230085_100015193705 [0,1,0,0,0,0|1,1,0]=3 1350 B17R2.2342 CC(SCc1ccncc1)c2ccccc2 62a_100015193705_100000230085 [0,1,0,0,0,0|1,1,0]=3 1351 B17R2.2342 CC(SCc1cnccn1)c2ccccc2 62a_100000230085_100016995436 [0,1,0,0,0,0|2,1,0]=4 1352 B17R2.2342 CC(SCc1cnccn1)c2ccccc2 62a_100016995436_100000230085 [0,1,0,0,0,0|2,1,0]=4 1353 B17R2.2342 CC(SCc1cncnc1)c2ccccc2 62a_100000230085_100015196519 [0,1,0,0,0,0|2,1,0]=4 1354 B17R2.2342 CC(SCc1cncnc1)c2ccccc2 62a_100015196519_100000230085 [0,1,0,0,0,0|2,1,0]=4 1355 B17R2.2342 CC(SCc1ncccn1)c2ccccc2 62a_100000230085_100000703007 [0,1,0,0,0,0|2,1,0]=4 1356 B17R2.2342 CC(SCc1ncccn1)c2ccccc2 62a_100000703007_100000230085 [0,1,0,0,0,0|2,1,0]=4 1357 B17R2.2342 CN(CCc1ccccc1)c2ccccc2 2230a_100000210012_100000765856 [0,1,0,0,0,0|2,0,0]=3 1358 B17R2.2342 CN(CCc1ccccc1)c2ccccc2 269982a_100000210012_100000765856 [0,1,0,0,0,0|2,0,0]=3 1359 B17R2.2342 CN(CCc1ccccc1)c2ccccc2 34a_100000210012_100000765856 [0,1,0,0,0,0|2,0,0]=3 1360 B17R2.2342 CN(CCc1ccccn1)c2ccccc2 2230a_100000210012_100015183660 [0,1,0,0,0,0|3,0,0]=4 1361 B17R2.2342 CN(CCc1ccccn1)c2ccccc2 269982a_100000210012_100015183660 [0,1,0,0,0,0|3,0,0]=4 1362 B17R2.2342 CN(CCc1cccnc1)c2ccccc2 2230a_100000210012_200011713674 [0,1,0,0,0,0|3,0,0]=4 1363 B17R2.2342 CN(CCc1cccnc1)c2ccccc2 269982a_100000210012_200011713674 [0,1,0,0,0,0|3,0,0]=4 1364 B17R2.2342 CN(CCc1ccncc1)c2ccccc2 2230a_100000210012_100000723409 [0,1,0,0,0,0|3,0,0]=4 1365 B17R2.2342 CN(CCc1ccncc1)c2ccccc2 269982a_100000210012_100000723409 [0,1,0,0,0,0|3,0,0]=4 1366 B17R2.2342 CN(CSc1ccccc1)c2ccccc2 2230a_100000210012_100011218342 [0,1,0,0,0,0|3,0,0]=4 1367 B17R2.2342 CN(CSc1ccccc1)c2ccccc2 269982a_100000210012_100011218342 [0,1,0,0,0,0|3,0,0]=4 1368 B17R2.2342 C[C@@H](NCc1ccccc1)c2ccccc2 207a_100000751104_100015611070 [0,1,0,0,0,0|1,0,0]=2 1369 B17R2.2342 C[C@@H](NCc1ccccc1)c2ccccc2 2230a_100000751104_100015291786 [0,1,0,0,0,0|1,0,0]=2 1370 B17R2.2342 C[C@@H](NCc1ccccc1)c2ccccc2 270004a_100000751104_100015611070 [0,1,0,0,0,0|1,0,0]=2 1371 B17R2.2342 C[C@@H](NCc1ccccc1)c2cnccn2 207a_100020589798_100015611070 [0,1,0,0,0,0|3,0,0]=4 1372 B17R2.2342 C[C@@H](NCc1ccccc1)c2cnccn2 2230a_100020589798_100015291786 [0,1,0,0,0,0|3,0,0]=4 1373 B17R2.2342 C[C@@H](NCc1ccccc1)c2cnccn2 270004a_100020589798_100015611070 [0,1,0,0,0,0|3,0,0]=4 1374 B17R2.2342 C[C@@H](NCc1ccccn1)c2ccccc2 207a_100000751104_100000209966 [0,1,0,0,0,0|2,0,0]=3 1375 B17R2.2342 C[C@@H](NCc1ccccn1)c2ccccc2 2230a_100000751104_100000721315 [0,1,0,0,0,0|2,0,0]=3 1376 B17R2.2342 C[C@@H](NCc1ccccn1)c2ccccc2 270004a_100000751104_100000209966 [0,1,0,0,0,0|2,0,0]=3 1377 B17R2.2342 C[C@@H](NCc1cccnc1)c2ccccc2 207a_100000751104_100000209961 [0,1,0,0,0,0|2,0,0]=3 1378 B17R2.2342 C[C@@H](NCc1cccnc1)c2ccccc2 2230a_100000751104_100000741622 [0,1,0,0,0,0|2,0,0]=3 1379 B17R2.2342 C[C@@H](NCc1cccnc1)c2ccccc2 270004a_100000751104_100000209961 [0,1,0,0,0,0|2,0,0]=3 1380 B17R2.2342 C[C@@H](NCc1cccnn1)c2ccccc2 2230a_100000751104_100016990269 [0,1,0,0,0,0|3,0,0]=4 1381 B17R2.2342 C[C@@H](NCc1ccncc1)c2ccccc2 207a_100000751104_100000186114 [0,1,0,0,0,0|2,0,0]=3 1382 B17R2.2342 C[C@@H](NCc1ccncc1)c2ccccc2 2230a_100000751104_100015193705 [0,1,0,0,0,0|2,0,0]=3 1383 B17R2.2342 C[C@@H](NCc1ccnnc1)c2ccccc2 270004a_100000751104_100011934578 [0,1,0,0,0,0|3,0,0]=4 1384 B17R2.2342 C[C@@H](NCc1cnccn1)c2ccccc2 2230a_100000751104_100016995436 [0,1,0,0,0,0|3,0,0]=4 1385 B17R2.2342 C[C@@H](NCc1cnccn1)c2ccccc2 270004a_100000751104_100000749867 [0,1,0,0,0,0|3,0,0]=4 1386 B17R2.2342 C[C@@H](NCc1cncnc1)c2ccccc2 2230a_100000751104_100015196519 [0,1,0,0,0,0|3,0,0]=4 1387 B17R2.2342 C[C@@H](NCc1cncnc1)c2ccccc2 270004a_100000751104_100000749868 [0,1,0,0,0,0|3,0,0]=4 1388 B17R2.2342 C[C@@H](NCc1ncccn1)c2ccccc2 2230a_100000751104_100000703007 [0,1,0,0,0,0|3,0,0]=4 1389 B17R2.2342 C[C@@H](NCc1ncccn1)c2ccccc2 270004a_100000751104_100011532527 [0,1,0,0,0,0|3,0,0]=4 1390 B17R2.2342 C[C@@H](OCc1ccccc1)c2ccccc2 34a_100000761318_100015291786 [0,1,0,0,0,0|0,0,0]=1 1391 B17R2.2342 C[C@@H](OCc1ccccc1)c2ccccc2 7a_100000761318_100000211182 [0,1,0,0,0,0|0,0,0]=1 1392 B17R2.2342 C[C@@H](OCc1ccccn1)c2ccccc2 34a_100000761318_100000721315 [0,1,0,0,0,0|1,0,0]=2 1393 B17R2.2342 C[C@@H](OCc1ccccn1)c2ccccc2 7a_100000761318_100000721315 [0,1,0,0,0,0|1,0,0]=2 1394 B17R2.2342 C[C@@H](OCc1cccnc1)c2ccccc2 34a_100000761318_100000733263 [0,1,0,0,0,0|1,0,0]=2 1395 B17R2.2342 C[C@@H](OCc1cccnc1)c2ccccc2 7a_100000761318_100000741622 [0,1,0,0,0,0|1,0,0]=2 1396 B17R2.2342 C[C@@H](OCc1cccnn1)c2ccccc2 34a_100000761318_100016990269 [0,1,0,0,0,0|2,0,0]=3 1397 B17R2.2342 C[C@@H](OCc1cccnn1)c2ccccc2 7a_100000761318_100016990269 [0,1,0,0,0,0|2,0,0]=3 1398 B17R2.2342 C[C@@H](OCc1ccncc1)c2ccccc2 7a_100000761318_100015193705 [0,1,0,0,0,0|1,0,0]=2 1399 B17R2.2342 C[C@@H](OCc1cnccn1)c2ccccc2 34a_100000761318_100016995436 [0,1,0,0,0,0|2,0,0]=3 1400 B17R2.2342 C[C@@H](OCc1cnccn1)c2ccccc2 7a_100000761318_100016995436 [0,1,0,0,0,0|2,0,0]=3 1401 B17R2.2342 C[C@@H](OCc1cncnc1)c2ccccc2 34a_100000761318_100015196519 [0,1,0,0,0,0|2,0,0]=3 1402 B17R2.2342 C[C@@H](OCc1cncnc1)c2ccccc2 7a_100000761318_100015196519 [0,1,0,0,0,0|2,0,0]=3 1403 B17R2.2342 C[C@@H](OCc1ncccn1)c2ccccc2 34a_100000761318_100000703007 [0,1,0,0,0,0|2,0,0]=3 1404 B17R2.2342 C[C@@H](OCc1ncccn1)c2ccccc2 7a_100000761318_100000703007 [0,1,0,0,0,0|2,0,0]=3 1405 B17R2.2342 O=C(CCc1ccccc1)c2ccccc2 1458a_100000185807_100000765856 [0,1,0,0,0,0|1,0,1]=3 1406 B17R2.2342 O=C(CCc1ccccn1)c2ccccc2 1458a_100000185807_100015183660 [0,1,0,0,0,0|2,0,1]=4 1407 B17R2.2342 O=C(CCc1cccnc1)c2ccccc2 1458a_100000185807_200011713674 [0,1,0,0,0,0|2,0,1]=4 1408 B17R2.2342 O=C(CCc1ccncc1)c2ccccc2 1458a_100000185807_100000723409 [0,1,0,0,0,0|2,0,1]=4 1409 B17R2.2342 O=C(COc1ccccc1)c2ccccc2 7a_100000210340_100000211460 [0,1,0,0,0,0|2,0,1]=4 1410 B17R2.2342 O=C(CSc1ccccc1)c2ccccc2 62a_100000211460_100000041952 [0,1,0,0,0,0|2,0,1]=4 1411 B17R2.2342 O=C(CSc1ccccc1)c2ccccc2 62a_100000719477_100000211460 [0,1,0,0,0,0|2,0,1]=4 1412 B17R2.2342 O=C(NCc1ccccc1)c2ccccc2 11a_100015324214_100000185807 [0,1,0,0,0,0|1,0,1]=3 1413 B17R2.2342 O=C(NCc1ccccc1)c2ccccc2 1626a_100015324214_100000185807 [0,1,0,0,0,0|1,0,1]=3 1414 B17R2.2342 O=C(NCc1ccccc1)c2ccccc2 240690a_100015324214_100000185807 [0,1,0,0,0,0|1,0,1]=3 1415 B17R2.2342 O=C(NCc1ccccc1)c2ccccc2 527a_100015324214_100000185807 [0,1,0,0,0,0|1,0,1]=3 1416 B17R2.2342 O=C(NCc1ccccn1)c2ccccc2 11a_100000210449_100000185807 [0,1,0,0,0,0|2,0,1]=4 1417 B17R2.2342 O=C(NCc1ccccn1)c2ccccc2 1626a_100000210449_100000185807 [0,1,0,0,0,0|2,0,1]=4 1418 B17R2.2342 O=C(NCc1ccccn1)c2ccccc2 240690a_100000210449_100000185807 [0,1,0,0,0,0|2,0,1]=4 1419 B17R2.2342 O=C(NCc1ccccn1)c2ccccc2 527a_100000210449_100000185807 [0,1,0,0,0,0|2,0,1]=4 1420 B17R2.2342 O=C(NCc1cccnc1)c2ccccc2 11a_100000210453_100000185807 [0,1,0,0,0,0|2,0,1]=4 1421 B17R2.2342 O=C(NCc1cccnc1)c2ccccc2 240690a_100000210453_100000185807 [0,1,0,0,0,0|2,0,1]=4 1422 B17R2.2342 O=C(NCc1cccnc1)c2ccccc2 527a_100000210453_100000185807 [0,1,0,0,0,0|2,0,1]=4 1423 B17R2.2342 O=C(NCc1ccncc1)c2ccccc2 11a_100000210450_100000185807 [0,1,0,0,0,0|2,0,1]=4 1424 B17R2.2342 O=C(NCc1ccncc1)c2ccccc2 1626a_100000210450_100000185807 [0,1,0,0,0,0|2,0,1]=4 1425 B17R2.2342 O=C(NCc1ccncc1)c2ccccc2 240690a_100000210450_100000185807 [0,1,0,0,0,0|2,0,1]=4 1426 B17R2.2342 O=C(NCc1ccncc1)c2ccccc2 527a_100000210450_100000185807 [0,1,0,0,0,0|2,0,1]=4 1427 B17R2.2342 O=C(NNc1ccccc1)c2ccccc2 22a_100015195140_100000185807 [0,1,0,0,0,0|2,0,1]=4 1428 B17R2.2342 O=S(CSc1ccccc1)c2ccccc2 62a_100000719477_100000031784 [0,1,0,0,0,0|3,0,0]=4 1429 B17R2.2342 OC(CNc1ccccc1)c2ccccc2 34a_100000106764_100000185958 [0,1,0,0,0,0|2,0,0]=3 1430 B17R2.2342 OC(COc1ccccc1)c2ccccc2 34a_100000210340_100000185958 [0,1,0,0,0,0|2,0,0]=3 1431 B17R2.2342 OC(COc1ccccc1)c2ccccc2 7a_100000210340_100000185958 [0,1,0,0,0,0|2,0,0]=3 1432 B17R2.2342 OC(COc1cccnc1)c2ccccc2 34a_100000210849_100000185958 [0,1,0,0,0,0|3,0,0]=4 1433 B17R2.2342 OC(COc1cccnc1)c2ccccc2 7a_100000210849_100000185958 [0,1,0,0,0,0|3,0,0]=4 1434 B17R2.2342 OC(COc1ccncc1)c2ccccc2 34a_100000212176_100000185958 [0,1,0,0,0,0|3,0,0]=4 1435 B17R2.2342 OC(CSc1ccccc1)c2ccccc2 62a_100000185958_100000041952 [0,1,0,0,0,0|2,0,0]=3 1436 B17R2.2342 OC(CSc1ccccc1)c2ccccc2 62a_100000719477_100000185958 [0,1,0,0,0,0|2,0,0]=3 1437 B17R2.2342 OC(CSc1ccccn1)c2ccccc2 62a_100000185958_100011216584 [0,1,0,0,0,0|3,0,0]=4 1438 B17R2.2342 OC(CSc1ccccn1)c2ccccc2 62a_100011216584_100000185958 [0,1,0,0,0,0|3,0,0]=4 1439 B17R2.2342 OC(CSc1cccnc1)c2ccccc2 62a_100000185958_100000210063 [0,1,0,0,0,0|3,0,0]=4 1440 B17R2.2342 OC(CSc1cccnc1)c2ccccc2 62a_100000210063_100000185958 [0,1,0,0,0,0|3,0,0]=4 1441 B17R2.2342 OC(CSc1ccncc1)c2ccccc2 62a_100000185958_100000728582 [0,1,0,0,0,0|3,0,0]=4 1442 B17R2.2342 OC(CSc1ccncc1)c2ccccc2 62a_100000728582_100000185958 [0,1,0,0,0,0|3,0,0]=4 1443 B17R2.2342 O[C@H](CNc1ccccc1)c2ccccc2 34a_100000106764_100011933945 [0,1,0,0,0,0|2,0,0]=3 1444 B17R2.2342 O[C@H](COc1ccccc1)c2ccccc2 34a_100000210340_100011933945 [0,1,0,0,0,0|2,0,0]=3 1445 B17R2.2342 O[C@H](COc1ccccc1)c2ccccc2 7a_100000210340_100011933945 [0,1,0,0,0,0|2,0,0]=3 1446 B17R2.2342 O[C@H](COc1cccnc1)c2ccccc2 34a_100000210849_100011933945 [0,1,0,0,0,0|3,0,0]=4 1447 B17R2.2342 O[C@H](COc1cccnc1)c2ccccc2 7a_100000210849_100011933945 [0,1,0,0,0,0|3,0,0]=4 1448 B17R2.2342 O[C@H](COc1ccncc1)c2ccccc2 34a_100000212176_100011933945 [0,1,0,0,0,0|3,0,0]=4 1449 B17R2.2342 O[C@H](CSc1ccccc1)c2ccccc2 62a_100000719477_100011933945 [0,1,0,0,0,0|2,0,0]=3 1450 B17R2.2342 O[C@H](CSc1ccccc1)c2ccccc2 62a_100011933945_100000041952 [0,1,0,0,0,0|2,0,0]=3 1451 B17R2.2342 O[C@H](CSc1ccccn1)c2ccccc2 62a_100011216584_100011933945 [0,1,0,0,0,0|3,0,0]=4 1452 B17R2.2342 O[C@H](CSc1ccccn1)c2ccccc2 62a_100011933945_100011216584 [0,1,0,0,0,0|3,0,0]=4 1453 B17R2.2342 O[C@H](CSc1cccnc1)c2ccccc2 62a_100000210063_100011933945 [0,1,0,0,0,0|3,0,0]=4 1454 B17R2.2342 O[C@H](CSc1cccnc1)c2ccccc2 62a_100011933945_100000210063 [0,1,0,0,0,0|3,0,0]=4 1455 B17R2.2342 O[C@H](CSc1ccncc1)c2ccccc2 62a_100000728582_100011933945 [0,1,0,0,0,0|3,0,0]=4 1456 B17R2.2342 O[C@H](CSc1ccncc1)c2ccccc2 62a_100011933945_100000728582 [0,1,0,0,0,0|3,0,0]=4 1457 B17R2.3956 Brc1ccccc1C=CCc2ccccc2 271570a_200016263579_100000695589 [0,1,0,0,0,0|1,0,1]=3 1458 B17R2.3956 Brc1ccccc1C=NNc2ccccc2 4a_100015195140_100000211189 [0,1,0,0,0,0|2,0,1]=4 1459 B17R2.3956 Brc1ccccc1CCNc2ccccc2 34a_100000106764_100012161201 [0,1,0,0,0,0|2,0,0]=3 1460 B17R2.3956 Brc1ccccc1CCOc2ccccc2 34a_100000210340_100012161201 [0,1,0,0,0,0|2,0,0]=3 1461 B17R2.3956 Brc1ccccc1CCOc2ccccc2 7a_100000210340_100012161201 [0,1,0,0,0,0|2,0,0]=3 1462 B17R2.3956 Brc1ccccc1CCOc2cccnc2 34a_100000210849_100012161201 [0,1,0,0,0,0|3,0,0]=4 1463 B17R2.3956 Brc1ccccc1CCOc2cccnc2 7a_100000210849_100012161201 [0,1,0,0,0,0|3,0,0]=4 1464 B17R2.3956 Brc1ccccc1CCOc2ccncc2 34a_100000212176_100012161201 [0,1,0,0,0,0|3,0,0]=4 1465 B17R2.3956 Brc1ccccc1CCSc2ccccc2 62a_100000719477_100012161201 [0,1,0,0,0,0|2,0,0]=3 1466 B17R2.3956 Brc1ccccc1CCSc2ccccc2 62a_100012161201_100000041952 [0,1,0,0,0,0|2,0,0]=3 1467 B17R2.3956 Brc1ccccc1CCSc2ccccn2 62a_100011216584_100012161201 [0,1,0,0,0,0|3,0,0]=4 1468 B17R2.3956 Brc1ccccc1CCSc2ccccn2 62a_100012161201_100011216584 [0,1,0,0,0,0|3,0,0]=4 1469 B17R2.3956 Brc1ccccc1CCSc2cccnc2 62a_100000210063_100012161201 [0,1,0,0,0,0|3,0,0]=4 1470 B17R2.3956 Brc1ccccc1CCSc2cccnc2 62a_100012161201_100000210063 [0,1,0,0,0,0|3,0,0]=4 1471 B17R2.3956 Brc1ccccc1CCSc2ccncc2 62a_100000728582_100012161201 [0,1,0,0,0,0|3,0,0]=4 1472 B17R2.3956 Brc1ccccc1CCSc2ccncc2 62a_100012161201_100000728582 [0,1,0,0,0,0|3,0,0]=4 1473 B17R2.3956 Brc1ccccc1CNCc2ccccc2 207a_100000689332_100015611070 [0,1,0,0,0,0|1,0,0]=2 1474 B17R2.3956 Brc1ccccc1CNCc2ccccc2 207a_100015324214_100000211189 [0,1,0,0,0,0|1,0,0]=2 1475 B17R2.3956 Brc1ccccc1CNCc2ccccc2 2230a_100000689332_100015291786 [0,1,0,0,0,0|1,0,0]=2 1476 B17R2.3956 Brc1ccccc1CNCc2ccccc2 2230a_100015324214_100000184730 [0,1,0,0,0,0|1,0,0]=2 1477 B17R2.3956 Brc1ccccc1CNCc2ccccc2 270004a_100000689332_100015611070 [0,1,0,0,0,0|1,0,0]=2 1478 B17R2.3956 Brc1ccccc1CNCc2ccccc2 270004a_100015324214_100000211189 [0,1,0,0,0,0|1,0,0]=2 1479 B17R2.3956 Brc1ccccc1CNCc2ccccc2 34a_100000689332_100015291786 [0,1,0,0,0,0|1,0,0]=2 1480 B17R2.3956 Brc1ccccc1CNCc2ccccc2 34a_100015324214_100000184730 [0,1,0,0,0,0|1,0,0]=2 1481 B17R2.3956 Brc1ccccc1CNCc2ccccn2 207a_100000689332_100000209966 [0,1,0,0,0,0|2,0,0]=3 1482 B17R2.3956 Brc1ccccc1CNCc2ccccn2 2230a_100000689332_100000721315 [0,1,0,0,0,0|2,0,0]=3 1483 B17R2.3956 Brc1ccccc1CNCc2ccccn2 270004a_100000210449_100000211189 [0,1,0,0,0,0|2,0,0]=3 1484 B17R2.3956 Brc1ccccc1CNCc2ccccn2 270004a_100000689332_100000209966 [0,1,0,0,0,0|2,0,0]=3 1485 B17R2.3956 Brc1ccccc1CNCc2ccccn2 34a_100000689332_100000721315 [0,1,0,0,0,0|2,0,0]=3 1486 B17R2.3956 Brc1ccccc1CNCc2cccnc2 207a_100000210453_100000211189 [0,1,0,0,0,0|2,0,0]=3 1487 B17R2.3956 Brc1ccccc1CNCc2cccnc2 207a_100000689332_100000209961 [0,1,0,0,0,0|2,0,0]=3 1488 B17R2.3956 Brc1ccccc1CNCc2cccnc2 2230a_100000689332_100000741622 [0,1,0,0,0,0|2,0,0]=3 1489 B17R2.3956 Brc1ccccc1CNCc2cccnc2 270004a_100000210453_100000211189 [0,1,0,0,0,0|2,0,0]=3 1490 B17R2.3956 Brc1ccccc1CNCc2cccnc2 270004a_100000689332_100000209961 [0,1,0,0,0,0|2,0,0]=3 1491 B17R2.3956 Brc1ccccc1CNCc2cccnc2 34a_100000689332_100000733263 [0,1,0,0,0,0|2,0,0]=3 1492 B17R2.3956 Brc1ccccc1CNCc2cccnn2 2230a_100000689332_100016990269 [0,1,0,0,0,0|3,0,0]=4 1493 B17R2.3956 Brc1ccccc1CNCc2cccnn2 2230a_100159270163_100000184730 [0,1,0,0,0,0|3,0,0]=4 1494 B17R2.3956 Brc1ccccc1CNCc2cccnn2 34a_100000689332_100016990269 [0,1,0,0,0,0|3,0,0]=4 1495 B17R2.3956 Brc1ccccc1CNCc2ccncc2 207a_100000689332_100000186114 [0,1,0,0,0,0|2,0,0]=3 1496 B17R2.3956 Brc1ccccc1CNCc2ccncc2 2230a_100000689332_100015193705 [0,1,0,0,0,0|2,0,0]=3 1497 B17R2.3956 Brc1ccccc1CNCc2ccnnc2 270004a_100000689332_100011934578 [0,1,0,0,0,0|3,0,0]=4 1498 B17R2.3956 Brc1ccccc1CNCc2cnccn2 2230a_100000689332_100016995436 [0,1,0,0,0,0|3,0,0]=4 1499 B17R2.3956 Brc1ccccc1CNCc2cnccn2 270004a_100000689332_100000749867 [0,1,0,0,0,0|3,0,0]=4 1500 B17R2.3956 Brc1ccccc1CNCc2cnccn2 34a_100000689332_100016995436 [0,1,0,0,0,0|3,0,0]=4 1501 B17R2.3956 Brc1ccccc1CNCc2cncnc2 207a_100011243677_100000211189 [0,1,0,0,0,0|3,0,0]=4 1502 B17R2.3956 Brc1ccccc1CNCc2cncnc2 2230a_100000689332_100015196519 [0,1,0,0,0,0|3,0,0]=4 1503 B17R2.3956 Brc1ccccc1CNCc2cncnc2 2230a_100011243677_100000184730 [0,1,0,0,0,0|3,0,0]=4 1504 B17R2.3956 Brc1ccccc1CNCc2cncnc2 270004a_100000689332_100000749868 [0,1,0,0,0,0|3,0,0]=4 1505 B17R2.3956 Brc1ccccc1CNCc2cncnc2 270004a_100011243677_100000211189 [0,1,0,0,0,0|3,0,0]=4 1506 B17R2.3956 Brc1ccccc1CNCc2cncnc2 34a_100000689332_100015196519 [0,1,0,0,0,0|3,0,0]=4 1507 B17R2.3956 Brc1ccccc1CNCc2ncccn2 2230a_100000689332_100000703007 [0,1,0,0,0,0|3,0,0]=4 1508 B17R2.3956 Brc1ccccc1CNCc2ncccn2 270004a_100000689332_100011532527 [0,1,0,0,0,0|3,0,0]=4 1509 B17R2.3956 Brc1ccccc1CNCc2ncccn2 34a_100000689332_100000703007 [0,1,0,0,0,0|3,0,0]=4 1510 B17R2.3956 Brc1ccccc1COCc2ccccc2 34a_100000210790_100000184730 [0,1,0,0,0,0|0,0,0]=1 1511 B17R2.3956 Brc1ccccc1COCc2ccccc2 34a_100000756307_100015291786 [0,1,0,0,0,0|0,0,0]=1 1512 B17R2.3956 Brc1ccccc1COCc2ccccc2 7a_100000210790_100000184730 [0,1,0,0,0,0|0,0,0]=1 1513 B17R2.3956 Brc1ccccc1COCc2ccccc2 7a_100000756307_100000211182 [0,1,0,0,0,0|0,0,0]=1 1514 B17R2.3956 Brc1ccccc1COCc2ccccn2 34a_100000756307_100000721315 [0,1,0,0,0,0|1,0,0]=2 1515 B17R2.3956 Brc1ccccc1COCc2ccccn2 7a_100000756307_100000721315 [0,1,0,0,0,0|1,0,0]=2 1516 B17R2.3956 Brc1ccccc1COCc2cccnc2 34a_100000756307_100000733263 [0,1,0,0,0,0|1,0,0]=2 1517 B17R2.3956 Brc1ccccc1COCc2cccnc2 7a_100000756307_100000741622 [0,1,0,0,0,0|1,0,0]=2 1518 B17R2.3956 Brc1ccccc1COCc2cccnn2 34a_100000756307_100016990269 [0,1,0,0,0,0|2,0,0]=3 1519 B17R2.3956 Brc1ccccc1COCc2cccnn2 7a_100000756307_100016990269 [0,1,0,0,0,0|2,0,0]=3 1520 B17R2.3956 Brc1ccccc1COCc2ccncc2 7a_100000756307_100015193705 [0,1,0,0,0,0|1,0,0]=2 1521 B17R2.3956 Brc1ccccc1COCc2cnccn2 34a_100000756307_100016995436 [0,1,0,0,0,0|2,0,0]=3 1522 B17R2.3956 Brc1ccccc1COCc2cnccn2 7a_100000756307_100016995436 [0,1,0,0,0,0|2,0,0]=3 1523 B17R2.3956 Brc1ccccc1COCc2cncnc2 34a_100000756307_100015196519 [0,1,0,0,0,0|2,0,0]=3 1524 B17R2.3956 Brc1ccccc1COCc2cncnc2 7a_100000756307_100015196519 [0,1,0,0,0,0|2,0,0]=3 1525 B17R2.3956 Brc1ccccc1COCc2ncccn2 34a_100000756307_100000703007 [0,1,0,0,0,0|2,0,0]=3 1526 B17R2.3956 Brc1ccccc1COCc2ncccn2 7a_100000756307_100000703007 [0,1,0,0,0,0|2,0,0]=3 1527 B17R2.3956 Brc1ccccc1CSCc2ccccc2 62a_100000184730_100015291786 [0,1,0,0,0,0|0,1,0]=2 1528 B17R2.3956 Brc1ccccc1CSCc2ccccc2 62a_100000211182_100000184730 [0,1,0,0,0,0|0,1,0]=2 1529 B17R2.3956 Brc1ccccc1CSCc2ccccn2 62a_100000184730_100000721315 [0,1,0,0,0,0|1,1,0]=3 1530 B17R2.3956 Brc1ccccc1CSCc2ccccn2 62a_100000721315_100000184730 [0,1,0,0,0,0|1,1,0]=3 1531 B17R2.3956 Brc1ccccc1CSCc2cccnc2 62a_100000184730_100000741622 [0,1,0,0,0,0|1,1,0]=3 1532 B17R2.3956 Brc1ccccc1CSCc2cccnc2 62a_100000741622_100000184730 [0,1,0,0,0,0|1,1,0]=3 1533 B17R2.3956 Brc1ccccc1CSCc2cccnn2 62a_100000184730_100016990269 [0,1,0,0,0,0|2,1,0]=4 1534 B17R2.3956 Brc1ccccc1CSCc2cccnn2 62a_100016990269_100000184730 [0,1,0,0,0,0|2,1,0]=4 1535 B17R2.3956 Brc1ccccc1CSCc2ccncc2 62a_100000184730_100015193705 [0,1,0,0,0,0|1,1,0]=3 1536 B17R2.3956 Brc1ccccc1CSCc2ccncc2 62a_100015193705_100000184730 [0,1,0,0,0,0|1,1,0]=3 1537 B17R2.3956 Brc1ccccc1CSCc2cnccn2 62a_100000184730_100016995436 [0,1,0,0,0,0|2,1,0]=4 1538 B17R2.3956 Brc1ccccc1CSCc2cnccn2 62a_100016995436_100000184730 [0,1,0,0,0,0|2,1,0]=4 1539 B17R2.3956 Brc1ccccc1CSCc2cncnc2 62a_100000184730_100015196519 [0,1,0,0,0,0|2,1,0]=4 1540 B17R2.3956 Brc1ccccc1CSCc2cncnc2 62a_100015196519_100000184730 [0,1,0,0,0,0|2,1,0]=4 1541 B17R2.3956 Brc1ccccc1CSCc2ncccn2 62a_100000184730_100000703007 [0,1,0,0,0,0|2,1,0]=4 1542 B17R2.3956 Brc1ccccc1CSCc2ncccn2 62a_100000703007_100000184730 [0,1,0,0,0,0|2,1,0]=4 1543 B17R2.3956 Brc1ccccc1NCCc2ccccc2 34a_100000210017_100000765856 [0,1,0,0,0,0|2,0,0]=3 1544 B17R2.3956 Brc1ccccc1NN=Cc2ccccc2 4a_100000241748_100015611070 [0,1,0,0,0,0|2,0,1]=4 1545 B17R2.3956 Brc1ccccc1OCCc2ccccc2 34a_100000181306_100000765856 [0,1,0,0,0,0|2,0,0]=3 1546 B17R2.3956 Brc1ccccc1OCCc2ccccc2 7a_100000181306_100000765856 [0,1,0,0,0,0|2,0,0]=3 1547 B17R2.3956 Brc1ccccc1OCCc2ccccn2 7a_100000181306_100015183660 [0,1,0,0,0,0|3,0,0]=4 1548 B17R2.3956 Brc1ccccc1OCCc2cccnc2 7a_100000181306_200011713674 [0,1,0,0,0,0|3,0,0]=4 1549 B17R2.3956 Brc1ccccc1OCCc2ccncc2 7a_100000181306_100000723409 [0,1,0,0,0,0|3,0,0]=4 1550 B17R2.3956 Brc1ccccc1SCCc2ccccc2 62a_100000695589_100011218657 [0,1,0,0,0,0|2,0,0]=3 1551 B17R2.3956 Brc1ccccc1SCCc2ccccc2 62a_100000765856_100000695589 [0,1,0,0,0,0|2,0,0]=3 1552 B17R2.3956 Brc1ccccc1SCCc2ccccn2 62a_100000695589_100015183660 [0,1,0,0,0,0|3,0,0]=4 1553 B17R2.3956 Brc1ccccc1SCCc2ccccn2 62a_100015183660_100000695589 [0,1,0,0,0,0|3,0,0]=4 1554 B17R2.3956 Brc1ccccc1SCCc2cccnc2 62a_100000695589_200011713674 [0,1,0,0,0,0|3,0,0]=4 1555 B17R2.3956 Brc1ccccc1SCCc2cccnc2 62a_200011713674_100000695589 [0,1,0,0,0,0|3,0,0]=4 1556 B17R2.3956 Brc1ccccc1SCCc2ccncc2 62a_100000695589_100000723409 [0,1,0,0,0,0|3,0,0]=4 1557 B17R2.3956 Brc1ccccc1SCCc2ccncc2 62a_100000723409_100000695589 [0,1,0,0,0,0|3,0,0]=4 1558 B17R2.3956 Brc1ccccc1SCSc2ccccc2 62a_100000695589_100011218342 [0,1,0,0,0,0|3,0,0]=4 1559 B17R2.3956 Brc1ccccc1SCSc2ccccc2 62a_100011218342_100000695589 [0,1,0,0,0,0|3,0,0]=4 1560 B17R2.3956 Brc1cccnc1C=CCc2ccccc2 271570a_200016263579_100000696092 [0,1,0,0,0,0|2,0,1]=4 1561 B17R2.3956 Brc1cccnc1CNCc2ccccc2 207a_100015324214_100011934733 [0,1,0,0,0,0|2,0,0]=3 1562 B17R2.3956 Brc1cccnc1CNCc2ccccc2 2230a_100015324214_100025702911 [0,1,0,0,0,0|2,0,0]=3 1563 B17R2.3956 Brc1cccnc1CNCc2ccccc2 270004a_100015324214_100011934733 [0,1,0,0,0,0|2,0,0]=3 1564 B17R2.3956 Brc1cccnc1CNCc2ccccc2 270004a_100020591323_100015611070 [0,1,0,0,0,0|2,0,0]=3 1565 B17R2.3956 Brc1cccnc1CNCc2ccccc2 34a_100015324214_100025702911 [0,1,0,0,0,0|2,0,0]=3 1566 B17R2.3956 Brc1cccnc1CNCc2ccccn2 270004a_100000210449_100011934733 [0,1,0,0,0,0|3,0,0]=4 1567 B17R2.3956 Brc1cccnc1CNCc2ccccn2 270004a_100020591323_100000209966 [0,1,0,0,0,0|3,0,0]=4 1568 B17R2.3956 Brc1cccnc1CNCc2cccnc2 207a_100000210453_100011934733 [0,1,0,0,0,0|3,0,0]=4 1569 B17R2.3956 Brc1cccnc1CNCc2cccnc2 270004a_100000210453_100011934733 [0,1,0,0,0,0|3,0,0]=4 1570 B17R2.3956 Brc1cccnc1CNCc2cccnc2 270004a_100020591323_100000209961 [0,1,0,0,0,0|3,0,0]=4 1571 B17R2.3956 Brc1cccnc1COCc2ccccc2 34a_100000210790_100025702911 [0,1,0,0,0,0|1,0,0]=2 1572 B17R2.3956 Brc1cccnc1COCc2ccccc2 34a_100011996772_100015291786 [0,1,0,0,0,0|1,0,0]=2 1573 B17R2.3956 Brc1cccnc1COCc2ccccc2 7a_100000210790_100025702911 [0,1,0,0,0,0|1,0,0]=2 1574 B17R2.3956 Brc1cccnc1COCc2ccccn2 34a_100011996772_100000721315 [0,1,0,0,0,0|2,0,0]=3 1575 B17R2.3956 Brc1cccnc1COCc2cccnc2 34a_100011996772_100000733263 [0,1,0,0,0,0|2,0,0]=3 1576 B17R2.3956 Brc1cccnc1COCc2cccnn2 34a_100011996772_100016990269 [0,1,0,0,0,0|3,0,0]=4 1577 B17R2.3956 Brc1cccnc1COCc2cnccn2 34a_100011996772_100016995436 [0,1,0,0,0,0|3,0,0]=4 1578 B17R2.3956 Brc1cccnc1COCc2cncnc2 34a_100011996772_100015196519 [0,1,0,0,0,0|3,0,0]=4 1579 B17R2.3956 Brc1cccnc1COCc2ncccn2 34a_100011996772_100000703007 [0,1,0,0,0,0|3,0,0]=4 1580 B17R2.3956 Brc1cccnc1CSCc2ccccc2 62a_100000211182_100025702911 [0,1,0,0,0,0|1,1,0]=3 1581 B17R2.3956 Brc1cccnc1CSCc2ccccc2 62a_100025702911_100015291786 [0,1,0,0,0,0|1,1,0]=3 1582 B17R2.3956 Brc1cccnc1CSCc2ccccn2 62a_100000721315_100025702911 [0,1,0,0,0,0|2,1,0]=4 1583 B17R2.3956 Brc1cccnc1CSCc2ccccn2 62a_100025702911_100000721315 [0,1,0,0,0,0|2,1,0]=4 1584 B17R2.3956 Brc1cccnc1CSCc2cccnc2 62a_100000741622_100025702911 [0,1,0,0,0,0|2,1,0]=4 1585 B17R2.3956 Brc1cccnc1CSCc2cccnc2 62a_100025702911_100000741622 [0,1,0,0,0,0|2,1,0]=4 1586 B17R2.3956 Brc1cccnc1CSCc2ccncc2 62a_100015193705_100025702911 [0,1,0,0,0,0|2,1,0]=4 1587 B17R2.3956 Brc1cccnc1CSCc2ccncc2 62a_100025702911_100015193705 [0,1,0,0,0,0|2,1,0]=4 1588 B17R2.3956 Brc1cccnc1NCCc2ccccc2 27a_100000106460_100000696092 [0,1,0,0,0,0|3,0,0]=4 1589 B17R2.3956 Brc1cccnc1SCCc2ccccc2 62a_100000696092_100011218657 [0,1,0,0,0,0|3,0,0]=4 1590 B17R2.3956 Brc1cccnc1SCCc2ccccc2 62a_100000765856_100000696092 [0,1,0,0,0,0|3,0,0]=4 1591 B17R2.3956 Brc1ccncc1C=CCc2ccccc2 271570a_200016263579_100010138639 [0,1,0,0,0,0|2,0,1]=4 1592 B17R2.3956 Brc1ccncc1CNCc2ccccc2 270004a_100015324214_100009816821 [0,1,0,0,0,0|2,0,0]=3 1593 B17R2.3956 Brc1ccncc1CNCc2ccccn2 270004a_100000210449_100009816821 [0,1,0,0,0,0|3,0,0]=4 1594 B17R2.3956 Brc1ccncc1CNCc2cccnc2 270004a_100000210453_100009816821 [0,1,0,0,0,0|3,0,0]=4 1595 B17R2.3956 Brc1ccncc1SCCc2ccccc2 62a_100000765856_100010138639 [0,1,0,0,0,0|3,0,0]=4 1596 B17R2.3956 Brc1ccncc1SCCc2ccccc2 62a_100010138639_100011218657 [0,1,0,0,0,0|3,0,0]=4 1597 B17R2.3956 Brc1cnccc1C=CCc2ccccc2 271570a_200016263579_100000726257 [0,1,0,0,0,0|2,0,1]=4 1598 B17R2.3956 Brc1cnccc1CNCc2ccccc2 207a_100020640021_100015611070 [0,1,0,0,0,0|2,0,0]=3 1599 B17R2.3956 Brc1cnccc1CNCc2ccccc2 270004a_100015324214_100000755692 [0,1,0,0,0,0|2,0,0]=3 1600 B17R2.3956 Brc1cnccc1CNCc2ccccc2 270004a_100020640021_100015611070 [0,1,0,0,0,0|2,0,0]=3 1601 B17R2.3956 Brc1cnccc1CNCc2ccccn2 207a_100020640021_100000209966 [0,1,0,0,0,0|3,0,0]=4 1602 B17R2.3956 Brc1cnccc1CNCc2ccccn2 270004a_100000210449_100000755692 [0,1,0,0,0,0|3,0,0]=4 1603 B17R2.3956 Brc1cnccc1CNCc2ccccn2 270004a_100020640021_100000209966 [0,1,0,0,0,0|3,0,0]=4 1604 B17R2.3956 Brc1cnccc1CNCc2cccnc2 207a_100020640021_100000209961 [0,1,0,0,0,0|3,0,0]=4 1605 B17R2.3956 Brc1cnccc1CNCc2cccnc2 270004a_100000210453_100000755692 [0,1,0,0,0,0|3,0,0]=4 1606 B17R2.3956 Brc1cnccc1CNCc2cccnc2 270004a_100020640021_100000209961 [0,1,0,0,0,0|3,0,0]=4 1607 B17R2.3956 Brc1cnccc1CNCc2ccncc2 207a_100020640021_100000186114 [0,1,0,0,0,0|3,0,0]=4 1608 B17R2.3956 Brc1cnccc1NCCc2ccccc2 27a_100000106460_100000726257 [0,1,0,0,0,0|3,0,0]=4 1609 B17R2.3956 Brc1cnccc1OCCc2ccccc2 34a_100011996408_100000765856 [0,1,0,0,0,0|3,0,0]=4 1610 B17R2.3956 Brc1cnccc1SCCc2ccccc2 62a_100000726257_100011218657 [0,1,0,0,0,0|3,0,0]=4 1611 B17R2.3956 Brc1cnccc1SCCc2ccccc2 62a_100000765856_100000726257 [0,1,0,0,0,0|3,0,0]=4 1612 B17R2.3956 Brc1ncccc1C=CCc2ccccc2 271570a_200016263579_100010202626 [0,1,0,0,0,0|2,0,1]=4 1613 B17R2.3956 Brc1ncccc1CNCc2ccccc2 2230a_100009818023_100015291786 [0,1,0,0,0,0|2,0,0]=3 1614 B17R2.3956 Brc1ncccc1CNCc2ccccc2 2230a_100015324214_100010140945 [0,1,0,0,0,0|2,0,0]=3 1615 B17R2.3956 Brc1ncccc1CNCc2ccccc2 270004a_100009818023_100015611070 [0,1,0,0,0,0|2,0,0]=3 1616 B17R2.3956 Brc1ncccc1CNCc2ccccc2 34a_100009818023_100015291786 [0,1,0,0,0,0|2,0,0]=3 1617 B17R2.3956 Brc1ncccc1CNCc2ccccc2 34a_100015324214_100010140945 [0,1,0,0,0,0|2,0,0]=3 1618 B17R2.3956 Brc1ncccc1CNCc2ccccn2 2230a_100009818023_100000721315 [0,1,0,0,0,0|3,0,0]=4 1619 B17R2.3956 Brc1ncccc1CNCc2ccccn2 270004a_100009818023_100000209966 [0,1,0,0,0,0|3,0,0]=4 1620 B17R2.3956 Brc1ncccc1CNCc2ccccn2 34a_100009818023_100000721315 [0,1,0,0,0,0|3,0,0]=4 1621 B17R2.3956 Brc1ncccc1CNCc2cccnc2 2230a_100009818023_100000741622 [0,1,0,0,0,0|3,0,0]=4 1622 B17R2.3956 Brc1ncccc1CNCc2cccnc2 270004a_100009818023_100000209961 [0,1,0,0,0,0|3,0,0]=4 1623 B17R2.3956 Brc1ncccc1CNCc2cccnc2 34a_100009818023_100000733263 [0,1,0,0,0,0|3,0,0]=4 1624 B17R2.3956 Brc1ncccc1CNCc2ccncc2 2230a_100009818023_100015193705 [0,1,0,0,0,0|3,0,0]=4 1625 B17R2.3956 Brc1ncccc1COCc2ccccc2 34a_100000210790_100010140945 [0,1,0,0,0,0|1,0,0]=2 1626 B17R2.3956 Brc1ncccc1COCc2ccccc2 34a_100000719692_100015291786 [0,1,0,0,0,0|1,0,0]=2 1627 B17R2.3956 Brc1ncccc1COCc2ccccc2 7a_100000210790_100010140945 [0,1,0,0,0,0|1,0,0]=2 1628 B17R2.3956 Brc1ncccc1COCc2ccccc2 7a_100000719692_100000211182 [0,1,0,0,0,0|1,0,0]=2 1629 B17R2.3956 Brc1ncccc1COCc2ccccn2 34a_100000719692_100000721315 [0,1,0,0,0,0|2,0,0]=3 1630 B17R2.3956 Brc1ncccc1COCc2ccccn2 7a_100000719692_100000721315 [0,1,0,0,0,0|2,0,0]=3 1631 B17R2.3956 Brc1ncccc1COCc2cccnc2 34a_100000719692_100000733263 [0,1,0,0,0,0|2,0,0]=3 1632 B17R2.3956 Brc1ncccc1COCc2cccnc2 7a_100000719692_100000741622 [0,1,0,0,0,0|2,0,0]=3 1633 B17R2.3956 Brc1ncccc1COCc2cccnn2 34a_100000719692_100016990269 [0,1,0,0,0,0|3,0,0]=4 1634 B17R2.3956 Brc1ncccc1COCc2cccnn2 7a_100000719692_100016990269 [0,1,0,0,0,0|3,0,0]=4 1635 B17R2.3956 Brc1ncccc1COCc2ccncc2 7a_100000719692_100015193705 [0,1,0,0,0,0|2,0,0]=3 1636 B17R2.3956 Brc1ncccc1COCc2cnccn2 34a_100000719692_100016995436 [0,1,0,0,0,0|3,0,0]=4 1637 B17R2.3956 Brc1ncccc1COCc2cnccn2 7a_100000719692_100016995436 [0,1,0,0,0,0|3,0,0]=4 1638 B17R2.3956 Brc1ncccc1COCc2cncnc2 34a_100000719692_100015196519 [0,1,0,0,0,0|3,0,0]=4 1639 B17R2.3956 Brc1ncccc1COCc2cncnc2 7a_100000719692_100015196519 [0,1,0,0,0,0|3,0,0]=4 1640 B17R2.3956 Brc1ncccc1COCc2ncccn2 34a_100000719692_100000703007 [0,1,0,0,0,0|3,0,0]=4 1641 B17R2.3956 Brc1ncccc1COCc2ncccn2 7a_100000719692_100000703007 [0,1,0,0,0,0|3,0,0]=4 1642 B17R2.3956 Brc1ncccc1CSCc2ccccc2 62a_100000211182_100010140945 [0,1,0,0,0,0|1,1,0]=3 1643 B17R2.3956 Brc1ncccc1CSCc2ccccc2 62a_100010140945_100015291786 [0,1,0,0,0,0|1,1,0]=3 1644 B17R2.3956 Brc1ncccc1CSCc2ccccn2 62a_100000721315_100010140945 [0,1,0,0,0,0|2,1,0]=4 1645 B17R2.3956 Brc1ncccc1CSCc2ccccn2 62a_100010140945_100000721315 [0,1,0,0,0,0|2,1,0]=4 1646 B17R2.3956 Brc1ncccc1CSCc2cccnc2 62a_100000741622_100010140945 [0,1,0,0,0,0|2,1,0]=4 1647 B17R2.3956 Brc1ncccc1CSCc2cccnc2 62a_100010140945_100000741622 [0,1,0,0,0,0|2,1,0]=4 1648 B17R2.3956 Brc1ncccc1CSCc2ccncc2 62a_100010140945_100015193705 [0,1,0,0,0,0|2,1,0]=4 1649 B17R2.3956 Brc1ncccc1CSCc2ccncc2 62a_100015193705_100010140945 [0,1,0,0,0,0|2,1,0]=4 1650 B17R2.3956 Brc1ncccc1OCCc2ccccc2 34a_100000744436_100000765856 [0,1,0,0,0,0|3,0,0]=4 1651 B17R2.3956 Brc1ncccc1OCCc2ccccc2 7a_100000744436_100000765856 [0,1,0,0,0,0|3,0,0]=4 1652 B17R2.3956 Brc1ncccc1SCCc2ccccc2 62a_100000765856_100010202626 [0,1,0,0,0,0|3,0,0]=4 1653 B17R2.3956 Brc1ncccc1SCCc2ccccc2 62a_100010202626_100011218657 [0,1,0,0,0,0|3,0,0]=4 1654 B17R2.3956 C[n+]1ccccc1C=CCc2ccccc2 271570a_200016263579_100000212160 [0,1,0,0,0,0|2,0,1]=4 1655 B17R2.3956 C[n+]1ccccc1SCCc2ccccc2 62a_100000765856_100000212160 [0,1,0,0,0,0|3,0,0]=4 1656 B17R2.3956 Cc1ccccc1C=CCc2ccccc2 271570a_200016263579_100000210755 [0,1,0,0,0,0|1,0,1]=3 1657 B17R2.3956 Cc1ccccc1C=NNc2ccccc2 4a_100015195140_100000211143 [0,1,0,0,0,0|2,0,1]=4 1658 B17R2.3956 Cc1ccccc1CCNc2ccccc2 34a_100000106764_100011713688 [0,1,0,0,0,0|2,0,0]=3 1659 B17R2.3956 Cc1ccccc1CCOc2ccccc2 34a_100000210340_100011713688 [0,1,0,0,0,0|2,0,0]=3 1660 B17R2.3956 Cc1ccccc1CCOc2ccccc2 7a_100000210340_100011713688 [0,1,0,0,0,0|2,0,0]=3 1661 B17R2.3956 Cc1ccccc1CCOc2cccnc2 34a_100000210849_100011713688 [0,1,0,0,0,0|3,0,0]=4 1662 B17R2.3956 Cc1ccccc1CCOc2cccnc2 7a_100000210849_100011713688 [0,1,0,0,0,0|3,0,0]=4 1663 B17R2.3956 Cc1ccccc1CCOc2ccncc2 34a_100000212176_100011713688 [0,1,0,0,0,0|3,0,0]=4 1664 B17R2.3956 Cc1ccccc1CCSc2ccccc2 62a_100000719477_100011713688 [0,1,0,0,0,0|2,0,0]=3 1665 B17R2.3956 Cc1ccccc1CCSc2ccccc2 62a_100011713688_100000041952 [0,1,0,0,0,0|2,0,0]=3 1666 B17R2.3956 Cc1ccccc1CCSc2ccccn2 62a_100011216584_100011713688 [0,1,0,0,0,0|3,0,0]=4 1667 B17R2.3956 Cc1ccccc1CCSc2ccccn2 62a_100011713688_100011216584 [0,1,0,0,0,0|3,0,0]=4 1668 B17R2.3956 Cc1ccccc1CCSc2cccnc2 62a_100000210063_100011713688 [0,1,0,0,0,0|3,0,0]=4 1669 B17R2.3956 Cc1ccccc1CCSc2cccnc2 62a_100011713688_100000210063 [0,1,0,0,0,0|3,0,0]=4 1670 B17R2.3956 Cc1ccccc1CCSc2ccncc2 62a_100000728582_100011713688 [0,1,0,0,0,0|3,0,0]=4 1671 B17R2.3956 Cc1ccccc1CCSc2ccncc2 62a_100011713688_100000728582 [0,1,0,0,0,0|3,0,0]=4 1672 B17R2.3956 Cc1ccccc1CNCc2ccccc2 207a_100000174972_100015611070 [0,1,0,0,0,0|1,0,0]=2 1673 B17R2.3956 Cc1ccccc1CNCc2ccccc2 207a_100015324214_100000211143 [0,1,0,0,0,0|1,0,0]=2 1674 B17R2.3956 Cc1ccccc1CNCc2ccccc2 2230a_100015324214_100000211839 [0,1,0,0,0,0|1,0,0]=2 1675 B17R2.3956 Cc1ccccc1CNCc2ccccc2 270004a_100000174972_100015611070 [0,1,0,0,0,0|1,0,0]=2 1676 B17R2.3956 Cc1ccccc1CNCc2ccccc2 270004a_100015324214_100000211143 [0,1,0,0,0,0|1,0,0]=2 1677 B17R2.3956 Cc1ccccc1CNCc2ccccc2 34a_100000174972_100015291786 [0,1,0,0,0,0|1,0,0]=2 1678 B17R2.3956 Cc1ccccc1CNCc2ccccc2 34a_100015324214_100000211839 [0,1,0,0,0,0|1,0,0]=2 1679 B17R2.3956 Cc1ccccc1CNCc2ccccn2 207a_100000174972_100000209966 [0,1,0,0,0,0|2,0,0]=3 1680 B17R2.3956 Cc1ccccc1CNCc2ccccn2 270004a_100000174972_100000209966 [0,1,0,0,0,0|2,0,0]=3 1681 B17R2.3956 Cc1ccccc1CNCc2ccccn2 270004a_100000210449_100000211143 [0,1,0,0,0,0|2,0,0]=3 1682 B17R2.3956 Cc1ccccc1CNCc2ccccn2 34a_100000174972_100000721315 [0,1,0,0,0,0|2,0,0]=3 1683 B17R2.3956 Cc1ccccc1CNCc2cccnc2 207a_100000174972_100000209961 [0,1,0,0,0,0|2,0,0]=3 1684 B17R2.3956 Cc1ccccc1CNCc2cccnc2 207a_100000210453_100000211143 [0,1,0,0,0,0|2,0,0]=3 1685 B17R2.3956 Cc1ccccc1CNCc2cccnc2 270004a_100000174972_100000209961 [0,1,0,0,0,0|2,0,0]=3 1686 B17R2.3956 Cc1ccccc1CNCc2cccnc2 270004a_100000210453_100000211143 [0,1,0,0,0,0|2,0,0]=3 1687 B17R2.3956 Cc1ccccc1CNCc2cccnc2 34a_100000174972_100000733263 [0,1,0,0,0,0|2,0,0]=3 1688 B17R2.3956 Cc1ccccc1CNCc2cccnn2 2230a_100159270163_100000211839 [0,1,0,0,0,0|3,0,0]=4 1689 B17R2.3956 Cc1ccccc1CNCc2cccnn2 34a_100000174972_100016990269 [0,1,0,0,0,0|3,0,0]=4 1690 B17R2.3956 Cc1ccccc1CNCc2ccncc2 207a_100000174972_100000186114 [0,1,0,0,0,0|2,0,0]=3 1691 B17R2.3956 Cc1ccccc1CNCc2ccnnc2 270004a_100000174972_100011934578 [0,1,0,0,0,0|3,0,0]=4 1692 B17R2.3956 Cc1ccccc1CNCc2cnccn2 270004a_100000174972_100000749867 [0,1,0,0,0,0|3,0,0]=4 1693 B17R2.3956 Cc1ccccc1CNCc2cnccn2 34a_100000174972_100016995436 [0,1,0,0,0,0|3,0,0]=4 1694 B17R2.3956 Cc1ccccc1CNCc2cncnc2 207a_100011243677_100000211143 [0,1,0,0,0,0|3,0,0]=4 1695 B17R2.3956 Cc1ccccc1CNCc2cncnc2 2230a_100011243677_100000211839 [0,1,0,0,0,0|3,0,0]=4 1696 B17R2.3956 Cc1ccccc1CNCc2cncnc2 270004a_100000174972_100000749868 [0,1,0,0,0,0|3,0,0]=4 1697 B17R2.3956 Cc1ccccc1CNCc2cncnc2 270004a_100011243677_100000211143 [0,1,0,0,0,0|3,0,0]=4 1698 B17R2.3956 Cc1ccccc1CNCc2cncnc2 34a_100000174972_100015196519 [0,1,0,0,0,0|3,0,0]=4 1699 B17R2.3956 Cc1ccccc1CNCc2ncccn2 270004a_100000174972_100011532527 [0,1,0,0,0,0|3,0,0]=4 1700 B17R2.3956 Cc1ccccc1CNCc2ncccn2 34a_100000174972_100000703007 [0,1,0,0,0,0|3,0,0]=4 1701 B17R2.3956 Cc1ccccc1COCc2ccccc2 34a_100000210790_100000211839 [0,1,0,0,0,0|0,0,0]=1 1702 B17R2.3956 Cc1ccccc1COCc2ccccc2 34a_100000698903_100015291786 [0,1,0,0,0,0|0,0,0]=1 1703 B17R2.3956 Cc1ccccc1COCc2ccccc2 7a_100000210790_100000211839 [0,1,0,0,0,0|0,0,0]=1 1704 B17R2.3956 Cc1ccccc1COCc2ccccc2 7a_100000698903_100000211182 [0,1,0,0,0,0|0,0,0]=1 1705 B17R2.3956 Cc1ccccc1COCc2ccccn2 34a_100000698903_100000721315 [0,1,0,0,0,0|1,0,0]=2 1706 B17R2.3956 Cc1ccccc1COCc2ccccn2 7a_100000698903_100000721315 [0,1,0,0,0,0|1,0,0]=2 1707 B17R2.3956 Cc1ccccc1COCc2cccnc2 34a_100000698903_100000733263 [0,1,0,0,0,0|1,0,0]=2 1708 B17R2.3956 Cc1ccccc1COCc2cccnc2 7a_100000698903_100000741622 [0,1,0,0,0,0|1,0,0]=2 1709 B17R2.3956 Cc1ccccc1COCc2cccnn2 34a_100000698903_100016990269 [0,1,0,0,0,0|2,0,0]=3 1710 B17R2.3956 Cc1ccccc1COCc2cccnn2 7a_100000698903_100016990269 [0,1,0,0,0,0|2,0,0]=3 1711 B17R2.3956 Cc1ccccc1COCc2ccncc2 7a_100000698903_100015193705 [0,1,0,0,0,0|1,0,0]=2 1712 B17R2.3956 Cc1ccccc1COCc2cnccn2 34a_100000698903_100016995436 [0,1,0,0,0,0|2,0,0]=3 1713 B17R2.3956 Cc1ccccc1COCc2cnccn2 7a_100000698903_100016995436 [0,1,0,0,0,0|2,0,0]=3 1714 B17R2.3956 Cc1ccccc1COCc2cncnc2 34a_100000698903_100015196519 [0,1,0,0,0,0|2,0,0]=3 1715 B17R2.3956 Cc1ccccc1COCc2cncnc2 7a_100000698903_100015196519 [0,1,0,0,0,0|2,0,0]=3 1716 B17R2.3956 Cc1ccccc1COCc2ncccn2 34a_100000698903_100000703007 [0,1,0,0,0,0|2,0,0]=3 1717 B17R2.3956 Cc1ccccc1COCc2ncccn2 7a_100000698903_100000703007 [0,1,0,0,0,0|2,0,0]=3 1718 B17R2.3956 Cc1ccccc1CSCc2ccccc2 62a_100000211182_100000211839 [0,1,0,0,0,0|0,1,0]=2 1719 B17R2.3956 Cc1ccccc1CSCc2ccccc2 62a_100000211839_100015291786 [0,1,0,0,0,0|0,1,0]=2 1720 B17R2.3956 Cc1ccccc1CSCc2ccccn2 62a_100000211839_100000721315 [0,1,0,0,0,0|1,1,0]=3 1721 B17R2.3956 Cc1ccccc1CSCc2ccccn2 62a_100000721315_100000211839 [0,1,0,0,0,0|1,1,0]=3 1722 B17R2.3956 Cc1ccccc1CSCc2cccnc2 62a_100000211839_100000741622 [0,1,0,0,0,0|1,1,0]=3 1723 B17R2.3956 Cc1ccccc1CSCc2cccnc2 62a_100000741622_100000211839 [0,1,0,0,0,0|1,1,0]=3 1724 B17R2.3956 Cc1ccccc1CSCc2cccnn2 62a_100000211839_100016990269 [0,1,0,0,0,0|2,1,0]=4 1725 B17R2.3956 Cc1ccccc1CSCc2cccnn2 62a_100016990269_100000211839 [0,1,0,0,0,0|2,1,0]=4 1726 B17R2.3956 Cc1ccccc1CSCc2ccncc2 62a_100000211839_100015193705 [0,1,0,0,0,0|1,1,0]=3 1727 B17R2.3956 Cc1ccccc1CSCc2ccncc2 62a_100015193705_100000211839 [0,1,0,0,0,0|1,1,0]=3 1728 B17R2.3956 Cc1ccccc1CSCc2cnccn2 62a_100000211839_100016995436 [0,1,0,0,0,0|2,1,0]=4 1729 B17R2.3956 Cc1ccccc1CSCc2cnccn2 62a_100016995436_100000211839 [0,1,0,0,0,0|2,1,0]=4 1730 B17R2.3956 Cc1ccccc1CSCc2cncnc2 62a_100000211839_100015196519 [0,1,0,0,0,0|2,1,0]=4 1731 B17R2.3956 Cc1ccccc1CSCc2cncnc2 62a_100015196519_100000211839 [0,1,0,0,0,0|2,1,0]=4 1732 B17R2.3956 Cc1ccccc1CSCc2ncccn2 62a_100000211839_100000703007 [0,1,0,0,0,0|2,1,0]=4 1733 B17R2.3956 Cc1ccccc1CSCc2ncccn2 62a_100000703007_100000211839 [0,1,0,0,0,0|2,1,0]=4 1734 B17R2.3956 Cc1ccccc1NCCc2ccccc2 34a_100015192222_100000765856 [0,1,0,0,0,0|2,0,0]=3 1735 B17R2.3956 Cc1ccccc1NN=Cc2ccccc2 4a_100000184220_100015611070 [0,1,0,0,0,0|2,0,1]=4 1736 B17R2.3956 Cc1ccccc1OCCc2ccccc2 34a_100000210338_100000765856 [0,1,0,0,0,0|2,0,0]=3 1737 B17R2.3956 Cc1ccccc1OCCc2ccccc2 7a_100000210338_100000765856 [0,1,0,0,0,0|2,0,0]=3 1738 B17R2.3956 Cc1ccccc1OCCc2ccccn2 7a_100000210338_100015183660 [0,1,0,0,0,0|3,0,0]=4 1739 B17R2.3956 Cc1ccccc1OCCc2cccnc2 7a_100000210338_200011713674 [0,1,0,0,0,0|3,0,0]=4 1740 B17R2.3956 Cc1ccccc1OCCc2ccncc2 7a_100000210338_100000723409 [0,1,0,0,0,0|3,0,0]=4 1741 B17R2.3956 Cc1ccccc1SCCc2ccccc2 62a_100000210755_100011218657 [0,1,0,0,0,0|2,0,0]=3 1742 B17R2.3956 Cc1ccccc1SCCc2ccccc2 62a_100000765856_100000210755 [0,1,0,0,0,0|2,0,0]=3 1743 B17R2.3956 Cc1ccccc1SCCc2ccccn2 62a_100000210755_100015183660 [0,1,0,0,0,0|3,0,0]=4 1744 B17R2.3956 Cc1ccccc1SCCc2ccccn2 62a_100015183660_100000210755 [0,1,0,0,0,0|3,0,0]=4 1745 B17R2.3956 Cc1ccccc1SCCc2cccnc2 62a_100000210755_200011713674 [0,1,0,0,0,0|3,0,0]=4 1746 B17R2.3956 Cc1ccccc1SCCc2cccnc2 62a_200011713674_100000210755 [0,1,0,0,0,0|3,0,0]=4 1747 B17R2.3956 Cc1ccccc1SCCc2ccncc2 62a_100000210755_100000723409 [0,1,0,0,0,0|3,0,0]=4 1748 B17R2.3956 Cc1ccccc1SCCc2ccncc2 62a_100000723409_100000210755 [0,1,0,0,0,0|3,0,0]=4 1749 B17R2.3956 Cc1ccccc1SCSc2ccccc2 62a_100000210755_100011218342 [0,1,0,0,0,0|3,0,0]=4 1750 B17R2.3956 Cc1ccccc1SCSc2ccccc2 62a_100011218342_100000210755 [0,1,0,0,0,0|3,0,0]=4 1751 B17R2.3956 Cc1cccnc1C=CCc2ccccc2 271570a_200016263579_100000751373 [0,1,0,0,0,0|2,0,1]=4 1752 B17R2.3956 Cc1cccnc1CNCc2ccccc2 207a_100015324214_100000698913 [0,1,0,0,0,0|2,0,0]=3 1753 B17R2.3956 Cc1cccnc1CNCc2ccccc2 2230a_100015324214_100000696600 [0,1,0,0,0,0|2,0,0]=3 1754 B17R2.3956 Cc1cccnc1CNCc2ccccc2 270004a_100015324214_100000698913 [0,1,0,0,0,0|2,0,0]=3 1755 B17R2.3956 Cc1cccnc1CNCc2ccccc2 34a_100011223789_100015291786 [0,1,0,0,0,0|2,0,0]=3 1756 B17R2.3956 Cc1cccnc1CNCc2ccccc2 34a_100015324214_100000696600 [0,1,0,0,0,0|2,0,0]=3 1757 B17R2.3956 Cc1cccnc1CNCc2ccccn2 270004a_100000210449_100000698913 [0,1,0,0,0,0|3,0,0]=4 1758 B17R2.3956 Cc1cccnc1CNCc2ccccn2 34a_100011223789_100000721315 [0,1,0,0,0,0|3,0,0]=4 1759 B17R2.3956 Cc1cccnc1CNCc2cccnc2 207a_100000210453_100000698913 [0,1,0,0,0,0|3,0,0]=4 1760 B17R2.3956 Cc1cccnc1CNCc2cccnc2 270004a_100000210453_100000698913 [0,1,0,0,0,0|3,0,0]=4 1761 B17R2.3956 Cc1cccnc1CNCc2cccnc2 34a_100011223789_100000733263 [0,1,0,0,0,0|3,0,0]=4 1762 B17R2.3956 Cc1cccnc1COCc2ccccc2 34a_100000210790_100000696600 [0,1,0,0,0,0|1,0,0]=2 1763 B17R2.3956 Cc1cccnc1COCc2ccccc2 34a_100000698912_100015291786 [0,1,0,0,0,0|1,0,0]=2 1764 B17R2.3956 Cc1cccnc1COCc2ccccc2 7a_100000210790_100000696600 [0,1,0,0,0,0|1,0,0]=2 1765 B17R2.3956 Cc1cccnc1COCc2ccccn2 34a_100000698912_100000721315 [0,1,0,0,0,0|2,0,0]=3 1766 B17R2.3956 Cc1cccnc1COCc2cccnc2 34a_100000698912_100000733263 [0,1,0,0,0,0|2,0,0]=3 1767 B17R2.3956 Cc1cccnc1COCc2cccnn2 34a_100000698912_100016990269 [0,1,0,0,0,0|3,0,0]=4 1768 B17R2.3956 Cc1cccnc1COCc2cnccn2 34a_100000698912_100016995436 [0,1,0,0,0,0|3,0,0]=4 1769 B17R2.3956 Cc1cccnc1COCc2cncnc2 34a_100000698912_100015196519 [0,1,0,0,0,0|3,0,0]=4 1770 B17R2.3956 Cc1cccnc1COCc2ncccn2 34a_100000698912_100000703007 [0,1,0,0,0,0|3,0,0]=4 1771 B17R2.3956 Cc1cccnc1CSCc2ccccc2 62a_100000211182_100000696600 [0,1,0,0,0,0|1,1,0]=3 1772 B17R2.3956 Cc1cccnc1CSCc2ccccc2 62a_100000696600_100015291786 [0,1,0,0,0,0|1,1,0]=3 1773 B17R2.3956 Cc1cccnc1CSCc2ccccn2 62a_100000696600_100000721315 [0,1,0,0,0,0|2,1,0]=4 1774 B17R2.3956 Cc1cccnc1CSCc2ccccn2 62a_100000721315_100000696600 [0,1,0,0,0,0|2,1,0]=4 1775 B17R2.3956 Cc1cccnc1CSCc2cccnc2 62a_100000696600_100000741622 [0,1,0,0,0,0|2,1,0]=4 1776 B17R2.3956 Cc1cccnc1CSCc2cccnc2 62a_100000741622_100000696600 [0,1,0,0,0,0|2,1,0]=4 1777 B17R2.3956 Cc1cccnc1CSCc2ccncc2 62a_100000696600_100015193705 [0,1,0,0,0,0|2,1,0]=4 1778 B17R2.3956 Cc1cccnc1CSCc2ccncc2 62a_100015193705_100000696600 [0,1,0,0,0,0|2,1,0]=4 1779 B17R2.3956 Cc1cccnc1SCCc2ccccc2 62a_100000751373_100011218657 [0,1,0,0,0,0|3,0,0]=4 1780 B17R2.3956 Cc1cccnc1SCCc2ccccc2 62a_100000765856_100000751373 [0,1,0,0,0,0|3,0,0]=4 1781 B17R2.3956 Cc1ccncc1C=CCc2ccccc2 271570a_200016263579_100000761580 [0,1,0,0,0,0|2,0,1]=4 1782 B17R2.3956 Cc1ccncc1CNCc2ccccc2 207a_100011997553_100015611070 [0,1,0,0,0,0|2,0,0]=3 1783 B17R2.3956 Cc1ccncc1CNCc2ccccc2 207a_100015324214_100000685662 [0,1,0,0,0,0|2,0,0]=3 1784 B17R2.3956 Cc1ccncc1CNCc2ccccc2 2230a_100015324214_100000690890 [0,1,0,0,0,0|2,0,0]=3 1785 B17R2.3956 Cc1ccncc1CNCc2ccccc2 270004a_100011997553_100015611070 [0,1,0,0,0,0|2,0,0]=3 1786 B17R2.3956 Cc1ccncc1CNCc2ccccc2 270004a_100015324214_100000685662 [0,1,0,0,0,0|2,0,0]=3 1787 B17R2.3956 Cc1ccncc1CNCc2ccccc2 34a_100015324214_100000690890 [0,1,0,0,0,0|2,0,0]=3 1788 B17R2.3956 Cc1ccncc1CNCc2ccccn2 207a_100011997553_100000209966 [0,1,0,0,0,0|3,0,0]=4 1789 B17R2.3956 Cc1ccncc1CNCc2ccccn2 270004a_100000210449_100000685662 [0,1,0,0,0,0|3,0,0]=4 1790 B17R2.3956 Cc1ccncc1CNCc2ccccn2 270004a_100011997553_100000209966 [0,1,0,0,0,0|3,0,0]=4 1791 B17R2.3956 Cc1ccncc1CNCc2cccnc2 207a_100000210453_100000685662 [0,1,0,0,0,0|3,0,0]=4 1792 B17R2.3956 Cc1ccncc1CNCc2cccnc2 207a_100011997553_100000209961 [0,1,0,0,0,0|3,0,0]=4 1793 B17R2.3956 Cc1ccncc1CNCc2cccnc2 270004a_100000210453_100000685662 [0,1,0,0,0,0|3,0,0]=4 1794 B17R2.3956 Cc1ccncc1CNCc2cccnc2 270004a_100011997553_100000209961 [0,1,0,0,0,0|3,0,0]=4 1795 B17R2.3956 Cc1ccncc1CNCc2ccncc2 207a_100011997553_100000186114 [0,1,0,0,0,0|3,0,0]=4 1796 B17R2.3956 Cc1ccncc1COCc2ccccc2 34a_100000210790_100000690890 [0,1,0,0,0,0|1,0,0]=2 1797 B17R2.3956 Cc1ccncc1COCc2ccccc2 34a_100011996381_100015291786 [0,1,0,0,0,0|1,0,0]=2 1798 B17R2.3956 Cc1ccncc1COCc2ccccc2 7a_100000210790_100000690890 [0,1,0,0,0,0|1,0,0]=2 1799 B17R2.3956 Cc1ccncc1COCc2ccccn2 34a_100011996381_100000721315 [0,1,0,0,0,0|2,0,0]=3 1800 B17R2.3956 Cc1ccncc1COCc2cccnc2 34a_100011996381_100000733263 [0,1,0,0,0,0|2,0,0]=3 1801 B17R2.3956 Cc1ccncc1COCc2cccnn2 34a_100011996381_100016990269 [0,1,0,0,0,0|3,0,0]=4 1802 B17R2.3956 Cc1ccncc1COCc2cnccn2 34a_100011996381_100016995436 [0,1,0,0,0,0|3,0,0]=4 1803 B17R2.3956 Cc1ccncc1COCc2cncnc2 34a_100011996381_100015196519 [0,1,0,0,0,0|3,0,0]=4 1804 B17R2.3956 Cc1ccncc1COCc2ncccn2 34a_100011996381_100000703007 [0,1,0,0,0,0|3,0,0]=4 1805 B17R2.3956 Cc1ccncc1CSCc2ccccc2 62a_100000211182_100000690890 [0,1,0,0,0,0|1,1,0]=3 1806 B17R2.3956 Cc1ccncc1CSCc2ccccc2 62a_100000690890_100015291786 [0,1,0,0,0,0|1,1,0]=3 1807 B17R2.3956 Cc1ccncc1CSCc2ccccn2 62a_100000690890_100000721315 [0,1,0,0,0,0|2,1,0]=4 1808 B17R2.3956 Cc1ccncc1CSCc2ccccn2 62a_100000721315_100000690890 [0,1,0,0,0,0|2,1,0]=4 1809 B17R2.3956 Cc1ccncc1CSCc2cccnc2 62a_100000690890_100000741622 [0,1,0,0,0,0|2,1,0]=4 1810 B17R2.3956 Cc1ccncc1CSCc2cccnc2 62a_100000741622_100000690890 [0,1,0,0,0,0|2,1,0]=4 1811 B17R2.3956 Cc1ccncc1CSCc2ccncc2 62a_100000690890_100015193705 [0,1,0,0,0,0|2,1,0]=4 1812 B17R2.3956 Cc1ccncc1CSCc2ccncc2 62a_100015193705_100000690890 [0,1,0,0,0,0|2,1,0]=4 1813 B17R2.3956 Cc1ccncc1OCCc2ccccc2 34a_100011997053_100000765856 [0,1,0,0,0,0|3,0,0]=4 1814 B17R2.3956 Cc1ccncc1OCCc2ccccc2 7a_100011997053_100000765856 [0,1,0,0,0,0|3,0,0]=4 1815 B17R2.3956 Cc1ccncc1SCCc2ccccc2 62a_100000761580_100011218657 [0,1,0,0,0,0|3,0,0]=4 1816 B17R2.3956 Cc1ccncc1SCCc2ccccc2 62a_100000765856_100000761580 [0,1,0,0,0,0|3,0,0]=4 1817 B17R2.3956 Cc1cnccc1C=CCc2ccccc2 271570a_200016263579_100015191297 [0,1,0,0,0,0|2,0,1]=4 1818 B17R2.3956 Cc1cnccc1CNCc2ccccc2 207a_100000708811_100015611070 [0,1,0,0,0,0|2,0,0]=3 1819 B17R2.3956 Cc1cnccc1CNCc2ccccc2 2230a_100015324214_100020672808 [0,1,0,0,0,0|2,0,0]=3 1820 B17R2.3956 Cc1cnccc1CNCc2ccccc2 270004a_100000708811_100015611070 [0,1,0,0,0,0|2,0,0]=3 1821 B17R2.3956 Cc1cnccc1CNCc2ccccc2 34a_100015324214_100020672809 [0,1,0,0,0,0|2,0,0]=3 1822 B17R2.3956 Cc1cnccc1CNCc2ccccn2 207a_100000708811_100000209966 [0,1,0,0,0,0|3,0,0]=4 1823 B17R2.3956 Cc1cnccc1CNCc2ccccn2 270004a_100000708811_100000209966 [0,1,0,0,0,0|3,0,0]=4 1824 B17R2.3956 Cc1cnccc1CNCc2cccnc2 207a_100000708811_100000209961 [0,1,0,0,0,0|3,0,0]=4 1825 B17R2.3956 Cc1cnccc1CNCc2cccnc2 270004a_100000708811_100000209961 [0,1,0,0,0,0|3,0,0]=4 1826 B17R2.3956 Cc1cnccc1CNCc2ccncc2 207a_100000708811_100000186114 [0,1,0,0,0,0|3,0,0]=4 1827 B17R2.3956 Cc1cnccc1COCc2ccccc2 34a_100000210790_100020672809 [0,1,0,0,0,0|1,0,0]=2 1828 B17R2.3956 Cc1cnccc1COCc2ccccc2 34a_100011997032_100015291786 [0,1,0,0,0,0|1,0,0]=2 1829 B17R2.3956 Cc1cnccc1COCc2ccccc2 7a_100000210790_100020672808 [0,1,0,0,0,0|1,0,0]=2 1830 B17R2.3956 Cc1cnccc1COCc2ccccn2 34a_100011997032_100000721315 [0,1,0,0,0,0|2,0,0]=3 1831 B17R2.3956 Cc1cnccc1COCc2cccnc2 34a_100011997032_100000733263 [0,1,0,0,0,0|2,0,0]=3 1832 B17R2.3956 Cc1cnccc1COCc2cccnn2 34a_100011997032_100016990269 [0,1,0,0,0,0|3,0,0]=4 1833 B17R2.3956 Cc1cnccc1COCc2cnccn2 34a_100011997032_100016995436 [0,1,0,0,0,0|3,0,0]=4 1834 B17R2.3956 Cc1cnccc1COCc2cncnc2 34a_100011997032_100015196519 [0,1,0,0,0,0|3,0,0]=4 1835 B17R2.3956 Cc1cnccc1COCc2ncccn2 34a_100011997032_100000703007 [0,1,0,0,0,0|3,0,0]=4 1836 B17R2.3956 Cc1cnccc1CSCc2ccccc2 62a_100000211182_100020672808 [0,1,0,0,0,0|1,1,0]=3 1837 B17R2.3956 Cc1cnccc1CSCc2ccccc2 62a_100020672808_100015291786 [0,1,0,0,0,0|1,1,0]=3 1838 B17R2.3956 Cc1cnccc1CSCc2ccccn2 62a_100000721315_100020672808 [0,1,0,0,0,0|2,1,0]=4 1839 B17R2.3956 Cc1cnccc1CSCc2ccccn2 62a_100020672808_100000721315 [0,1,0,0,0,0|2,1,0]=4 1840 B17R2.3956 Cc1cnccc1CSCc2cccnc2 62a_100000741622_100020672808 [0,1,0,0,0,0|2,1,0]=4 1841 B17R2.3956 Cc1cnccc1CSCc2cccnc2 62a_100020672808_100000741622 [0,1,0,0,0,0|2,1,0]=4 1842 B17R2.3956 Cc1cnccc1CSCc2ccncc2 62a_100015193705_100020672808 [0,1,0,0,0,0|2,1,0]=4 1843 B17R2.3956 Cc1cnccc1CSCc2ccncc2 62a_100020672808_100015193705 [0,1,0,0,0,0|2,1,0]=4 1844 B17R2.3956 Cc1cnccc1NCCc2ccccc2 27a_100000106460_100000765111 [0,1,0,0,0,0|3,0,0]=4 1845 B17R2.3956 Cc1cnccc1OCCc2ccccc2 34a_100000694293_100000765856 [0,1,0,0,0,0|3,0,0]=4 1846 B17R2.3956 Cc1cnccc1SCCc2ccccc2 62a_100000765111_100011218657 [0,1,0,0,0,0|3,0,0]=4 1847 B17R2.3956 Cc1cnccc1SCCc2ccccc2 62a_100000765856_100000765111 [0,1,0,0,0,0|3,0,0]=4 1848 B17R2.3956 Cc1ncccc1C=CCc2ccccc2 271570a_200016263579_100000751574 [0,1,0,0,0,0|2,0,1]=4 1849 B17R2.3956 Cc1ncccc1CNCc2ccccc2 207a_100015324214_100000751968 [0,1,0,0,0,0|2,0,0]=3 1850 B17R2.3956 Cc1ncccc1CNCc2ccccc2 2230a_100015324214_100000732876 [0,1,0,0,0,0|2,0,0]=3 1851 B17R2.3956 Cc1ncccc1CNCc2ccccc2 270004a_100015324214_100000751968 [0,1,0,0,0,0|2,0,0]=3 1852 B17R2.3956 Cc1ncccc1CNCc2ccccc2 34a_100015324214_100000732876 [0,1,0,0,0,0|2,0,0]=3 1853 B17R2.3956 Cc1ncccc1CNCc2ccccn2 270004a_100000210449_100000751968 [0,1,0,0,0,0|3,0,0]=4 1854 B17R2.3956 Cc1ncccc1CNCc2cccnc2 207a_100000210453_100000751968 [0,1,0,0,0,0|3,0,0]=4 1855 B17R2.3956 Cc1ncccc1CNCc2cccnc2 270004a_100000210453_100000751968 [0,1,0,0,0,0|3,0,0]=4 1856 B17R2.3956 Cc1ncccc1COCc2ccccc2 34a_100000210790_100000732876 [0,1,0,0,0,0|1,0,0]=2 1857 B17R2.3956 Cc1ncccc1COCc2ccccc2 34a_100000729262_100015291786 [0,1,0,0,0,0|1,0,0]=2 1858 B17R2.3956 Cc1ncccc1COCc2ccccc2 7a_100000210790_100000732876 [0,1,0,0,0,0|1,0,0]=2 1859 B17R2.3956 Cc1ncccc1COCc2ccccc2 7a_100000729262_100000211182 [0,1,0,0,0,0|1,0,0]=2 1860 B17R2.3956 Cc1ncccc1COCc2ccccn2 34a_100000729262_100000721315 [0,1,0,0,0,0|2,0,0]=3 1861 B17R2.3956 Cc1ncccc1COCc2ccccn2 7a_100000729262_100000721315 [0,1,0,0,0,0|2,0,0]=3 1862 B17R2.3956 Cc1ncccc1COCc2cccnc2 34a_100000729262_100000733263 [0,1,0,0,0,0|2,0,0]=3 1863 B17R2.3956 Cc1ncccc1COCc2cccnc2 7a_100000729262_100000741622 [0,1,0,0,0,0|2,0,0]=3 1864 B17R2.3956 Cc1ncccc1COCc2cccnn2 34a_100000729262_100016990269 [0,1,0,0,0,0|3,0,0]=4 1865 B17R2.3956 Cc1ncccc1COCc2cccnn2 7a_100000729262_100016990269 [0,1,0,0,0,0|3,0,0]=4 1866 B17R2.3956 Cc1ncccc1COCc2ccncc2 7a_100000729262_100015193705 [0,1,0,0,0,0|2,0,0]=3 1867 B17R2.3956 Cc1ncccc1COCc2cnccn2 34a_100000729262_100016995436 [0,1,0,0,0,0|3,0,0]=4 1868 B17R2.3956 Cc1ncccc1COCc2cnccn2 7a_100000729262_100016995436 [0,1,0,0,0,0|3,0,0]=4 1869 B17R2.3956 Cc1ncccc1COCc2cncnc2 34a_100000729262_100015196519 [0,1,0,0,0,0|3,0,0]=4 1870 B17R2.3956 Cc1ncccc1COCc2cncnc2 7a_100000729262_100015196519 [0,1,0,0,0,0|3,0,0]=4 1871 B17R2.3956 Cc1ncccc1COCc2ncccn2 34a_100000729262_100000703007 [0,1,0,0,0,0|3,0,0]=4 1872 B17R2.3956 Cc1ncccc1COCc2ncccn2 7a_100000729262_100000703007 [0,1,0,0,0,0|3,0,0]=4 1873 B17R2.3956 Cc1ncccc1CSCc2ccccc2 62a_100000211182_100000732876 [0,1,0,0,0,0|1,1,0]=3 1874 B17R2.3956 Cc1ncccc1CSCc2ccccc2 62a_100000732876_100015291786 [0,1,0,0,0,0|1,1,0]=3 1875 B17R2.3956 Cc1ncccc1CSCc2ccccn2 62a_100000721315_100000732876 [0,1,0,0,0,0|2,1,0]=4 1876 B17R2.3956 Cc1ncccc1CSCc2ccccn2 62a_100000732876_100000721315 [0,1,0,0,0,0|2,1,0]=4 1877 B17R2.3956 Cc1ncccc1CSCc2cccnc2 62a_100000732876_100000741622 [0,1,0,0,0,0|2,1,0]=4 1878 B17R2.3956 Cc1ncccc1CSCc2cccnc2 62a_100000741622_100000732876 [0,1,0,0,0,0|2,1,0]=4 1879 B17R2.3956 Cc1ncccc1CSCc2ccncc2 62a_100000732876_100015193705 [0,1,0,0,0,0|2,1,0]=4 1880 B17R2.3956 Cc1ncccc1CSCc2ccncc2 62a_100015193705_100000732876 [0,1,0,0,0,0|2,1,0]=4 1881 B17R2.3956 Cc1ncccc1OCCc2ccccc2 34a_100000745507_100000765856 [0,1,0,0,0,0|3,0,0]=4 1882 B17R2.3956 Cc1ncccc1OCCc2ccccc2 7a_100000745507_100000765856 [0,1,0,0,0,0|3,0,0]=4 1883 B17R2.3956 Cc1ncccc1SCCc2ccccc2 62a_100000751574_100011218657 [0,1,0,0,0,0|3,0,0]=4 1884 B17R2.3956 Cc1ncccc1SCCc2ccccc2 62a_100000765856_100000751574 [0,1,0,0,0,0|3,0,0]=4 1885 B17R2.3956 Cc1nccnc1CNCc2ccccc2 2230a_100020641712_100015291786 [0,1,0,0,0,0|3,0,0]=4 1886 B17R2.3956 Cc1nccnc1CNCc2ccccc2 270004a_100015324214_100000050726 [0,1,0,0,0,0|3,0,0]=4 1887 B17R2.3956 Cc1nccnc1CNCc2ccccc2 270004a_100020641712_100015611070 [0,1,0,0,0,0|3,0,0]=4 1888 B17R2.3956 Cc1nccnc1CNCc2ccccc2 34a_100020641712_100015291786 [0,1,0,0,0,0|3,0,0]=4 1889 B17R2.3956 Clc1ccccc1C=CCc2ccccc2 271570a_200016263579_100000764095 [0,1,0,0,0,0|1,0,1]=3 1890 B17R2.3956 Clc1ccccc1C=NNc2ccccc2 4a_100015195140_100000210073 [0,1,0,0,0,0|2,0,1]=4 1891 B17R2.3956 Clc1ccccc1CCNc2ccccc2 34a_100000106764_100011713703 [0,1,0,0,0,0|2,0,0]=3 1892 B17R2.3956 Clc1ccccc1CCOc2ccccc2 34a_100000210340_100011713703 [0,1,0,0,0,0|2,0,0]=3 1893 B17R2.3956 Clc1ccccc1CCOc2ccccc2 7a_100000210340_100011713703 [0,1,0,0,0,0|2,0,0]=3 1894 B17R2.3956 Clc1ccccc1CCOc2cccnc2 34a_100000210849_100011713703 [0,1,0,0,0,0|3,0,0]=4 1895 B17R2.3956 Clc1ccccc1CCOc2cccnc2 7a_100000210849_100011713703 [0,1,0,0,0,0|3,0,0]=4 1896 B17R2.3956 Clc1ccccc1CCOc2ccncc2 34a_100000212176_100011713703 [0,1,0,0,0,0|3,0,0]=4 1897 B17R2.3956 Clc1ccccc1CCSc2ccccc2 62a_100000719477_100011713703 [0,1,0,0,0,0|2,0,0]=3 1898 B17R2.3956 Clc1ccccc1CCSc2ccccc2 62a_100011713703_100000041952 [0,1,0,0,0,0|2,0,0]=3 1899 B17R2.3956 Clc1ccccc1CCSc2ccccn2 62a_100011216584_100011713703 [0,1,0,0,0,0|3,0,0]=4 1900 B17R2.3956 Clc1ccccc1CCSc2ccccn2 62a_100011713703_100011216584 [0,1,0,0,0,0|3,0,0]=4 1901 B17R2.3956 Clc1ccccc1CCSc2cccnc2 62a_100000210063_100011713703 [0,1,0,0,0,0|3,0,0]=4 1902 B17R2.3956 Clc1ccccc1CCSc2cccnc2 62a_100011713703_100000210063 [0,1,0,0,0,0|3,0,0]=4 1903 B17R2.3956 Clc1ccccc1CCSc2ccncc2 62a_100000728582_100011713703 [0,1,0,0,0,0|3,0,0]=4 1904 B17R2.3956 Clc1ccccc1CCSc2ccncc2 62a_100011713703_100000728582 [0,1,0,0,0,0|3,0,0]=4 1905 B17R2.3956 Clc1ccccc1CNCc2ccccc2 207a_100000174879_100015611070 [0,1,0,0,0,0|1,0,0]=2 1906 B17R2.3956 Clc1ccccc1CNCc2ccccc2 207a_100015324214_100000210073 [0,1,0,0,0,0|1,0,0]=2 1907 B17R2.3956 Clc1ccccc1CNCc2ccccc2 2230a_100000174879_100015291786 [0,1,0,0,0,0|1,0,0]=2 1908 B17R2.3956 Clc1ccccc1CNCc2ccccc2 2230a_100015324214_100000187162 [0,1,0,0,0,0|1,0,0]=2 1909 B17R2.3956 Clc1ccccc1CNCc2ccccc2 270004a_100000174879_100015611070 [0,1,0,0,0,0|1,0,0]=2 1910 B17R2.3956 Clc1ccccc1CNCc2ccccc2 270004a_100015324214_100000210073 [0,1,0,0,0,0|1,0,0]=2 1911 B17R2.3956 Clc1ccccc1CNCc2ccccc2 34a_100000174879_100015291786 [0,1,0,0,0,0|1,0,0]=2 1912 B17R2.3956 Clc1ccccc1CNCc2ccccc2 34a_100015324214_100000187162 [0,1,0,0,0,0|1,0,0]=2 1913 B17R2.3956 Clc1ccccc1CNCc2ccccn2 207a_100000174879_100000209966 [0,1,0,0,0,0|2,0,0]=3 1914 B17R2.3956 Clc1ccccc1CNCc2ccccn2 2230a_100000174879_100000721315 [0,1,0,0,0,0|2,0,0]=3 1915 B17R2.3956 Clc1ccccc1CNCc2ccccn2 270004a_100000174879_100000209966 [0,1,0,0,0,0|2,0,0]=3 1916 B17R2.3956 Clc1ccccc1CNCc2ccccn2 270004a_100000210449_100000210073 [0,1,0,0,0,0|2,0,0]=3 1917 B17R2.3956 Clc1ccccc1CNCc2ccccn2 34a_100000174879_100000721315 [0,1,0,0,0,0|2,0,0]=3 1918 B17R2.3956 Clc1ccccc1CNCc2cccnc2 207a_100000174879_100000209961 [0,1,0,0,0,0|2,0,0]=3 1919 B17R2.3956 Clc1ccccc1CNCc2cccnc2 207a_100000210453_100000210073 [0,1,0,0,0,0|2,0,0]=3 1920 B17R2.3956 Clc1ccccc1CNCc2cccnc2 2230a_100000174879_100000741622 [0,1,0,0,0,0|2,0,0]=3 1921 B17R2.3956 Clc1ccccc1CNCc2cccnc2 270004a_100000174879_100000209961 [0,1,0,0,0,0|2,0,0]=3 1922 B17R2.3956 Clc1ccccc1CNCc2cccnc2 270004a_100000210453_100000210073 [0,1,0,0,0,0|2,0,0]=3 1923 B17R2.3956 Clc1ccccc1CNCc2cccnc2 34a_100000174879_100000733263 [0,1,0,0,0,0|2,0,0]=3 1924 B17R2.3956 Clc1ccccc1CNCc2cccnn2 2230a_100000174879_100016990269 [0,1,0,0,0,0|3,0,0]=4 1925 B17R2.3956 Clc1ccccc1CNCc2cccnn2 2230a_100159270163_100000187162 [0,1,0,0,0,0|3,0,0]=4 1926 B17R2.3956 Clc1ccccc1CNCc2cccnn2 34a_100000174879_100016990269 [0,1,0,0,0,0|3,0,0]=4 1927 B17R2.3956 Clc1ccccc1CNCc2ccncc2 207a_100000174879_100000186114 [0,1,0,0,0,0|2,0,0]=3 1928 B17R2.3956 Clc1ccccc1CNCc2ccncc2 2230a_100000174879_100015193705 [0,1,0,0,0,0|2,0,0]=3 1929 B17R2.3956 Clc1ccccc1CNCc2ccnnc2 270004a_100000174879_100011934578 [0,1,0,0,0,0|3,0,0]=4 1930 B17R2.3956 Clc1ccccc1CNCc2cnccn2 2230a_100000174879_100016995436 [0,1,0,0,0,0|3,0,0]=4 1931 B17R2.3956 Clc1ccccc1CNCc2cnccn2 270004a_100000174879_100000749867 [0,1,0,0,0,0|3,0,0]=4 1932 B17R2.3956 Clc1ccccc1CNCc2cnccn2 34a_100000174879_100016995436 [0,1,0,0,0,0|3,0,0]=4 1933 B17R2.3956 Clc1ccccc1CNCc2cncnc2 207a_100011243677_100000210073 [0,1,0,0,0,0|3,0,0]=4 1934 B17R2.3956 Clc1ccccc1CNCc2cncnc2 2230a_100000174879_100015196519 [0,1,0,0,0,0|3,0,0]=4 1935 B17R2.3956 Clc1ccccc1CNCc2cncnc2 2230a_100011243677_100000187162 [0,1,0,0,0,0|3,0,0]=4 1936 B17R2.3956 Clc1ccccc1CNCc2cncnc2 270004a_100000174879_100000749868 [0,1,0,0,0,0|3,0,0]=4 1937 B17R2.3956 Clc1ccccc1CNCc2cncnc2 270004a_100011243677_100000210073 [0,1,0,0,0,0|3,0,0]=4 1938 B17R2.3956 Clc1ccccc1CNCc2cncnc2 34a_100000174879_100015196519 [0,1,0,0,0,0|3,0,0]=4 1939 B17R2.3956 Clc1ccccc1CNCc2ncccn2 2230a_100000174879_100000703007 [0,1,0,0,0,0|3,0,0]=4 1940 B17R2.3956 Clc1ccccc1CNCc2ncccn2 270004a_100000174879_100011532527 [0,1,0,0,0,0|3,0,0]=4 1941 B17R2.3956 Clc1ccccc1CNCc2ncccn2 34a_100000174879_100000703007 [0,1,0,0,0,0|3,0,0]=4 1942 B17R2.3956 Clc1ccccc1COCc2ccccc2 34a_100000210790_100000187162 [0,1,0,0,0,0|0,0,0]=1 1943 B17R2.3956 Clc1ccccc1COCc2ccccc2 34a_100000210847_100015291786 [0,1,0,0,0,0|0,0,0]=1 1944 B17R2.3956 Clc1ccccc1COCc2ccccc2 7a_100000210790_100000187162 [0,1,0,0,0,0|0,0,0]=1 1945 B17R2.3956 Clc1ccccc1COCc2ccccc2 7a_100000210847_100000211182 [0,1,0,0,0,0|0,0,0]=1 1946 B17R2.3956 Clc1ccccc1COCc2ccccn2 34a_100000210847_100000721315 [0,1,0,0,0,0|1,0,0]=2 1947 B17R2.3956 Clc1ccccc1COCc2ccccn2 7a_100000210847_100000721315 [0,1,0,0,0,0|1,0,0]=2 1948 B17R2.3956 Clc1ccccc1COCc2cccnc2 34a_100000210847_100000733263 [0,1,0,0,0,0|1,0,0]=2 1949 B17R2.3956 Clc1ccccc1COCc2cccnc2 7a_100000210847_100000741622 [0,1,0,0,0,0|1,0,0]=2 1950 B17R2.3956 Clc1ccccc1COCc2cccnn2 34a_100000210847_100016990269 [0,1,0,0,0,0|2,0,0]=3 1951 B17R2.3956 Clc1ccccc1COCc2cccnn2 7a_100000210847_100016990269 [0,1,0,0,0,0|2,0,0]=3 1952 B17R2.3956 Clc1ccccc1COCc2ccncc2 7a_100000210847_100015193705 [0,1,0,0,0,0|1,0,0]=2 1953 B17R2.3956 Clc1ccccc1COCc2cnccn2 34a_100000210847_100016995436 [0,1,0,0,0,0|2,0,0]=3 1954 B17R2.3956 Clc1ccccc1COCc2cnccn2 7a_100000210847_100016995436 [0,1,0,0,0,0|2,0,0]=3 1955 B17R2.3956 Clc1ccccc1COCc2cncnc2 34a_100000210847_100015196519 [0,1,0,0,0,0|2,0,0]=3 1956 B17R2.3956 Clc1ccccc1COCc2cncnc2 7a_100000210847_100015196519 [0,1,0,0,0,0|2,0,0]=3 1957 B17R2.3956 Clc1ccccc1COCc2ncccn2 34a_100000210847_100000703007 [0,1,0,0,0,0|2,0,0]=3 1958 B17R2.3956 Clc1ccccc1COCc2ncccn2 7a_100000210847_100000703007 [0,1,0,0,0,0|2,0,0]=3 1959 B17R2.3956 Clc1ccccc1CSCc2ccccc2 62a_100000187162_100015291786 [0,1,0,0,0,0|0,1,0]=2 1960 B17R2.3956 Clc1ccccc1CSCc2ccccc2 62a_100000211182_100000187162 [0,1,0,0,0,0|0,1,0]=2 1961 B17R2.3956 Clc1ccccc1CSCc2ccccn2 62a_100000187162_100000721315 [0,1,0,0,0,0|1,1,0]=3 1962 B17R2.3956 Clc1ccccc1CSCc2ccccn2 62a_100000721315_100000187162 [0,1,0,0,0,0|1,1,0]=3 1963 B17R2.3956 Clc1ccccc1CSCc2cccnc2 62a_100000187162_100000741622 [0,1,0,0,0,0|1,1,0]=3 1964 B17R2.3956 Clc1ccccc1CSCc2cccnc2 62a_100000741622_100000187162 [0,1,0,0,0,0|1,1,0]=3 1965 B17R2.3956 Clc1ccccc1CSCc2cccnn2 62a_100000187162_100016990269 [0,1,0,0,0,0|2,1,0]=4 1966 B17R2.3956 Clc1ccccc1CSCc2cccnn2 62a_100016990269_100000187162 [0,1,0,0,0,0|2,1,0]=4 1967 B17R2.3956 Clc1ccccc1CSCc2ccncc2 62a_100000187162_100015193705 [0,1,0,0,0,0|1,1,0]=3 1968 B17R2.3956 Clc1ccccc1CSCc2ccncc2 62a_100015193705_100000187162 [0,1,0,0,0,0|1,1,0]=3 1969 B17R2.3956 Clc1ccccc1CSCc2cnccn2 62a_100000187162_100016995436 [0,1,0,0,0,0|2,1,0]=4 1970 B17R2.3956 Clc1ccccc1CSCc2cnccn2 62a_100016995436_100000187162 [0,1,0,0,0,0|2,1,0]=4 1971 B17R2.3956 Clc1ccccc1CSCc2cncnc2 62a_100000187162_100015196519 [0,1,0,0,0,0|2,1,0]=4 1972 B17R2.3956 Clc1ccccc1CSCc2cncnc2 62a_100015196519_100000187162 [0,1,0,0,0,0|2,1,0]=4 1973 B17R2.3956 Clc1ccccc1CSCc2ncccn2 62a_100000187162_100000703007 [0,1,0,0,0,0|2,1,0]=4 1974 B17R2.3956 Clc1ccccc1CSCc2ncccn2 62a_100000703007_100000187162 [0,1,0,0,0,0|2,1,0]=4 1975 B17R2.3956 Clc1ccccc1NCCc2ccccc2 34a_100000185783_100000765856 [0,1,0,0,0,0|2,0,0]=3 1976 B17R2.3956 Clc1ccccc1NN=Cc2ccccc2 4a_100000683529_100015611070 [0,1,0,0,0,0|2,0,1]=4 1977 B17R2.3956 Clc1ccccc1OCCc2ccccc2 34a_100000210172_100000765856 [0,1,0,0,0,0|2,0,0]=3 1978 B17R2.3956 Clc1ccccc1OCCc2ccccc2 7a_100000210172_100000765856 [0,1,0,0,0,0|2,0,0]=3 1979 B17R2.3956 Clc1ccccc1OCCc2ccccn2 7a_100000210172_100015183660 [0,1,0,0,0,0|3,0,0]=4 1980 B17R2.3956 Clc1ccccc1OCCc2cccnc2 7a_100000210172_200011713674 [0,1,0,0,0,0|3,0,0]=4 1981 B17R2.3956 Clc1ccccc1OCCc2ccncc2 7a_100000210172_100000723409 [0,1,0,0,0,0|3,0,0]=4 1982 B17R2.3956 Clc1ccccc1SCCc2ccccc2 62a_100000764095_100011218657 [0,1,0,0,0,0|2,0,0]=3 1983 B17R2.3956 Clc1ccccc1SCCc2ccccc2 62a_100000765856_100000764095 [0,1,0,0,0,0|2,0,0]=3 1984 B17R2.3956 Clc1ccccc1SCCc2ccccn2 62a_100000764095_100015183660 [0,1,0,0,0,0|3,0,0]=4 1985 B17R2.3956 Clc1ccccc1SCCc2ccccn2 62a_100015183660_100000764095 [0,1,0,0,0,0|3,0,0]=4 1986 B17R2.3956 Clc1ccccc1SCCc2cccnc2 62a_100000764095_200011713674 [0,1,0,0,0,0|3,0,0]=4 1987 B17R2.3956 Clc1ccccc1SCCc2cccnc2 62a_200011713674_100000764095 [0,1,0,0,0,0|3,0,0]=4 1988 B17R2.3956 Clc1ccccc1SCCc2ccncc2 62a_100000723409_100000764095 [0,1,0,0,0,0|3,0,0]=4 1989 B17R2.3956 Clc1ccccc1SCCc2ccncc2 62a_100000764095_100000723409 [0,1,0,0,0,0|3,0,0]=4 1990 B17R2.3956 Clc1ccccc1SCSc2ccccc2 62a_100000764095_100011218342 [0,1,0,0,0,0|3,0,0]=4 1991 B17R2.3956 Clc1ccccc1SCSc2ccccc2 62a_100011218342_100000764095 [0,1,0,0,0,0|3,0,0]=4 1992 B17R2.3956 Clc1cccnc1C=CCc2ccccc2 271570a_200016263579_100011356963 [0,1,0,0,0,0|2,0,1]=4 1993 B17R2.3956 Clc1cccnc1CNCc2ccccc2 207a_100015324214_100012001307 [0,1,0,0,0,0|2,0,0]=3 1994 B17R2.3956 Clc1cccnc1CNCc2ccccc2 2230a_100015189233_100015291786 [0,1,0,0,0,0|2,0,0]=3 1995 B17R2.3956 Clc1cccnc1CNCc2ccccc2 2230a_100015324214_100000099807 [0,1,0,0,0,0|2,0,0]=3 1996 B17R2.3956 Clc1cccnc1CNCc2ccccc2 270004a_100015189233_100015611070 [0,1,0,0,0,0|2,0,0]=3 1997 B17R2.3956 Clc1cccnc1CNCc2ccccc2 270004a_100015324214_100012001307 [0,1,0,0,0,0|2,0,0]=3 1998 B17R2.3956 Clc1cccnc1CNCc2ccccn2 2230a_100015189233_100000721315 [0,1,0,0,0,0|3,0,0]=4 1999 B17R2.3956 Clc1cccnc1CNCc2ccccn2 270004a_100000210449_100012001307 [0,1,0,0,0,0|3,0,0]=4 2000 B17R2.3956 Clc1cccnc1CNCc2ccccn2 270004a_100015189233_100000209966 [0,1,0,0,0,0|3,0,0]=4 2001 B17R2.3956 Clc1cccnc1CNCc2cccnc2 207a_100000210453_100012001307 [0,1,0,0,0,0|3,0,0]=4 2002 B17R2.3956 Clc1cccnc1CNCc2cccnc2 2230a_100015189233_100000741622 [0,1,0,0,0,0|3,0,0]=4 2003 B17R2.3956 Clc1cccnc1CNCc2cccnc2 270004a_100000210453_100012001307 [0,1,0,0,0,0|3,0,0]=4 2004 B17R2.3956 Clc1cccnc1CNCc2cccnc2 270004a_100015189233_100000209961 [0,1,0,0,0,0|3,0,0]=4 2005 B17R2.3956 Clc1cccnc1CNCc2ccncc2 2230a_100015189233_100015193705 [0,1,0,0,0,0|3,0,0]=4 2006 B17R2.3956 Clc1cccnc1COCc2ccccc2 34a_100012002383_100015291786 [0,1,0,0,0,0|1,0,0]=2 2007 B17R2.3956 Clc1cccnc1COCc2ccccc2 7a_100000210790_100000099807 [0,1,0,0,0,0|1,0,0]=2 2008 B17R2.3956 Clc1cccnc1COCc2ccccn2 34a_100012002383_100000721315 [0,1,0,0,0,0|2,0,0]=3 2009 B17R2.3956 Clc1cccnc1COCc2cccnc2 34a_100012002383_100000733263 [0,1,0,0,0,0|2,0,0]=3 2010 B17R2.3956 Clc1cccnc1COCc2cccnn2 34a_100012002383_100016990269 [0,1,0,0,0,0|3,0,0]=4 2011 B17R2.3956 Clc1cccnc1COCc2cnccn2 34a_100012002383_100016995436 [0,1,0,0,0,0|3,0,0]=4 2012 B17R2.3956 Clc1cccnc1COCc2cncnc2 34a_100012002383_100015196519 [0,1,0,0,0,0|3,0,0]=4 2013 B17R2.3956 Clc1cccnc1COCc2ncccn2 34a_100012002383_100000703007 [0,1,0,0,0,0|3,0,0]=4 2014 B17R2.3956 Clc1cccnc1CSCc2ccccc2 62a_100000099807_100015291786 [0,1,0,0,0,0|1,1,0]=3 2015 B17R2.3956 Clc1cccnc1CSCc2ccccc2 62a_100000211182_100000099807 [0,1,0,0,0,0|1,1,0]=3 2016 B17R2.3956 Clc1cccnc1CSCc2ccccn2 62a_100000099807_100000721315 [0,1,0,0,0,0|2,1,0]=4 2017 B17R2.3956 Clc1cccnc1CSCc2ccccn2 62a_100000721315_100000099807 [0,1,0,0,0,0|2,1,0]=4 2018 B17R2.3956 Clc1cccnc1CSCc2cccnc2 62a_100000099807_100000741622 [0,1,0,0,0,0|2,1,0]=4 2019 B17R2.3956 Clc1cccnc1CSCc2cccnc2 62a_100000741622_100000099807 [0,1,0,0,0,0|2,1,0]=4 2020 B17R2.3956 Clc1cccnc1CSCc2ccncc2 62a_100000099807_100015193705 [0,1,0,0,0,0|2,1,0]=4 2021 B17R2.3956 Clc1cccnc1CSCc2ccncc2 62a_100015193705_100000099807 [0,1,0,0,0,0|2,1,0]=4 2022 B17R2.3956 Clc1cccnc1OCCc2ccccc2 34a_100011290957_100000765856 [0,1,0,0,0,0|3,0,0]=4 2023 B17R2.3956 Clc1cccnc1SCCc2ccccc2 62a_100000765856_100011356963 [0,1,0,0,0,0|3,0,0]=4 2024 B17R2.3956 Clc1cccnc1SCCc2ccccc2 62a_100011356963_100011218657 [0,1,0,0,0,0|3,0,0]=4 2025 B17R2.3956 Clc1ccncc1C=CCc2ccccc2 271570a_200016263579_100009995489 [0,1,0,0,0,0|2,0,1]=4 2026 B17R2.3956 Clc1ccncc1CNCc2ccccc2 270004a_100015324214_100000050567 [0,1,0,0,0,0|2,0,0]=3 2027 B17R2.3956 Clc1ccncc1CNCc2ccccn2 270004a_100000210449_100000050567 [0,1,0,0,0,0|3,0,0]=4 2028 B17R2.3956 Clc1ccncc1CNCc2cccnc2 270004a_100000210453_100000050567 [0,1,0,0,0,0|3,0,0]=4 2029 B17R2.3956 Clc1ccncc1COCc2ccccc2 34a_100000117392_100015291786 [0,1,0,0,0,0|1,0,0]=2 2030 B17R2.3956 Clc1ccncc1COCc2ccccn2 34a_100000117392_100000721315 [0,1,0,0,0,0|2,0,0]=3 2031 B17R2.3956 Clc1ccncc1COCc2cccnc2 34a_100000117392_100000733263 [0,1,0,0,0,0|2,0,0]=3 2032 B17R2.3956 Clc1ccncc1COCc2cccnn2 34a_100000117392_100016990269 [0,1,0,0,0,0|3,0,0]=4 2033 B17R2.3956 Clc1ccncc1COCc2cnccn2 34a_100000117392_100016995436 [0,1,0,0,0,0|3,0,0]=4 2034 B17R2.3956 Clc1ccncc1COCc2cncnc2 34a_100000117392_100015196519 [0,1,0,0,0,0|3,0,0]=4 2035 B17R2.3956 Clc1ccncc1COCc2ncccn2 34a_100000117392_100000703007 [0,1,0,0,0,0|3,0,0]=4 2036 B17R2.3956 Clc1ccncc1OCCc2ccccc2 34a_100011996695_100000765856 [0,1,0,0,0,0|3,0,0]=4 2037 B17R2.3956 Clc1ccncc1SCCc2ccccc2 62a_100000765856_100009995489 [0,1,0,0,0,0|3,0,0]=4 2038 B17R2.3956 Clc1ccncc1SCCc2ccccc2 62a_100009995489_100011218657 [0,1,0,0,0,0|3,0,0]=4 2039 B17R2.3956 Clc1cnccc1C=CCc2ccccc2 271570a_200016263579_100000708259 [0,1,0,0,0,0|2,0,1]=4 2040 B17R2.3956 Clc1cnccc1CNCc2ccccc2 207a_100015324214_100011934409 [0,1,0,0,0,0|2,0,0]=3 2041 B17R2.3956 Clc1cnccc1CNCc2ccccc2 2230a_100015324214_100000763264 [0,1,0,0,0,0|2,0,0]=3 2042 B17R2.3956 Clc1cnccc1CNCc2ccccc2 270004a_100015324214_100011934409 [0,1,0,0,0,0|2,0,0]=3 2043 B17R2.3956 Clc1cnccc1CNCc2ccccn2 270004a_100000210449_100011934409 [0,1,0,0,0,0|3,0,0]=4 2044 B17R2.3956 Clc1cnccc1CNCc2cccnc2 207a_100000210453_100011934409 [0,1,0,0,0,0|3,0,0]=4 2045 B17R2.3956 Clc1cnccc1CNCc2cccnc2 270004a_100000210453_100011934409 [0,1,0,0,0,0|3,0,0]=4 2046 B17R2.3956 Clc1cnccc1COCc2ccccc2 7a_100000210790_100000763264 [0,1,0,0,0,0|1,0,0]=2 2047 B17R2.3956 Clc1cnccc1CSCc2ccccc2 62a_100000211182_100000763264 [0,1,0,0,0,0|1,1,0]=3 2048 B17R2.3956 Clc1cnccc1CSCc2ccccc2 62a_100000763264_100015291786 [0,1,0,0,0,0|1,1,0]=3 2049 B17R2.3956 Clc1cnccc1CSCc2ccccn2 62a_100000721315_100000763264 [0,1,0,0,0,0|2,1,0]=4 2050 B17R2.3956 Clc1cnccc1CSCc2ccccn2 62a_100000763264_100000721315 [0,1,0,0,0,0|2,1,0]=4 2051 B17R2.3956 Clc1cnccc1CSCc2cccnc2 62a_100000741622_100000763264 [0,1,0,0,0,0|2,1,0]=4 2052 B17R2.3956 Clc1cnccc1CSCc2cccnc2 62a_100000763264_100000741622 [0,1,0,0,0,0|2,1,0]=4 2053 B17R2.3956 Clc1cnccc1CSCc2ccncc2 62a_100000763264_100015193705 [0,1,0,0,0,0|2,1,0]=4 2054 B17R2.3956 Clc1cnccc1CSCc2ccncc2 62a_100015193705_100000763264 [0,1,0,0,0,0|2,1,0]=4 2055 B17R2.3956 Clc1cnccc1OCCc2ccccc2 34a_100011997054_100000765856 [0,1,0,0,0,0|3,0,0]=4 2056 B17R2.3956 Clc1cnccc1SCCc2ccccc2 62a_100000708259_100011218657 [0,1,0,0,0,0|3,0,0]=4 2057 B17R2.3956 Clc1cnccc1SCCc2ccccc2 62a_100000765856_100000708259 [0,1,0,0,0,0|3,0,0]=4 2058 B17R2.3956 Clc1ncccc1C=CCc2ccccc2 271570a_200016263579_100000036424 [0,1,0,0,0,0|2,0,1]=4 2059 B17R2.3956 Clc1ncccc1CNCc2ccccc2 207a_100015189234_100015611070 [0,1,0,0,0,0|2,0,0]=3 2060 B17R2.3956 Clc1ncccc1CNCc2ccccc2 2230a_100015189234_100015291786 [0,1,0,0,0,0|2,0,0]=3 2061 B17R2.3956 Clc1ncccc1CNCc2ccccc2 2230a_100015324214_100000045678 [0,1,0,0,0,0|2,0,0]=3 2062 B17R2.3956 Clc1ncccc1CNCc2ccccc2 34a_100015189234_100015291786 [0,1,0,0,0,0|2,0,0]=3 2063 B17R2.3956 Clc1ncccc1CNCc2ccccc2 34a_100015324214_100000045678 [0,1,0,0,0,0|2,0,0]=3 2064 B17R2.3956 Clc1ncccc1CNCc2ccccn2 207a_100015189234_100000209966 [0,1,0,0,0,0|3,0,0]=4 2065 B17R2.3956 Clc1ncccc1CNCc2ccccn2 2230a_100015189234_100000721315 [0,1,0,0,0,0|3,0,0]=4 2066 B17R2.3956 Clc1ncccc1CNCc2ccccn2 34a_100015189234_100000721315 [0,1,0,0,0,0|3,0,0]=4 2067 B17R2.3956 Clc1ncccc1CNCc2cccnc2 207a_100015189234_100000209961 [0,1,0,0,0,0|3,0,0]=4 2068 B17R2.3956 Clc1ncccc1CNCc2cccnc2 2230a_100015189234_100000741622 [0,1,0,0,0,0|3,0,0]=4 2069 B17R2.3956 Clc1ncccc1CNCc2cccnc2 34a_100015189234_100000733263 [0,1,0,0,0,0|3,0,0]=4 2070 B17R2.3956 Clc1ncccc1CNCc2ccncc2 207a_100015189234_100000186114 [0,1,0,0,0,0|3,0,0]=4 2071 B17R2.3956 Clc1ncccc1CNCc2ccncc2 2230a_100015189234_100015193705 [0,1,0,0,0,0|3,0,0]=4 2072 B17R2.3956 Clc1ncccc1COCc2ccccc2 34a_100000210790_100000045678 [0,1,0,0,0,0|1,0,0]=2 2073 B17R2.3956 Clc1ncccc1COCc2ccccc2 34a_100000748726_100015291786 [0,1,0,0,0,0|1,0,0]=2 2074 B17R2.3956 Clc1ncccc1COCc2ccccc2 7a_100000210790_100000045678 [0,1,0,0,0,0|1,0,0]=2 2075 B17R2.3956 Clc1ncccc1COCc2ccccc2 7a_100000748726_100000211182 [0,1,0,0,0,0|1,0,0]=2 2076 B17R2.3956 Clc1ncccc1COCc2ccccn2 34a_100000748726_100000721315 [0,1,0,0,0,0|2,0,0]=3 2077 B17R2.3956 Clc1ncccc1COCc2ccccn2 7a_100000748726_100000721315 [0,1,0,0,0,0|2,0,0]=3 2078 B17R2.3956 Clc1ncccc1COCc2cccnc2 34a_100000748726_100000733263 [0,1,0,0,0,0|2,0,0]=3 2079 B17R2.3956 Clc1ncccc1COCc2cccnc2 7a_100000748726_100000741622 [0,1,0,0,0,0|2,0,0]=3 2080 B17R2.3956 Clc1ncccc1COCc2cccnn2 34a_100000748726_100016990269 [0,1,0,0,0,0|3,0,0]=4 2081 B17R2.3956 Clc1ncccc1COCc2cccnn2 7a_100000748726_100016990269 [0,1,0,0,0,0|3,0,0]=4 2082 B17R2.3956 Clc1ncccc1COCc2ccncc2 7a_100000748726_100015193705 [0,1,0,0,0,0|2,0,0]=3 2083 B17R2.3956 Clc1ncccc1COCc2cnccn2 34a_100000748726_100016995436 [0,1,0,0,0,0|3,0,0]=4 2084 B17R2.3956 Clc1ncccc1COCc2cnccn2 7a_100000748726_100016995436 [0,1,0,0,0,0|3,0,0]=4 2085 B17R2.3956 Clc1ncccc1COCc2cncnc2 34a_100000748726_100015196519 [0,1,0,0,0,0|3,0,0]=4 2086 B17R2.3956 Clc1ncccc1COCc2cncnc2 7a_100000748726_100015196519 [0,1,0,0,0,0|3,0,0]=4 2087 B17R2.3956 Clc1ncccc1COCc2ncccn2 34a_100000748726_100000703007 [0,1,0,0,0,0|3,0,0]=4 2088 B17R2.3956 Clc1ncccc1COCc2ncccn2 7a_100000748726_100000703007 [0,1,0,0,0,0|3,0,0]=4 2089 B17R2.3956 Clc1ncccc1CSCc2ccccc2 62a_100000045678_100015291786 [0,1,0,0,0,0|1,1,0]=3 2090 B17R2.3956 Clc1ncccc1CSCc2ccccc2 62a_100000211182_100000045678 [0,1,0,0,0,0|1,1,0]=3 2091 B17R2.3956 Clc1ncccc1CSCc2ccccn2 62a_100000045678_100000721315 [0,1,0,0,0,0|2,1,0]=4 2092 B17R2.3956 Clc1ncccc1CSCc2ccccn2 62a_100000721315_100000045678 [0,1,0,0,0,0|2,1,0]=4 2093 B17R2.3956 Clc1ncccc1CSCc2cccnc2 62a_100000045678_100000741622 [0,1,0,0,0,0|2,1,0]=4 2094 B17R2.3956 Clc1ncccc1CSCc2cccnc2 62a_100000741622_100000045678 [0,1,0,0,0,0|2,1,0]=4 2095 B17R2.3956 Clc1ncccc1CSCc2ccncc2 62a_100000045678_100015193705 [0,1,0,0,0,0|2,1,0]=4 2096 B17R2.3956 Clc1ncccc1CSCc2ccncc2 62a_100015193705_100000045678 [0,1,0,0,0,0|2,1,0]=4 2097 B17R2.3956 Clc1ncccc1OCCc2ccccc2 34a_100000757616_100000765856 [0,1,0,0,0,0|3,0,0]=4 2098 B17R2.3956 Clc1ncccc1OCCc2ccccc2 7a_100000757616_100000765856 [0,1,0,0,0,0|3,0,0]=4 2099 B17R2.3956 Clc1ncccc1SCCc2ccccc2 62a_100000036424_100011218657 [0,1,0,0,0,0|3,0,0]=4 2100 B17R2.3956 Clc1ncccc1SCCc2ccccc2 62a_100000765856_100000036424 [0,1,0,0,0,0|3,0,0]=4 2101 B17R2.3956 Clc1nccnc1CNCc2ccccc2 2230a_100000729963_100015291786 [0,1,0,0,0,0|3,0,0]=4 2102 B17R2.3956 Clc1nccnc1COCc2ccccc2 34a_100000057004_100015291786 [0,1,0,0,0,0|2,0,0]=3 2103 B17R2.3956 Clc1nccnc1COCc2ccccn2 34a_100000057004_100000721315 [0,1,0,0,0,0|3,0,0]=4 2104 B17R2.3956 Clc1nccnc1COCc2cccnc2 34a_100000057004_100000733263 [0,1,0,0,0,0|3,0,0]=4 2105 B17R2.3956 Fc1ccccc1C=CCc2ccccc2 271570a_200016263579_100011215700 [0,1,0,0,0,0|1,0,1]=3 2106 B17R2.3956 Fc1ccccc1C=NNc2ccccc2 4a_100015195140_100000210811 [0,1,0,0,0,0|2,0,1]=4 2107 B17R2.3956 Fc1ccccc1CCNc2ccccc2 34a_100000106764_100000720011 [0,1,0,0,0,0|2,0,0]=3 2108 B17R2.3956 Fc1ccccc1CCOc2ccccc2 34a_100000210340_100000720011 [0,1,0,0,0,0|2,0,0]=3 2109 B17R2.3956 Fc1ccccc1CCOc2ccccc2 7a_100000210340_100000720011 [0,1,0,0,0,0|2,0,0]=3 2110 B17R2.3956 Fc1ccccc1CCOc2cccnc2 34a_100000210849_100000720011 [0,1,0,0,0,0|3,0,0]=4 2111 B17R2.3956 Fc1ccccc1CCOc2cccnc2 7a_100000210849_100000720011 [0,1,0,0,0,0|3,0,0]=4 2112 B17R2.3956 Fc1ccccc1CCOc2ccncc2 34a_100000212176_100000720011 [0,1,0,0,0,0|3,0,0]=4 2113 B17R2.3956 Fc1ccccc1CCSc2ccccc2 62a_100000719477_100011713696 [0,1,0,0,0,0|2,0,0]=3 2114 B17R2.3956 Fc1ccccc1CCSc2ccccc2 62a_100011713696_100000041952 [0,1,0,0,0,0|2,0,0]=3 2115 B17R2.3956 Fc1ccccc1CCSc2ccccn2 62a_100011216584_100011713696 [0,1,0,0,0,0|3,0,0]=4 2116 B17R2.3956 Fc1ccccc1CCSc2ccccn2 62a_100011713696_100011216584 [0,1,0,0,0,0|3,0,0]=4 2117 B17R2.3956 Fc1ccccc1CCSc2cccnc2 62a_100000210063_100011713696 [0,1,0,0,0,0|3,0,0]=4 2118 B17R2.3956 Fc1ccccc1CCSc2cccnc2 62a_100011713696_100000210063 [0,1,0,0,0,0|3,0,0]=4 2119 B17R2.3956 Fc1ccccc1CCSc2ccncc2 62a_100000728582_100011713696 [0,1,0,0,0,0|3,0,0]=4 2120 B17R2.3956 Fc1ccccc1CCSc2ccncc2 62a_100011713696_100000728582 [0,1,0,0,0,0|3,0,0]=4 2121 B17R2.3956 Fc1ccccc1CNCc2ccccc2 207a_100000174869_100015611070 [0,1,0,0,0,0|1,0,0]=2 2122 B17R2.3956 Fc1ccccc1CNCc2ccccc2 207a_100015324214_100000210811 [0,1,0,0,0,0|1,0,0]=2 2123 B17R2.3956 Fc1ccccc1CNCc2ccccc2 2230a_100015324214_100000211605 [0,1,0,0,0,0|1,0,0]=2 2124 B17R2.3956 Fc1ccccc1CNCc2ccccc2 270004a_100000174869_100015611070 [0,1,0,0,0,0|1,0,0]=2 2125 B17R2.3956 Fc1ccccc1CNCc2ccccc2 270004a_100015324214_100000210811 [0,1,0,0,0,0|1,0,0]=2 2126 B17R2.3956 Fc1ccccc1CNCc2ccccc2 34a_100000174869_100015291786 [0,1,0,0,0,0|1,0,0]=2 2127 B17R2.3956 Fc1ccccc1CNCc2ccccc2 34a_100015324214_100000211605 [0,1,0,0,0,0|1,0,0]=2 2128 B17R2.3956 Fc1ccccc1CNCc2ccccn2 207a_100000174869_100000209966 [0,1,0,0,0,0|2,0,0]=3 2129 B17R2.3956 Fc1ccccc1CNCc2ccccn2 270004a_100000174869_100000209966 [0,1,0,0,0,0|2,0,0]=3 2130 B17R2.3956 Fc1ccccc1CNCc2ccccn2 270004a_100000210449_100000210811 [0,1,0,0,0,0|2,0,0]=3 2131 B17R2.3956 Fc1ccccc1CNCc2ccccn2 34a_100000174869_100000721315 [0,1,0,0,0,0|2,0,0]=3 2132 B17R2.3956 Fc1ccccc1CNCc2cccnc2 207a_100000174869_100000209961 [0,1,0,0,0,0|2,0,0]=3 2133 B17R2.3956 Fc1ccccc1CNCc2cccnc2 207a_100000210453_100000210811 [0,1,0,0,0,0|2,0,0]=3 2134 B17R2.3956 Fc1ccccc1CNCc2cccnc2 270004a_100000174869_100000209961 [0,1,0,0,0,0|2,0,0]=3 2135 B17R2.3956 Fc1ccccc1CNCc2cccnc2 270004a_100000210453_100000210811 [0,1,0,0,0,0|2,0,0]=3 2136 B17R2.3956 Fc1ccccc1CNCc2cccnc2 34a_100000174869_100000733263 [0,1,0,0,0,0|2,0,0]=3 2137 B17R2.3956 Fc1ccccc1CNCc2cccnn2 2230a_100159270163_100000211605 [0,1,0,0,0,0|3,0,0]=4 2138 B17R2.3956 Fc1ccccc1CNCc2cccnn2 34a_100000174869_100016990269 [0,1,0,0,0,0|3,0,0]=4 2139 B17R2.3956 Fc1ccccc1CNCc2ccncc2 207a_100000174869_100000186114 [0,1,0,0,0,0|2,0,0]=3 2140 B17R2.3956 Fc1ccccc1CNCc2ccnnc2 270004a_100000174869_100011934578 [0,1,0,0,0,0|3,0,0]=4 2141 B17R2.3956 Fc1ccccc1CNCc2cnccn2 270004a_100000174869_100000749867 [0,1,0,0,0,0|3,0,0]=4 2142 B17R2.3956 Fc1ccccc1CNCc2cnccn2 34a_100000174869_100016995436 [0,1,0,0,0,0|3,0,0]=4 2143 B17R2.3956 Fc1ccccc1CNCc2cncnc2 207a_100011243677_100000210811 [0,1,0,0,0,0|3,0,0]=4 2144 B17R2.3956 Fc1ccccc1CNCc2cncnc2 2230a_100011243677_100000211605 [0,1,0,0,0,0|3,0,0]=4 2145 B17R2.3956 Fc1ccccc1CNCc2cncnc2 270004a_100000174869_100000749868 [0,1,0,0,0,0|3,0,0]=4 2146 B17R2.3956 Fc1ccccc1CNCc2cncnc2 270004a_100011243677_100000210811 [0,1,0,0,0,0|3,0,0]=4 2147 B17R2.3956 Fc1ccccc1CNCc2cncnc2 34a_100000174869_100015196519 [0,1,0,0,0,0|3,0,0]=4 2148 B17R2.3956 Fc1ccccc1CNCc2ncccn2 270004a_100000174869_100011532527 [0,1,0,0,0,0|3,0,0]=4 2149 B17R2.3956 Fc1ccccc1CNCc2ncccn2 34a_100000174869_100000703007 [0,1,0,0,0,0|3,0,0]=4 2150 B17R2.3956 Fc1ccccc1COCc2ccccc2 34a_100000210790_100000211605 [0,1,0,0,0,0|0,0,0]=1 2151 B17R2.3956 Fc1ccccc1COCc2ccccc2 34a_100000211962_100015291786 [0,1,0,0,0,0|0,0,0]=1 2152 B17R2.3956 Fc1ccccc1COCc2ccccc2 7a_100000210790_100000211605 [0,1,0,0,0,0|0,0,0]=1 2153 B17R2.3956 Fc1ccccc1COCc2ccccc2 7a_100000211962_100000211182 [0,1,0,0,0,0|0,0,0]=1 2154 B17R2.3956 Fc1ccccc1COCc2ccccn2 34a_100000211962_100000721315 [0,1,0,0,0,0|1,0,0]=2 2155 B17R2.3956 Fc1ccccc1COCc2ccccn2 7a_100000211962_100000721315 [0,1,0,0,0,0|1,0,0]=2 2156 B17R2.3956 Fc1ccccc1COCc2cccnc2 34a_100000211962_100000733263 [0,1,0,0,0,0|1,0,0]=2 2157 B17R2.3956 Fc1ccccc1COCc2cccnc2 7a_100000211962_100000741622 [0,1,0,0,0,0|1,0,0]=2 2158 B17R2.3956 Fc1ccccc1COCc2cccnn2 34a_100000211962_100016990269 [0,1,0,0,0,0|2,0,0]=3 2159 B17R2.3956 Fc1ccccc1COCc2cccnn2 7a_100000211962_100016990269 [0,1,0,0,0,0|2,0,0]=3 2160 B17R2.3956 Fc1ccccc1COCc2ccncc2 7a_100000211962_100015193705 [0,1,0,0,0,0|1,0,0]=2 2161 B17R2.3956 Fc1ccccc1COCc2cnccn2 34a_100000211962_100016995436 [0,1,0,0,0,0|2,0,0]=3 2162 B17R2.3956 Fc1ccccc1COCc2cnccn2 7a_100000211962_100016995436 [0,1,0,0,0,0|2,0,0]=3 2163 B17R2.3956 Fc1ccccc1COCc2cncnc2 34a_100000211962_100015196519 [0,1,0,0,0,0|2,0,0]=3 2164 B17R2.3956 Fc1ccccc1COCc2cncnc2 7a_100000211962_100015196519 [0,1,0,0,0,0|2,0,0]=3 2165 B17R2.3956 Fc1ccccc1COCc2ncccn2 34a_100000211962_100000703007 [0,1,0,0,0,0|2,0,0]=3 2166 B17R2.3956 Fc1ccccc1COCc2ncccn2 7a_100000211962_100000703007 [0,1,0,0,0,0|2,0,0]=3 2167 B17R2.3956 Fc1ccccc1CSCc2ccccc2 62a_100000211182_100000211605 [0,1,0,0,0,0|0,1,0]=2 2168 B17R2.3956 Fc1ccccc1CSCc2ccccc2 62a_100000211605_100015291786 [0,1,0,0,0,0|0,1,0]=2 2169 B17R2.3956 Fc1ccccc1CSCc2ccccn2 62a_100000211605_100000721315 [0,1,0,0,0,0|1,1,0]=3 2170 B17R2.3956 Fc1ccccc1CSCc2ccccn2 62a_100000721315_100000211605 [0,1,0,0,0,0|1,1,0]=3 2171 B17R2.3956 Fc1ccccc1CSCc2cccnc2 62a_100000211605_100000741622 [0,1,0,0,0,0|1,1,0]=3 2172 B17R2.3956 Fc1ccccc1CSCc2cccnc2 62a_100000741622_100000211605 [0,1,0,0,0,0|1,1,0]=3 2173 B17R2.3956 Fc1ccccc1CSCc2cccnn2 62a_100000211605_100016990269 [0,1,0,0,0,0|2,1,0]=4 2174 B17R2.3956 Fc1ccccc1CSCc2cccnn2 62a_100016990269_100000211605 [0,1,0,0,0,0|2,1,0]=4 2175 B17R2.3956 Fc1ccccc1CSCc2ccncc2 62a_100000211605_100015193705 [0,1,0,0,0,0|1,1,0]=3 2176 B17R2.3956 Fc1ccccc1CSCc2ccncc2 62a_100015193705_100000211605 [0,1,0,0,0,0|1,1,0]=3 2177 B17R2.3956 Fc1ccccc1CSCc2cnccn2 62a_100000211605_100016995436 [0,1,0,0,0,0|2,1,0]=4 2178 B17R2.3956 Fc1ccccc1CSCc2cnccn2 62a_100016995436_100000211605 [0,1,0,0,0,0|2,1,0]=4 2179 B17R2.3956 Fc1ccccc1CSCc2cncnc2 62a_100000211605_100015196519 [0,1,0,0,0,0|2,1,0]=4 2180 B17R2.3956 Fc1ccccc1CSCc2cncnc2 62a_100015196519_100000211605 [0,1,0,0,0,0|2,1,0]=4 2181 B17R2.3956 Fc1ccccc1CSCc2ncccn2 62a_100000211605_100000703007 [0,1,0,0,0,0|2,1,0]=4 2182 B17R2.3956 Fc1ccccc1CSCc2ncccn2 62a_100000703007_100000211605 [0,1,0,0,0,0|2,1,0]=4 2183 B17R2.3956 Fc1ccccc1NCCc2ccccc2 34a_100000210422_100000765856 [0,1,0,0,0,0|2,0,0]=3 2184 B17R2.3956 Fc1ccccc1NN=Cc2ccccc2 4a_100000239246_100015611070 [0,1,0,0,0,0|2,0,1]=4 2185 B17R2.3956 Fc1ccccc1OCCc2ccccc2 34a_100000210171_100000765856 [0,1,0,0,0,0|2,0,0]=3 2186 B17R2.3956 Fc1ccccc1OCCc2ccccc2 7a_100000210171_100000765856 [0,1,0,0,0,0|2,0,0]=3 2187 B17R2.3956 Fc1ccccc1OCCc2ccccn2 7a_100000210171_100015183660 [0,1,0,0,0,0|3,0,0]=4 2188 B17R2.3956 Fc1ccccc1OCCc2cccnc2 7a_100000210171_200011713674 [0,1,0,0,0,0|3,0,0]=4 2189 B17R2.3956 Fc1ccccc1OCCc2ccncc2 7a_100000210171_100000723409 [0,1,0,0,0,0|3,0,0]=4 2190 B17R2.3956 Fc1ccccc1SCCc2ccccc2 62a_100000765856_100011215700 [0,1,0,0,0,0|2,0,0]=3 2191 B17R2.3956 Fc1ccccc1SCCc2ccccc2 62a_100011215700_100011218657 [0,1,0,0,0,0|2,0,0]=3 2192 B17R2.3956 Fc1ccccc1SCCc2ccccn2 62a_100011215700_100015183660 [0,1,0,0,0,0|3,0,0]=4 2193 B17R2.3956 Fc1ccccc1SCCc2ccccn2 62a_100015183660_100011215700 [0,1,0,0,0,0|3,0,0]=4 2194 B17R2.3956 Fc1ccccc1SCCc2cccnc2 62a_100011215700_200011713674 [0,1,0,0,0,0|3,0,0]=4 2195 B17R2.3956 Fc1ccccc1SCCc2cccnc2 62a_200011713674_100011215700 [0,1,0,0,0,0|3,0,0]=4 2196 B17R2.3956 Fc1ccccc1SCCc2ccncc2 62a_100000723409_100011215700 [0,1,0,0,0,0|3,0,0]=4 2197 B17R2.3956 Fc1ccccc1SCCc2ccncc2 62a_100011215700_100000723409 [0,1,0,0,0,0|3,0,0]=4 2198 B17R2.3956 Fc1ccccc1SCSc2ccccc2 62a_100011215700_100011218342 [0,1,0,0,0,0|3,0,0]=4 2199 B17R2.3956 Fc1ccccc1SCSc2ccccc2 62a_100011218342_100011215700 [0,1,0,0,0,0|3,0,0]=4 2200 B17R2.3956 Fc1cccnc1C=CCc2ccccc2 271570a_200016263579_100000685392 [0,1,0,0,0,0|2,0,1]=4 2201 B17R2.3956 Fc1cccnc1CNCc2ccccc2 207a_100015324214_100011934734 [0,1,0,0,0,0|2,0,0]=3 2202 B17R2.3956 Fc1cccnc1CNCc2ccccc2 2230a_100015324214_100000104219 [0,1,0,0,0,0|2,0,0]=3 2203 B17R2.3956 Fc1cccnc1CNCc2ccccc2 270004a_100000690088_100015611070 [0,1,0,0,0,0|2,0,0]=3 2204 B17R2.3956 Fc1cccnc1CNCc2ccccc2 270004a_100015324214_100011934734 [0,1,0,0,0,0|2,0,0]=3 2205 B17R2.3956 Fc1cccnc1CNCc2ccccc2 34a_100000690088_100015291786 [0,1,0,0,0,0|2,0,0]=3 2206 B17R2.3956 Fc1cccnc1CNCc2ccccc2 34a_100015324214_100000104219 [0,1,0,0,0,0|2,0,0]=3 2207 B17R2.3956 Fc1cccnc1CNCc2ccccn2 270004a_100000210449_100011934734 [0,1,0,0,0,0|3,0,0]=4 2208 B17R2.3956 Fc1cccnc1CNCc2ccccn2 270004a_100000690088_100000209966 [0,1,0,0,0,0|3,0,0]=4 2209 B17R2.3956 Fc1cccnc1CNCc2ccccn2 34a_100000690088_100000721315 [0,1,0,0,0,0|3,0,0]=4 2210 B17R2.3956 Fc1cccnc1CNCc2cccnc2 207a_100000210453_100011934734 [0,1,0,0,0,0|3,0,0]=4 2211 B17R2.3956 Fc1cccnc1CNCc2cccnc2 270004a_100000210453_100011934734 [0,1,0,0,0,0|3,0,0]=4 2212 B17R2.3956 Fc1cccnc1CNCc2cccnc2 270004a_100000690088_100000209961 [0,1,0,0,0,0|3,0,0]=4 2213 B17R2.3956 Fc1cccnc1CNCc2cccnc2 34a_100000690088_100000733263 [0,1,0,0,0,0|3,0,0]=4 2214 B17R2.3956 Fc1cccnc1COCc2ccccc2 34a_100000210790_100000104219 [0,1,0,0,0,0|1,0,0]=2 2215 B17R2.3956 Fc1cccnc1COCc2ccccc2 34a_100011934865_100015291786 [0,1,0,0,0,0|1,0,0]=2 2216 B17R2.3956 Fc1cccnc1COCc2ccccc2 7a_100000210790_100000104219 [0,1,0,0,0,0|1,0,0]=2 2217 B17R2.3956 Fc1cccnc1COCc2ccccn2 34a_100011934865_100000721315 [0,1,0,0,0,0|2,0,0]=3 2218 B17R2.3956 Fc1cccnc1COCc2cccnc2 34a_100011934865_100000733263 [0,1,0,0,0,0|2,0,0]=3 2219 B17R2.3956 Fc1cccnc1COCc2cccnn2 34a_100011934865_100016990269 [0,1,0,0,0,0|3,0,0]=4 2220 B17R2.3956 Fc1cccnc1COCc2cnccn2 34a_100011934865_100016995436 [0,1,0,0,0,0|3,0,0]=4 2221 B17R2.3956 Fc1cccnc1COCc2cncnc2 34a_100011934865_100015196519 [0,1,0,0,0,0|3,0,0]=4 2222 B17R2.3956 Fc1cccnc1COCc2ncccn2 34a_100011934865_100000703007 [0,1,0,0,0,0|3,0,0]=4 2223 B17R2.3956 Fc1cccnc1CSCc2ccccc2 62a_100000104219_100015291786 [0,1,0,0,0,0|1,1,0]=3 2224 B17R2.3956 Fc1cccnc1CSCc2ccccc2 62a_100000211182_100000104219 [0,1,0,0,0,0|1,1,0]=3 2225 B17R2.3956 Fc1cccnc1CSCc2ccccn2 62a_100000104219_100000721315 [0,1,0,0,0,0|2,1,0]=4 2226 B17R2.3956 Fc1cccnc1CSCc2ccccn2 62a_100000721315_100000104219 [0,1,0,0,0,0|2,1,0]=4 2227 B17R2.3956 Fc1cccnc1CSCc2cccnc2 62a_100000104219_100000741622 [0,1,0,0,0,0|2,1,0]=4 2228 B17R2.3956 Fc1cccnc1CSCc2cccnc2 62a_100000741622_100000104219 [0,1,0,0,0,0|2,1,0]=4 2229 B17R2.3956 Fc1cccnc1CSCc2ccncc2 62a_100000104219_100015193705 [0,1,0,0,0,0|2,1,0]=4 2230 B17R2.3956 Fc1cccnc1CSCc2ccncc2 62a_100015193705_100000104219 [0,1,0,0,0,0|2,1,0]=4 2231 B17R2.3956 Fc1cccnc1OCCc2ccccc2 34a_100011219419_100000765856 [0,1,0,0,0,0|3,0,0]=4 2232 B17R2.3956 Fc1cccnc1SCCc2ccccc2 62a_100000685392_100011218657 [0,1,0,0,0,0|3,0,0]=4 2233 B17R2.3956 Fc1cccnc1SCCc2ccccc2 62a_100000765856_100000685392 [0,1,0,0,0,0|3,0,0]=4 2234 B17R2.3956 Fc1ccncc1C=CCc2ccccc2 271570a_200016263579_100009820683 [0,1,0,0,0,0|2,0,1]=4 2235 B17R2.3956 Fc1ccncc1SCCc2ccccc2 62a_100000765856_100009820683 [0,1,0,0,0,0|3,0,0]=4 2236 B17R2.3956 Fc1ccncc1SCCc2ccccc2 62a_100009820683_100011218657 [0,1,0,0,0,0|3,0,0]=4 2237 B17R2.3956 Fc1cnccc1C=CCc2ccccc2 271570a_200016263579_100000047030 [0,1,0,0,0,0|2,0,1]=4 2238 B17R2.3956 Fc1cnccc1CNCc2ccccc2 207a_100011935246_100015611070 [0,1,0,0,0,0|2,0,0]=3 2239 B17R2.3956 Fc1cnccc1CNCc2ccccc2 270004a_100011935246_100015611070 [0,1,0,0,0,0|2,0,0]=3 2240 B17R2.3956 Fc1cnccc1CNCc2ccccc2 34a_100011935246_100015291786 [0,1,0,0,0,0|2,0,0]=3 2241 B17R2.3956 Fc1cnccc1CNCc2ccccn2 207a_100011935246_100000209966 [0,1,0,0,0,0|3,0,0]=4 2242 B17R2.3956 Fc1cnccc1CNCc2ccccn2 270004a_100011935246_100000209966 [0,1,0,0,0,0|3,0,0]=4 2243 B17R2.3956 Fc1cnccc1CNCc2ccccn2 34a_100011935246_100000721315 [0,1,0,0,0,0|3,0,0]=4 2244 B17R2.3956 Fc1cnccc1CNCc2cccnc2 207a_100011935246_100000209961 [0,1,0,0,0,0|3,0,0]=4 2245 B17R2.3956 Fc1cnccc1CNCc2cccnc2 270004a_100011935246_100000209961 [0,1,0,0,0,0|3,0,0]=4 2246 B17R2.3956 Fc1cnccc1CNCc2cccnc2 34a_100011935246_100000733263 [0,1,0,0,0,0|3,0,0]=4 2247 B17R2.3956 Fc1cnccc1CNCc2ccncc2 207a_100011935246_100000186114 [0,1,0,0,0,0|3,0,0]=4 2248 B17R2.3956 Fc1cnccc1COCc2ccccc2 34a_100012172863_100015291786 [0,1,0,0,0,0|1,0,0]=2 2249 B17R2.3956 Fc1cnccc1COCc2ccccn2 34a_100012172863_100000721315 [0,1,0,0,0,0|2,0,0]=3 2250 B17R2.3956 Fc1cnccc1COCc2cccnc2 34a_100012172863_100000733263 [0,1,0,0,0,0|2,0,0]=3 2251 B17R2.3956 Fc1cnccc1COCc2cccnn2 34a_100012172863_100016990269 [0,1,0,0,0,0|3,0,0]=4 2252 B17R2.3956 Fc1cnccc1COCc2cnccn2 34a_100012172863_100016995436 [0,1,0,0,0,0|3,0,0]=4 2253 B17R2.3956 Fc1cnccc1COCc2cncnc2 34a_100012172863_100015196519 [0,1,0,0,0,0|3,0,0]=4 2254 B17R2.3956 Fc1cnccc1COCc2ncccn2 34a_100012172863_100000703007 [0,1,0,0,0,0|3,0,0]=4 2255 B17R2.3956 Fc1cnccc1NCCc2ccccc2 27a_100000106460_100000035921 [0,1,0,0,0,0|3,0,0]=4 2256 B17R2.3956 Fc1cnccc1OCCc2ccccc2 34a_200000081243_100000765856 [0,1,0,0,0,0|3,0,0]=4 2257 B17R2.3956 Fc1cnccc1SCCc2ccccc2 62a_100000047030_100011218657 [0,1,0,0,0,0|3,0,0]=4 2258 B17R2.3956 Fc1cnccc1SCCc2ccccc2 62a_100000765856_100000047030 [0,1,0,0,0,0|3,0,0]=4 2259 B17R2.3956 Fc1ncccc1C=CCc2ccccc2 271570a_200016263579_100009816115 [0,1,0,0,0,0|2,0,1]=4 2260 B17R2.3956 Fc1ncccc1CNCc2ccccc2 2230a_100015324214_100000099810 [0,1,0,0,0,0|2,0,0]=3 2261 B17R2.3956 Fc1ncccc1CNCc2ccccc2 270004a_100000724633_100015611070 [0,1,0,0,0,0|2,0,0]=3 2262 B17R2.3956 Fc1ncccc1CNCc2ccccc2 34a_100000724633_100015291786 [0,1,0,0,0,0|2,0,0]=3 2263 B17R2.3956 Fc1ncccc1CNCc2ccccc2 34a_100015324214_100000099810 [0,1,0,0,0,0|2,0,0]=3 2264 B17R2.3956 Fc1ncccc1CNCc2ccccn2 270004a_100000724633_100000209966 [0,1,0,0,0,0|3,0,0]=4 2265 B17R2.3956 Fc1ncccc1CNCc2ccccn2 34a_100000724633_100000721315 [0,1,0,0,0,0|3,0,0]=4 2266 B17R2.3956 Fc1ncccc1CNCc2cccnc2 270004a_100000724633_100000209961 [0,1,0,0,0,0|3,0,0]=4 2267 B17R2.3956 Fc1ncccc1CNCc2cccnc2 34a_100000724633_100000733263 [0,1,0,0,0,0|3,0,0]=4 2268 B17R2.3956 Fc1ncccc1COCc2ccccc2 34a_100000079888_100015291786 [0,1,0,0,0,0|1,0,0]=2 2269 B17R2.3956 Fc1ncccc1COCc2ccccc2 34a_100000210790_100000099810 [0,1,0,0,0,0|1,0,0]=2 2270 B17R2.3956 Fc1ncccc1COCc2ccccc2 7a_100000079888_100000211182 [0,1,0,0,0,0|1,0,0]=2 2271 B17R2.3956 Fc1ncccc1COCc2ccccc2 7a_100000210790_100000099810 [0,1,0,0,0,0|1,0,0]=2 2272 B17R2.3956 Fc1ncccc1COCc2ccccn2 34a_100000079888_100000721315 [0,1,0,0,0,0|2,0,0]=3 2273 B17R2.3956 Fc1ncccc1COCc2ccccn2 7a_100000079888_100000721315 [0,1,0,0,0,0|2,0,0]=3 2274 B17R2.3956 Fc1ncccc1COCc2cccnc2 34a_100000079888_100000733263 [0,1,0,0,0,0|2,0,0]=3 2275 B17R2.3956 Fc1ncccc1COCc2cccnc2 7a_100000079888_100000741622 [0,1,0,0,0,0|2,0,0]=3 2276 B17R2.3956 Fc1ncccc1COCc2cccnn2 34a_100000079888_100016990269 [0,1,0,0,0,0|3,0,0]=4 2277 B17R2.3956 Fc1ncccc1COCc2cccnn2 7a_100000079888_100016990269 [0,1,0,0,0,0|3,0,0]=4 2278 B17R2.3956 Fc1ncccc1COCc2ccncc2 7a_100000079888_100015193705 [0,1,0,0,0,0|2,0,0]=3 2279 B17R2.3956 Fc1ncccc1COCc2cnccn2 34a_100000079888_100016995436 [0,1,0,0,0,0|3,0,0]=4 2280 B17R2.3956 Fc1ncccc1COCc2cnccn2 7a_100000079888_100016995436 [0,1,0,0,0,0|3,0,0]=4 2281 B17R2.3956 Fc1ncccc1COCc2cncnc2 34a_100000079888_100015196519 [0,1,0,0,0,0|3,0,0]=4 2282 B17R2.3956 Fc1ncccc1COCc2cncnc2 7a_100000079888_100015196519 [0,1,0,0,0,0|3,0,0]=4 2283 B17R2.3956 Fc1ncccc1COCc2ncccn2 34a_100000079888_100000703007 [0,1,0,0,0,0|3,0,0]=4 2284 B17R2.3956 Fc1ncccc1COCc2ncccn2 7a_100000079888_100000703007 [0,1,0,0,0,0|3,0,0]=4 2285 B17R2.3956 Fc1ncccc1CSCc2ccccc2 62a_100000099810_100015291786 [0,1,0,0,0,0|1,1,0]=3 2286 B17R2.3956 Fc1ncccc1CSCc2ccccc2 62a_100000211182_100000099810 [0,1,0,0,0,0|1,1,0]=3 2287 B17R2.3956 Fc1ncccc1CSCc2ccccn2 62a_100000099810_100000721315 [0,1,0,0,0,0|2,1,0]=4 2288 B17R2.3956 Fc1ncccc1CSCc2ccccn2 62a_100000721315_100000099810 [0,1,0,0,0,0|2,1,0]=4 2289 B17R2.3956 Fc1ncccc1CSCc2cccnc2 62a_100000099810_100000741622 [0,1,0,0,0,0|2,1,0]=4 2290 B17R2.3956 Fc1ncccc1CSCc2cccnc2 62a_100000741622_100000099810 [0,1,0,0,0,0|2,1,0]=4 2291 B17R2.3956 Fc1ncccc1CSCc2ccncc2 62a_100000099810_100015193705 [0,1,0,0,0,0|2,1,0]=4 2292 B17R2.3956 Fc1ncccc1CSCc2ccncc2 62a_100015193705_100000099810 [0,1,0,0,0,0|2,1,0]=4 2293 B17R2.3956 Fc1ncccc1OCCc2ccccc2 34a_100000061740_100000765856 [0,1,0,0,0,0|3,0,0]=4 2294 B17R2.3956 Fc1ncccc1OCCc2ccccc2 7a_100000061740_100000765856 [0,1,0,0,0,0|3,0,0]=4 2295 B17R2.3956 Fc1ncccc1SCCc2ccccc2 62a_100000765856_100009816115 [0,1,0,0,0,0|3,0,0]=4 2296 B17R2.3956 Fc1ncccc1SCCc2ccccc2 62a_100009816115_100011218657 [0,1,0,0,0,0|3,0,0]=4 2297 B17R2.3956 Ic1ccccc1C=NNc2ccccc2 4a_100015195140_100000010305 [0,1,0,0,0,0|2,0,1]=4 2298 B17R2.3956 Ic1ccccc1CNCc2ccccc2 207a_100015324214_100000010305 [0,1,0,0,0,0|1,0,0]=2 2299 B17R2.3956 Ic1ccccc1CNCc2ccccc2 207a_100015347259_100015611070 [0,1,0,0,0,0|1,0,0]=2 2300 B17R2.3956 Ic1ccccc1CNCc2ccccc2 2230a_100015324214_100011215278 [0,1,0,0,0,0|1,0,0]=2 2301 B17R2.3956 Ic1ccccc1CNCc2ccccc2 270004a_100015324214_100000010305 [0,1,0,0,0,0|1,0,0]=2 2302 B17R2.3956 Ic1ccccc1CNCc2ccccc2 270004a_100015347259_100015611070 [0,1,0,0,0,0|1,0,0]=2 2303 B17R2.3956 Ic1ccccc1CNCc2ccccc2 34a_100015324214_100011215278 [0,1,0,0,0,0|1,0,0]=2 2304 B17R2.3956 Ic1ccccc1CNCc2ccccn2 207a_100015347259_100000209966 [0,1,0,0,0,0|2,0,0]=3 2305 B17R2.3956 Ic1ccccc1CNCc2ccccn2 270004a_100000210449_100000010305 [0,1,0,0,0,0|2,0,0]=3 2306 B17R2.3956 Ic1ccccc1CNCc2ccccn2 270004a_100015347259_100000209966 [0,1,0,0,0,0|2,0,0]=3 2307 B17R2.3956 Ic1ccccc1CNCc2cccnc2 207a_100000210453_100000010305 [0,1,0,0,0,0|2,0,0]=3 2308 B17R2.3956 Ic1ccccc1CNCc2cccnc2 207a_100015347259_100000209961 [0,1,0,0,0,0|2,0,0]=3 2309 B17R2.3956 Ic1ccccc1CNCc2cccnc2 270004a_100000210453_100000010305 [0,1,0,0,0,0|2,0,0]=3 2310 B17R2.3956 Ic1ccccc1CNCc2cccnc2 270004a_100015347259_100000209961 [0,1,0,0,0,0|2,0,0]=3 2311 B17R2.3956 Ic1ccccc1CNCc2cccnn2 2230a_100159270163_100011215278 [0,1,0,0,0,0|3,0,0]=4 2312 B17R2.3956 Ic1ccccc1CNCc2ccncc2 207a_100015347259_100000186114 [0,1,0,0,0,0|2,0,0]=3 2313 B17R2.3956 Ic1ccccc1CNCc2ccnnc2 270004a_100015347259_100011934578 [0,1,0,0,0,0|3,0,0]=4 2314 B17R2.3956 Ic1ccccc1CNCc2cnccn2 270004a_100015347259_100000749867 [0,1,0,0,0,0|3,0,0]=4 2315 B17R2.3956 Ic1ccccc1CNCc2cncnc2 207a_100011243677_100000010305 [0,1,0,0,0,0|3,0,0]=4 2316 B17R2.3956 Ic1ccccc1CNCc2cncnc2 2230a_100011243677_100011215278 [0,1,0,0,0,0|3,0,0]=4 2317 B17R2.3956 Ic1ccccc1CNCc2cncnc2 270004a_100011243677_100000010305 [0,1,0,0,0,0|3,0,0]=4 2318 B17R2.3956 Ic1ccccc1CNCc2cncnc2 270004a_100015347259_100000749868 [0,1,0,0,0,0|3,0,0]=4 2319 B17R2.3956 Ic1ccccc1CNCc2ncccn2 270004a_100015347259_100011532527 [0,1,0,0,0,0|3,0,0]=4 2320 B17R2.3956 Ic1ccccc1COCc2ccccc2 34a_100000187465_100015291786 [0,1,0,0,0,0|0,0,0]=1 2321 B17R2.3956 Ic1ccccc1COCc2ccccc2 34a_100000210790_100011215278 [0,1,0,0,0,0|0,0,0]=1 2322 B17R2.3956 Ic1ccccc1COCc2ccccc2 7a_100000187465_100000211182 [0,1,0,0,0,0|0,0,0]=1 2323 B17R2.3956 Ic1ccccc1COCc2ccccc2 7a_100000210790_100011215278 [0,1,0,0,0,0|0,0,0]=1 2324 B17R2.3956 Ic1ccccc1COCc2ccccn2 34a_100000187465_100000721315 [0,1,0,0,0,0|1,0,0]=2 2325 B17R2.3956 Ic1ccccc1COCc2ccccn2 7a_100000187465_100000721315 [0,1,0,0,0,0|1,0,0]=2 2326 B17R2.3956 Ic1ccccc1COCc2cccnc2 34a_100000187465_100000733263 [0,1,0,0,0,0|1,0,0]=2 2327 B17R2.3956 Ic1ccccc1COCc2cccnc2 7a_100000187465_100000741622 [0,1,0,0,0,0|1,0,0]=2 2328 B17R2.3956 Ic1ccccc1COCc2cccnn2 34a_100000187465_100016990269 [0,1,0,0,0,0|2,0,0]=3 2329 B17R2.3956 Ic1ccccc1COCc2cccnn2 7a_100000187465_100016990269 [0,1,0,0,0,0|2,0,0]=3 2330 B17R2.3956 Ic1ccccc1COCc2ccncc2 7a_100000187465_100015193705 [0,1,0,0,0,0|1,0,0]=2 2331 B17R2.3956 Ic1ccccc1COCc2cnccn2 34a_100000187465_100016995436 [0,1,0,0,0,0|2,0,0]=3 2332 B17R2.3956 Ic1ccccc1COCc2cnccn2 7a_100000187465_100016995436 [0,1,0,0,0,0|2,0,0]=3 2333 B17R2.3956 Ic1ccccc1COCc2cncnc2 34a_100000187465_100015196519 [0,1,0,0,0,0|2,0,0]=3 2334 B17R2.3956 Ic1ccccc1COCc2cncnc2 7a_100000187465_100015196519 [0,1,0,0,0,0|2,0,0]=3 2335 B17R2.3956 Ic1ccccc1COCc2ncccn2 34a_100000187465_100000703007 [0,1,0,0,0,0|2,0,0]=3 2336 B17R2.3956 Ic1ccccc1COCc2ncccn2 7a_100000187465_100000703007 [0,1,0,0,0,0|2,0,0]=3 2337 B17R2.3956 Ic1ccccc1CSCc2ccccc2 62a_100000211182_100011216222 [0,1,0,0,0,0|0,1,0]=2 2338 B17R2.3956 Ic1ccccc1CSCc2ccccc2 62a_100011216222_100015291786 [0,1,0,0,0,0|0,1,0]=2 2339 B17R2.3956 Ic1ccccc1CSCc2ccccn2 62a_100000721315_100011216222 [0,1,0,0,0,0|1,1,0]=3 2340 B17R2.3956 Ic1ccccc1CSCc2ccccn2 62a_100011216222_100000721315 [0,1,0,0,0,0|1,1,0]=3 2341 B17R2.3956 Ic1ccccc1CSCc2cccnc2 62a_100000741622_100011216222 [0,1,0,0,0,0|1,1,0]=3 2342 B17R2.3956 Ic1ccccc1CSCc2cccnc2 62a_100011216222_100000741622 [0,1,0,0,0,0|1,1,0]=3 2343 B17R2.3956 Ic1ccccc1CSCc2cccnn2 62a_100011216222_100016990269 [0,1,0,0,0,0|2,1,0]=4 2344 B17R2.3956 Ic1ccccc1CSCc2cccnn2 62a_100016990269_100011216222 [0,1,0,0,0,0|2,1,0]=4 2345 B17R2.3956 Ic1ccccc1CSCc2ccncc2 62a_100011216222_100015193705 [0,1,0,0,0,0|1,1,0]=3 2346 B17R2.3956 Ic1ccccc1CSCc2ccncc2 62a_100015193705_100011216222 [0,1,0,0,0,0|1,1,0]=3 2347 B17R2.3956 Ic1ccccc1CSCc2cnccn2 62a_100011216222_100016995436 [0,1,0,0,0,0|2,1,0]=4 2348 B17R2.3956 Ic1ccccc1CSCc2cnccn2 62a_100016995436_100011216222 [0,1,0,0,0,0|2,1,0]=4 2349 B17R2.3956 Ic1ccccc1CSCc2cncnc2 62a_100011216222_100015196519 [0,1,0,0,0,0|2,1,0]=4 2350 B17R2.3956 Ic1ccccc1CSCc2cncnc2 62a_100015196519_100011216222 [0,1,0,0,0,0|2,1,0]=4 2351 B17R2.3956 Ic1ccccc1CSCc2ncccn2 62a_100000703007_100011216222 [0,1,0,0,0,0|2,1,0]=4 2352 B17R2.3956 Ic1ccccc1CSCc2ncccn2 62a_100011216222_100000703007 [0,1,0,0,0,0|2,1,0]=4 2353 B17R2.3956 Ic1ccccc1NCCc2ccccc2 34a_100000210053_100000765856 [0,1,0,0,0,0|2,0,0]=3 2354 B17R2.3956 Ic1ccccc1NN=Cc2ccccc2 4a_100011218156_100015611070 [0,1,0,0,0,0|2,0,1]=4 2355 B17R2.3956 Ic1ccccc1OCCc2ccccc2 34a_100000739446_100000765856 [0,1,0,0,0,0|2,0,0]=3 2356 B17R2.3956 Ic1ccccc1OCCc2ccccc2 7a_100000739446_100000765856 [0,1,0,0,0,0|2,0,0]=3 2357 B17R2.3956 Ic1ccccc1OCCc2ccccn2 7a_100000739446_100015183660 [0,1,0,0,0,0|3,0,0]=4 2358 B17R2.3956 Ic1ccccc1OCCc2cccnc2 7a_100000739446_200011713674 [0,1,0,0,0,0|3,0,0]=4 2359 B17R2.3956 Ic1ccccc1OCCc2ccncc2 7a_100000739446_100000723409 [0,1,0,0,0,0|3,0,0]=4 2360 B17R2.3956 Ic1ccncc1OCCc2ccccc2 34a_100000050107_100000765856 [0,1,0,0,0,0|3,0,0]=4 2361 B17R2.3956 Ic1ncccc1OCCc2ccccc2 34a_100000034122_100000765856 [0,1,0,0,0,0|3,0,0]=4 2362 B17R2.3956 Ic1ncccc1OCCc2ccccc2 7a_100000034122_100000765856 [0,1,0,0,0,0|3,0,0]=4 2363 B17R2.3956 Nc1ccccc1C=CCc2ccccc2 271570a_200016263579_100000210017 [0,1,0,0,0,0|1,0,1]=3 2364 B17R2.3956 Nc1ccccc1COCc2ccccc2 34a_100000212039_100015291786 [0,1,0,0,0,0|0,0,0]=1 2365 B17R2.3956 Nc1ccccc1COCc2ccccn2 34a_100000212039_100000721315 [0,1,0,0,0,0|1,0,0]=2 2366 B17R2.3956 Nc1ccccc1COCc2cccnc2 34a_100000212039_100000733263 [0,1,0,0,0,0|1,0,0]=2 2367 B17R2.3956 Nc1ccccc1COCc2cccnn2 34a_100000212039_100016990269 [0,1,0,0,0,0|2,0,0]=3 2368 B17R2.3956 Nc1ccccc1COCc2cnccn2 34a_100000212039_100016995436 [0,1,0,0,0,0|2,0,0]=3 2369 B17R2.3956 Nc1ccccc1COCc2cncnc2 34a_100000212039_100015196519 [0,1,0,0,0,0|2,0,0]=3 2370 B17R2.3956 Nc1ccccc1COCc2ncccn2 34a_100000212039_100000703007 [0,1,0,0,0,0|2,0,0]=3 2371 B17R2.3956 Nc1ccccc1OCCc2ccccc2 34a_100000185747_100000765856 [0,1,0,0,0,0|2,0,0]=3 2372 B17R2.3956 Nc1ccccc1OCCc2ccccc2 7a_100000185747_100000765856 [0,1,0,0,0,0|2,0,0]=3 2373 B17R2.3956 Nc1ccccc1OCCc2ccccn2 7a_100000185747_100015183660 [0,1,0,0,0,0|3,0,0]=4 2374 B17R2.3956 Nc1ccccc1OCCc2cccnc2 7a_100000185747_200011713674 [0,1,0,0,0,0|3,0,0]=4 2375 B17R2.3956 Nc1ccccc1OCCc2ccncc2 7a_100000185747_100000723409 [0,1,0,0,0,0|3,0,0]=4 2376 B17R2.3956 Nc1ccccc1SCCc2ccccc2 62a_100000210017_100011218657 [0,1,0,0,0,0|2,0,0]=3 2377 B17R2.3956 Nc1ccccc1SCCc2ccccc2 62a_100000765856_100000210017 [0,1,0,0,0,0|2,0,0]=3 2378 B17R2.3956 Nc1ccccc1SCCc2ccccn2 62a_100000210017_100015183660 [0,1,0,0,0,0|3,0,0]=4 2379 B17R2.3956 Nc1ccccc1SCCc2ccccn2 62a_100015183660_100000210017 [0,1,0,0,0,0|3,0,0]=4 2380 B17R2.3956 Nc1ccccc1SCCc2cccnc2 62a_100000210017_200011713674 [0,1,0,0,0,0|3,0,0]=4 2381 B17R2.3956 Nc1ccccc1SCCc2cccnc2 62a_200011713674_100000210017 [0,1,0,0,0,0|3,0,0]=4 2382 B17R2.3956 Nc1ccccc1SCCc2ccncc2 62a_100000210017_100000723409 [0,1,0,0,0,0|3,0,0]=4 2383 B17R2.3956 Nc1ccccc1SCCc2ccncc2 62a_100000723409_100000210017 [0,1,0,0,0,0|3,0,0]=4 2384 B17R2.3956 Nc1ccccc1SCSc2ccccc2 62a_100000210017_100011218342 [0,1,0,0,0,0|3,0,0]=4 2385 B17R2.3956 Nc1ccccc1SCSc2ccccc2 62a_100011218342_100000210017 [0,1,0,0,0,0|3,0,0]=4 2386 B17R2.3956 Nc1cccnc1C=CCc2ccccc2 271570a_200016263579_100000688686 [0,1,0,0,0,0|2,0,1]=4 2387 B17R2.3956 Nc1cccnc1COCc2ccccc2 34a_114873767017_100015291786 [0,1,0,0,0,0|1,0,0]=2 2388 B17R2.3956 Nc1cccnc1COCc2ccccn2 34a_114873767017_100000721315 [0,1,0,0,0,0|2,0,0]=3 2389 B17R2.3956 Nc1cccnc1COCc2cccnc2 34a_114873767017_100000733263 [0,1,0,0,0,0|2,0,0]=3 2390 B17R2.3956 Nc1cccnc1COCc2cccnn2 34a_114873767017_100016990269 [0,1,0,0,0,0|3,0,0]=4 2391 B17R2.3956 Nc1cccnc1COCc2cnccn2 34a_114873767017_100016995436 [0,1,0,0,0,0|3,0,0]=4 2392 B17R2.3956 Nc1cccnc1COCc2cncnc2 34a_114873767017_100015196519 [0,1,0,0,0,0|3,0,0]=4 2393 B17R2.3956 Nc1cccnc1COCc2ncccn2 34a_114873767017_100000703007 [0,1,0,0,0,0|3,0,0]=4 2394 B17R2.3956 Nc1cccnc1OCCc2ccccc2 34a_100000746358_100000765856 [0,1,0,0,0,0|3,0,0]=4 2395 B17R2.3956 Nc1cccnc1SCCc2ccccc2 62a_100000688686_100011218657 [0,1,0,0,0,0|3,0,0]=4 2396 B17R2.3956 Nc1cccnc1SCCc2ccccc2 62a_100000765856_100000688686 [0,1,0,0,0,0|3,0,0]=4 2397 B17R2.3956 Nc1ccncc1C=CCc2ccccc2 271570a_200016263579_100000047001 [0,1,0,0,0,0|2,0,1]=4 2398 B17R2.3956 Nc1ccncc1OCCc2ccccc2 34a_100000753702_100000765856 [0,1,0,0,0,0|3,0,0]=4 2399 B17R2.3956 Nc1ccncc1SCCc2ccccc2 62a_100000047001_100011218657 [0,1,0,0,0,0|3,0,0]=4 2400 B17R2.3956 Nc1ccncc1SCCc2ccccc2 62a_100000765856_100000047001 [0,1,0,0,0,0|3,0,0]=4 2401 B17R2.3956 Nc1cnccc1C=CCc2ccccc2 271570a_200016263579_100009815883 [0,1,0,0,0,0|2,0,1]=4 2402 B17R2.3956 Nc1cnccc1SCCc2ccccc2 62a_100000756074_100011218657 [0,1,0,0,0,0|3,0,0]=4 2403 B17R2.3956 Nc1cnccc1SCCc2ccccc2 62a_100000765856_100000756074 [0,1,0,0,0,0|3,0,0]=4 2404 B17R2.3956 Nc1ncccc1C=CCc2ccccc2 271570a_200016263579_100000045569 [0,1,0,0,0,0|2,0,1]=4 2405 B17R2.3956 Nc1ncccc1OCCc2ccccc2 34a_100000211975_100000765856 [0,1,0,0,0,0|3,0,0]=4 2406 B17R2.3956 Nc1ncccc1OCCc2ccccc2 7a_100000211975_100000765856 [0,1,0,0,0,0|3,0,0]=4 2407 B17R2.3956 Nc1ncccc1SCCc2ccccc2 62a_100000045569_100011218657 [0,1,0,0,0,0|3,0,0]=4 2408 B17R2.3956 Nc1ncccc1SCCc2ccccc2 62a_100000765856_100000045569 [0,1,0,0,0,0|3,0,0]=4 2409 B17R2.3956 O=c1[nH]cccc1C=CCc2ccccc2 271570a_200016263579_100000050042 [0,1,0,0,0,0|2,0,1]=4 2410 B17R2.3956 O=c1cc[nH]cc1C=CCc2ccccc2 271570a_200016263579_100009998708 [0,1,0,0,0,0|2,0,1]=4 2411 B17R2.3956 O=c1cc[nH]cc1SCCc2ccccc2 62a_100000765856_100009998708 [0,1,0,0,0,0|3,0,0]=4 2412 B17R2.3956 O=c1cc[nH]cc1SCCc2ccccc2 62a_100009998708_100011218657 [0,1,0,0,0,0|3,0,0]=4 2413 B17R2.3956 O=c1ccocc1OCCc2ccccc2 34a_100000060831_100000765856 [0,1,0,0,0,0|3,0,0]=4 2414 B17R2.3956 O=c1occcc1OCCc2ccccc2 34a_100000077404_100000765856 [0,1,0,0,0,0|3,0,0]=4 2415 B17R2.3956 O=c1occcc1OCCc2ccccc2 7a_100000077404_100000765856 [0,1,0,0,0,0|3,0,0]=4 2416 B17R2.3956 Oc1ccccc1C=CCc2ccccc2 271570a_200016263579_100000739446 [0,1,0,0,0,0|1,0,1]=3 2417 B17R2.3956 Oc1ccccc1C=NNc2ccccc2 4a_100015195140_100000185834 [0,1,0,0,0,0|2,0,1]=4 2418 B17R2.3956 Oc1ccccc1CCNc2ccccc2 34a_100000106764_100000722297 [0,1,0,0,0,0|2,0,0]=3 2419 B17R2.3956 Oc1ccccc1CCOc2ccccc2 34a_100000210340_100000722297 [0,1,0,0,0,0|2,0,0]=3 2420 B17R2.3956 Oc1ccccc1CCOc2ccccc2 7a_100000210340_100000722297 [0,1,0,0,0,0|2,0,0]=3 2421 B17R2.3956 Oc1ccccc1CCOc2cccnc2 34a_100000210849_100000722297 [0,1,0,0,0,0|3,0,0]=4 2422 B17R2.3956 Oc1ccccc1CCOc2cccnc2 7a_100000210849_100000722297 [0,1,0,0,0,0|3,0,0]=4 2423 B17R2.3956 Oc1ccccc1CCOc2ccncc2 34a_100000212176_100000722297 [0,1,0,0,0,0|3,0,0]=4 2424 B17R2.3956 Oc1ccccc1CCSc2ccccc2 62a_100000719477_100000722297 [0,1,0,0,0,0|2,0,0]=3 2425 B17R2.3956 Oc1ccccc1CCSc2ccccc2 62a_100000722297_100000041952 [0,1,0,0,0,0|2,0,0]=3 2426 B17R2.3956 Oc1ccccc1CCSc2ccccn2 62a_100000722297_100011216584 [0,1,0,0,0,0|3,0,0]=4 2427 B17R2.3956 Oc1ccccc1CCSc2ccccn2 62a_100011216584_100000722297 [0,1,0,0,0,0|3,0,0]=4 2428 B17R2.3956 Oc1ccccc1CCSc2cccnc2 62a_100000210063_100000722297 [0,1,0,0,0,0|3,0,0]=4 2429 B17R2.3956 Oc1ccccc1CCSc2cccnc2 62a_100000722297_100000210063 [0,1,0,0,0,0|3,0,0]=4 2430 B17R2.3956 Oc1ccccc1CCSc2ccncc2 62a_100000722297_100000728582 [0,1,0,0,0,0|3,0,0]=4 2431 B17R2.3956 Oc1ccccc1CCSc2ccncc2 62a_100000728582_100000722297 [0,1,0,0,0,0|3,0,0]=4 2432 B17R2.3956 Oc1ccccc1CNCc2ccccc2 207a_100000185550_100015611070 [0,1,0,0,0,0|1,0,0]=2 2433 B17R2.3956 Oc1ccccc1CNCc2ccccc2 270004a_100000185550_100015611070 [0,1,0,0,0,0|1,0,0]=2 2434 B17R2.3956 Oc1ccccc1CNCc2ccccc2 271570a_203496583355_200000195884 [0,1,0,0,0,0|1,0,0]=2 2435 B17R2.3956 Oc1ccccc1CNCc2ccccc2 34a_100000185550_100015291786 [0,1,0,0,0,0|1,0,0]=2 2436 B17R2.3956 Oc1ccccc1CNCc2ccccn2 207a_100000185550_100000209966 [0,1,0,0,0,0|2,0,0]=3 2437 B17R2.3956 Oc1ccccc1CNCc2ccccn2 270004a_100000185550_100000209966 [0,1,0,0,0,0|2,0,0]=3 2438 B17R2.3956 Oc1ccccc1CNCc2ccccn2 34a_100000185550_100000721315 [0,1,0,0,0,0|2,0,0]=3 2439 B17R2.3956 Oc1ccccc1CNCc2cccnc2 207a_100000185550_100000209961 [0,1,0,0,0,0|2,0,0]=3 2440 B17R2.3956 Oc1ccccc1CNCc2cccnc2 270004a_100000185550_100000209961 [0,1,0,0,0,0|2,0,0]=3 2441 B17R2.3956 Oc1ccccc1CNCc2cccnc2 34a_100000185550_100000733263 [0,1,0,0,0,0|2,0,0]=3 2442 B17R2.3956 Oc1ccccc1CNCc2cccnn2 34a_100000185550_100016990269 [0,1,0,0,0,0|3,0,0]=4 2443 B17R2.3956 Oc1ccccc1CNCc2ccncc2 207a_100000185550_100000186114 [0,1,0,0,0,0|2,0,0]=3 2444 B17R2.3956 Oc1ccccc1CNCc2ccnnc2 270004a_100000185550_100011934578 [0,1,0,0,0,0|3,0,0]=4 2445 B17R2.3956 Oc1ccccc1CNCc2cnccn2 270004a_100000185550_100000749867 [0,1,0,0,0,0|3,0,0]=4 2446 B17R2.3956 Oc1ccccc1CNCc2cnccn2 34a_100000185550_100016995436 [0,1,0,0,0,0|3,0,0]=4 2447 B17R2.3956 Oc1ccccc1CNCc2cncnc2 270004a_100000185550_100000749868 [0,1,0,0,0,0|3,0,0]=4 2448 B17R2.3956 Oc1ccccc1CNCc2cncnc2 34a_100000185550_100015196519 [0,1,0,0,0,0|3,0,0]=4 2449 B17R2.3956 Oc1ccccc1CNCc2ncccn2 270004a_100000185550_100011532527 [0,1,0,0,0,0|3,0,0]=4 2450 B17R2.3956 Oc1ccccc1CNCc2ncccn2 34a_100000185550_100000703007 [0,1,0,0,0,0|3,0,0]=4 2451 B17R2.3956 Oc1ccccc1NCCc2ccccc2 34a_100000185747_100000765856 [0,1,0,0,0,0|2,0,0]=3 2452 B17R2.3956 Oc1ccccc1SCCc2ccccc2 62a_100000739446_100011218657 [0,1,0,0,0,0|2,0,0]=3 2453 B17R2.3956 Oc1ccccc1SCCc2ccccc2 62a_100000765856_100000739446 [0,1,0,0,0,0|2,0,0]=3 2454 B17R2.3956 Oc1ccccc1SCCc2ccccn2 62a_100000739446_100015183660 [0,1,0,0,0,0|3,0,0]=4 2455 B17R2.3956 Oc1ccccc1SCCc2ccccn2 62a_100015183660_100000739446 [0,1,0,0,0,0|3,0,0]=4 2456 B17R2.3956 Oc1ccccc1SCCc2cccnc2 62a_100000739446_200011713674 [0,1,0,0,0,0|3,0,0]=4 2457 B17R2.3956 Oc1ccccc1SCCc2cccnc2 62a_200011713674_100000739446 [0,1,0,0,0,0|3,0,0]=4 2458 B17R2.3956 Oc1ccccc1SCCc2ccncc2 62a_100000723409_100000739446 [0,1,0,0,0,0|3,0,0]=4 2459 B17R2.3956 Oc1ccccc1SCCc2ccncc2 62a_100000739446_100000723409 [0,1,0,0,0,0|3,0,0]=4 2460 B17R2.3956 Oc1ccccc1SCSc2ccccc2 62a_100000739446_100011218342 [0,1,0,0,0,0|3,0,0]=4 2461 B17R2.3956 Oc1ccccc1SCSc2ccccc2 62a_100011218342_100000739446 [0,1,0,0,0,0|3,0,0]=4 2462 B17R2.3956 Oc1cccnc1C=CCc2ccccc2 271570a_200016263579_100000034122 [0,1,0,0,0,0|2,0,1]=4 2463 B17R2.3956 Oc1cccnc1CNCc2ccccc2 34a_100015324214_200020655725 [0,1,0,0,0,0|2,0,0]=3 2464 B17R2.3956 Oc1cccnc1COCc2ccccc2 34a_100000210790_200020655725 [0,1,0,0,0,0|1,0,0]=2 2465 B17R2.3956 Oc1cccnc1COCc2ccccc2 7a_100000210790_200020655725 [0,1,0,0,0,0|1,0,0]=2 2466 B17R2.3956 Oc1cccnc1CSCc2ccccc2 62a_100000211182_200020655725 [0,1,0,0,0,0|1,1,0]=3 2467 B17R2.3956 Oc1cccnc1CSCc2ccccc2 62a_200020655725_100015291786 [0,1,0,0,0,0|1,1,0]=3 2468 B17R2.3956 Oc1cccnc1CSCc2ccccn2 62a_100000721315_200020655725 [0,1,0,0,0,0|2,1,0]=4 2469 B17R2.3956 Oc1cccnc1CSCc2ccccn2 62a_200020655725_100000721315 [0,1,0,0,0,0|2,1,0]=4 2470 B17R2.3956 Oc1cccnc1CSCc2cccnc2 62a_100000741622_200020655725 [0,1,0,0,0,0|2,1,0]=4 2471 B17R2.3956 Oc1cccnc1CSCc2cccnc2 62a_200020655725_100000741622 [0,1,0,0,0,0|2,1,0]=4 2472 B17R2.3956 Oc1cccnc1CSCc2ccncc2 62a_100015193705_200020655725 [0,1,0,0,0,0|2,1,0]=4 2473 B17R2.3956 Oc1cccnc1CSCc2ccncc2 62a_200020655725_100015193705 [0,1,0,0,0,0|2,1,0]=4 2474 B17R2.3956 Oc1cccnc1SCCc2ccccc2 62a_100000034122_100011218657 [0,1,0,0,0,0|3,0,0]=4 2475 B17R2.3956 Oc1cccnc1SCCc2ccccc2 62a_100000765856_100000034122 [0,1,0,0,0,0|3,0,0]=4 2476 B17R2.3956 Oc1cnccc1C=CCc2ccccc2 271570a_200016263579_100009817591 [0,1,0,0,0,0|2,0,1]=4 2477 B17R2.3956 Oc1cnccc1SCCc2ccccc2 62a_100000765856_100009817591 [0,1,0,0,0,0|3,0,0]=4 2478 B17R2.3956 Oc1cnccc1SCCc2ccccc2 62a_100009817591_100011218657 [0,1,0,0,0,0|3,0,0]=4 2479 B17R2.3956 Oc1ncccc1CNCc2ccccc2 207a_100015324214_100011998315 [0,1,0,0,0,0|2,0,0]=3 2480 B17R2.3956 Oc1ncccc1CNCc2ccccc2 270004a_100015324214_100011998315 [0,1,0,0,0,0|2,0,0]=3 2481 B17R2.3956 Oc1ncccc1CNCc2ccccn2 270004a_100000210449_100011998315 [0,1,0,0,0,0|3,0,0]=4 2482 B17R2.3956 Oc1ncccc1CNCc2cccnc2 207a_100000210453_100011998315 [0,1,0,0,0,0|3,0,0]=4 2483 B17R2.3956 Oc1ncccc1CNCc2cccnc2 270004a_100000210453_100011998315 [0,1,0,0,0,0|3,0,0]=4 2484 B17R2.3956 Oc1ncccc1SCCc2ccccc2 62a_100000760158_100011218657 [0,1,0,0,0,0|3,0,0]=4 2485 B17R2.3956 Oc1ncccc1SCCc2ccccc2 62a_100000765856_100000760158 [0,1,0,0,0,0|3,0,0]=4 2486 B17R2.3956 S=c1cc[nH]cc1C=CCc2ccccc2 271570a_200016263579_200012280681 [0,1,0,0,0,0|2,0,1]=4 2487 B17R2.3956 S=c1cc[nH]cc1SCCc2ccccc2 62a_100000765856_200012280681 [0,1,0,0,0,0|3,0,0]=4 2488 B17R2.3956 S=c1cc[nH]cc1SCCc2ccccc2 62a_200012280681_100011218657 [0,1,0,0,0,0|3,0,0]=4 2489 B17R2.3956 [O-][n+]1ccccc1C=CCc2ccccc2 271570a_200016263579_200000042595 [0,1,0,0,0,0|2,0,1]=4 2490 B17R2.3956 [O-][n+]1ccccc1OCCc2ccccc2 7a_100000211761_100000765856 [0,1,0,0,0,0|3,0,0]=4 2491 B17R2.3956 [O-][n+]1ccccc1SCCc2ccccc2 62a_100000765856_200000042595 [0,1,0,0,0,0|3,0,0]=4 2492 B17R2.5301 Brc1cc(ccn1)C=CCc2ccccc2 271570a_200016263579_100009814637 [0,1,0,0,0,0|2,0,1]=4 2493 B17R2.5301 Brc1cc(ccn1)CNCc2ccccc2 2230a_100015324214_100010243470 [0,1,0,0,0,0|2,0,0]=3 2494 B17R2.5301 Brc1cc(ccn1)CNCc2ccccc2 2230a_100025757509_100015291786 [0,1,0,0,0,0|2,0,0]=3 2495 B17R2.5301 Brc1cc(ccn1)CNCc2ccccc2 270004a_100015324214_100009814634 [0,1,0,0,0,0|2,0,0]=3 2496 B17R2.5301 Brc1cc(ccn1)CNCc2ccccc2 270004a_100025757509_100015611070 [0,1,0,0,0,0|2,0,0]=3 2497 B17R2.5301 Brc1cc(ccn1)CNCc2ccccc2 34a_100015324214_100010243470 [0,1,0,0,0,0|2,0,0]=3 2498 B17R2.5301 Brc1cc(ccn1)CNCc2ccccc2 34a_100025757509_100015291786 [0,1,0,0,0,0|2,0,0]=3 2499 B17R2.5301 Brc1cc(ccn1)CNCc2ccccn2 2230a_100025757509_100000721315 [0,1,0,0,0,0|3,0,0]=4 2500 B17R2.5301 Brc1cc(ccn1)CNCc2ccccn2 270004a_100000210449_100009814634 [0,1,0,0,0,0|3,0,0]=4 2501 B17R2.5301 Brc1cc(ccn1)CNCc2ccccn2 270004a_100025757509_100000209966 [0,1,0,0,0,0|3,0,0]=4 2502 B17R2.5301 Brc1cc(ccn1)CNCc2ccccn2 34a_100025757509_100000721315 [0,1,0,0,0,0|3,0,0]=4 2503 B17R2.5301 Brc1cc(ccn1)CNCc2cccnc2 2230a_100025757509_100000741622 [0,1,0,0,0,0|3,0,0]=4 2504 B17R2.5301 Brc1cc(ccn1)CNCc2cccnc2 270004a_100000210453_100009814634 [0,1,0,0,0,0|3,0,0]=4 2505 B17R2.5301 Brc1cc(ccn1)CNCc2cccnc2 270004a_100025757509_100000209961 [0,1,0,0,0,0|3,0,0]=4 2506 B17R2.5301 Brc1cc(ccn1)CNCc2cccnc2 34a_100025757509_100000733263 [0,1,0,0,0,0|3,0,0]=4 2507 B17R2.5301 Brc1cc(ccn1)CNCc2ccncc2 2230a_100025757509_100015193705 [0,1,0,0,0,0|3,0,0]=4 2508 B17R2.5301 Brc1cc(ccn1)COCc2ccccc2 34a_100000210790_100010243470 [0,1,0,0,0,0|1,0,0]=2 2509 B17R2.5301 Brc1cc(ccn1)COCc2ccccc2 34a_100009814636_100015291786 [0,1,0,0,0,0|1,0,0]=2 2510 B17R2.5301 Brc1cc(ccn1)COCc2ccccc2 7a_100000210790_100010254460 [0,1,0,0,0,0|1,0,0]=2 2511 B17R2.5301 Brc1cc(ccn1)COCc2ccccc2 7a_100009814636_100000211182 [0,1,0,0,0,0|1,0,0]=2 2512 B17R2.5301 Brc1cc(ccn1)COCc2ccccn2 34a_100009814636_100000721315 [0,1,0,0,0,0|2,0,0]=3 2513 B17R2.5301 Brc1cc(ccn1)COCc2ccccn2 7a_100009814636_100000721315 [0,1,0,0,0,0|2,0,0]=3 2514 B17R2.5301 Brc1cc(ccn1)COCc2cccnc2 34a_100009814636_100000733263 [0,1,0,0,0,0|2,0,0]=3 2515 B17R2.5301 Brc1cc(ccn1)COCc2cccnc2 7a_100009814636_100000741622 [0,1,0,0,0,0|2,0,0]=3 2516 B17R2.5301 Brc1cc(ccn1)COCc2cccnn2 34a_100009814636_100016990269 [0,1,0,0,0,0|3,0,0]=4 2517 B17R2.5301 Brc1cc(ccn1)COCc2cccnn2 7a_100009814636_100016990269 [0,1,0,0,0,0|3,0,0]=4 2518 B17R2.5301 Brc1cc(ccn1)COCc2ccncc2 7a_100009814636_100015193705 [0,1,0,0,0,0|2,0,0]=3 2519 B17R2.5301 Brc1cc(ccn1)COCc2cnccn2 34a_100009814636_100016995436 [0,1,0,0,0,0|3,0,0]=4 2520 B17R2.5301 Brc1cc(ccn1)COCc2cnccn2 7a_100009814636_100016995436 [0,1,0,0,0,0|3,0,0]=4 2521 B17R2.5301 Brc1cc(ccn1)COCc2cncnc2 34a_100009814636_100015196519 [0,1,0,0,0,0|3,0,0]=4 2522 B17R2.5301 Brc1cc(ccn1)COCc2cncnc2 7a_100009814636_100015196519 [0,1,0,0,0,0|3,0,0]=4 2523 B17R2.5301 Brc1cc(ccn1)COCc2ncccn2 34a_100009814636_100000703007 [0,1,0,0,0,0|3,0,0]=4 2524 B17R2.5301 Brc1cc(ccn1)COCc2ncccn2 7a_100009814636_100000703007 [0,1,0,0,0,0|3,0,0]=4 2525 B17R2.5301 Brc1cc(ccn1)CSCc2ccccc2 62a_100000211182_100010243470 [0,1,0,0,0,0|1,1,0]=3 2526 B17R2.5301 Brc1cc(ccn1)CSCc2ccccc2 62a_100010254460_100015291786 [0,1,0,0,0,0|1,1,0]=3 2527 B17R2.5301 Brc1cc(ccn1)CSCc2ccccn2 62a_100000721315_100010243470 [0,1,0,0,0,0|2,1,0]=4 2528 B17R2.5301 Brc1cc(ccn1)CSCc2ccccn2 62a_100010254460_100000721315 [0,1,0,0,0,0|2,1,0]=4 2529 B17R2.5301 Brc1cc(ccn1)CSCc2cccnc2 62a_100000741622_100010243470 [0,1,0,0,0,0|2,1,0]=4 2530 B17R2.5301 Brc1cc(ccn1)CSCc2cccnc2 62a_100010254460_100000741622 [0,1,0,0,0,0|2,1,0]=4 2531 B17R2.5301 Brc1cc(ccn1)CSCc2ccncc2 62a_100010254460_100015193705 [0,1,0,0,0,0|2,1,0]=4 2532 B17R2.5301 Brc1cc(ccn1)CSCc2ccncc2 62a_100015193705_100010243470 [0,1,0,0,0,0|2,1,0]=4 2533 B17R2.5301 Brc1cc(ccn1)SCCc2ccccc2 62a_100000765856_100009814637 [0,1,0,0,0,0|3,0,0]=4 2534 B17R2.5301 Brc1cc(ccn1)SCCc2ccccc2 62a_100009814637_100011218657 [0,1,0,0,0,0|3,0,0]=4 2535 B17R2.5301 Brc1cccc(c1)C=CCc2ccccc2 271570a_200016263579_100000691529 [0,1,0,0,0,0|1,0,1]=3 2536 B17R2.5301 Brc1cccc(c1)C=NNc2ccccc2 4a_100015195140_100000210085 [0,1,0,0,0,0|2,0,1]=4 2537 B17R2.5301 Brc1cccc(c1)CCNc2ccccc2 34a_100000106764_100011740638 [0,1,0,0,0,0|2,0,0]=3 2538 B17R2.5301 Brc1cccc(c1)CCOc2ccccc2 34a_100000210340_100011740638 [0,1,0,0,0,0|2,0,0]=3 2539 B17R2.5301 Brc1cccc(c1)CCOc2ccccc2 7a_100000210340_100011740638 [0,1,0,0,0,0|2,0,0]=3 2540 B17R2.5301 Brc1cccc(c1)CCOc2cccnc2 34a_100000210849_100011740638 [0,1,0,0,0,0|3,0,0]=4 2541 B17R2.5301 Brc1cccc(c1)CCOc2cccnc2 7a_100000210849_100011740638 [0,1,0,0,0,0|3,0,0]=4 2542 B17R2.5301 Brc1cccc(c1)CCOc2ccncc2 34a_100000212176_100011740638 [0,1,0,0,0,0|3,0,0]=4 2543 B17R2.5301 Brc1cccc(c1)CCSc2ccccc2 62a_100000719477_100011740638 [0,1,0,0,0,0|2,0,0]=3 2544 B17R2.5301 Brc1cccc(c1)CCSc2ccccc2 62a_100011740638_100000041952 [0,1,0,0,0,0|2,0,0]=3 2545 B17R2.5301 Brc1cccc(c1)CCSc2ccccn2 62a_100011216584_100011740638 [0,1,0,0,0,0|3,0,0]=4 2546 B17R2.5301 Brc1cccc(c1)CCSc2ccccn2 62a_100011740638_100011216584 [0,1,0,0,0,0|3,0,0]=4 2547 B17R2.5301 Brc1cccc(c1)CCSc2cccnc2 62a_100000210063_100011740638 [0,1,0,0,0,0|3,0,0]=4 2548 B17R2.5301 Brc1cccc(c1)CCSc2cccnc2 62a_100011740638_100000210063 [0,1,0,0,0,0|3,0,0]=4 2549 B17R2.5301 Brc1cccc(c1)CCSc2ccncc2 62a_100000728582_100011740638 [0,1,0,0,0,0|3,0,0]=4 2550 B17R2.5301 Brc1cccc(c1)CCSc2ccncc2 62a_100011740638_100000728582 [0,1,0,0,0,0|3,0,0]=4 2551 B17R2.5301 Brc1cccc(c1)CNCc2ccccc2 207a_100000174977_100015611070 [0,1,0,0,0,0|1,0,0]=2 2552 B17R2.5301 Brc1cccc(c1)CNCc2ccccc2 207a_100015324214_100000210085 [0,1,0,0,0,0|1,0,0]=2 2553 B17R2.5301 Brc1cccc(c1)CNCc2ccccc2 2230a_100000174977_100015291786 [0,1,0,0,0,0|1,0,0]=2 2554 B17R2.5301 Brc1cccc(c1)CNCc2ccccc2 2230a_100015324214_100000698116 [0,1,0,0,0,0|1,0,0]=2 2555 B17R2.5301 Brc1cccc(c1)CNCc2ccccc2 270004a_100000174977_100015611070 [0,1,0,0,0,0|1,0,0]=2 2556 B17R2.5301 Brc1cccc(c1)CNCc2ccccc2 270004a_100015324214_100000210085 [0,1,0,0,0,0|1,0,0]=2 2557 B17R2.5301 Brc1cccc(c1)CNCc2ccccc2 34a_100000174977_100015291786 [0,1,0,0,0,0|1,0,0]=2 2558 B17R2.5301 Brc1cccc(c1)CNCc2ccccc2 34a_100015324214_100000698116 [0,1,0,0,0,0|1,0,0]=2 2559 B17R2.5301 Brc1cccc(c1)CNCc2ccccn2 207a_100000174977_100000209966 [0,1,0,0,0,0|2,0,0]=3 2560 B17R2.5301 Brc1cccc(c1)CNCc2ccccn2 2230a_100000174977_100000721315 [0,1,0,0,0,0|2,0,0]=3 2561 B17R2.5301 Brc1cccc(c1)CNCc2ccccn2 270004a_100000174977_100000209966 [0,1,0,0,0,0|2,0,0]=3 2562 B17R2.5301 Brc1cccc(c1)CNCc2ccccn2 270004a_100000210449_100000210085 [0,1,0,0,0,0|2,0,0]=3 2563 B17R2.5301 Brc1cccc(c1)CNCc2ccccn2 34a_100000174977_100000721315 [0,1,0,0,0,0|2,0,0]=3 2564 B17R2.5301 Brc1cccc(c1)CNCc2cccnc2 207a_100000174977_100000209961 [0,1,0,0,0,0|2,0,0]=3 2565 B17R2.5301 Brc1cccc(c1)CNCc2cccnc2 207a_100000210453_100000210085 [0,1,0,0,0,0|2,0,0]=3 2566 B17R2.5301 Brc1cccc(c1)CNCc2cccnc2 2230a_100000174977_100000741622 [0,1,0,0,0,0|2,0,0]=3 2567 B17R2.5301 Brc1cccc(c1)CNCc2cccnc2 270004a_100000174977_100000209961 [0,1,0,0,0,0|2,0,0]=3 2568 B17R2.5301 Brc1cccc(c1)CNCc2cccnc2 270004a_100000210453_100000210085 [0,1,0,0,0,0|2,0,0]=3 2569 B17R2.5301 Brc1cccc(c1)CNCc2cccnc2 34a_100000174977_100000733263 [0,1,0,0,0,0|2,0,0]=3 2570 B17R2.5301 Brc1cccc(c1)CNCc2cccnn2 2230a_100000174977_100016990269 [0,1,0,0,0,0|3,0,0]=4 2571 B17R2.5301 Brc1cccc(c1)CNCc2cccnn2 2230a_100159270163_100000698116 [0,1,0,0,0,0|3,0,0]=4 2572 B17R2.5301 Brc1cccc(c1)CNCc2cccnn2 34a_100000174977_100016990269 [0,1,0,0,0,0|3,0,0]=4 2573 B17R2.5301 Brc1cccc(c1)CNCc2ccncc2 207a_100000174977_100000186114 [0,1,0,0,0,0|2,0,0]=3 2574 B17R2.5301 Brc1cccc(c1)CNCc2ccncc2 2230a_100000174977_100015193705 [0,1,0,0,0,0|2,0,0]=3 2575 B17R2.5301 Brc1cccc(c1)CNCc2ccnnc2 270004a_100000174977_100011934578 [0,1,0,0,0,0|3,0,0]=4 2576 B17R2.5301 Brc1cccc(c1)CNCc2cnccn2 2230a_100000174977_100016995436 [0,1,0,0,0,0|3,0,0]=4 2577 B17R2.5301 Brc1cccc(c1)CNCc2cnccn2 270004a_100000174977_100000749867 [0,1,0,0,0,0|3,0,0]=4 2578 B17R2.5301 Brc1cccc(c1)CNCc2cnccn2 34a_100000174977_100016995436 [0,1,0,0,0,0|3,0,0]=4 2579 B17R2.5301 Brc1cccc(c1)CNCc2cncnc2 207a_100011243677_100000210085 [0,1,0,0,0,0|3,0,0]=4 2580 B17R2.5301 Brc1cccc(c1)CNCc2cncnc2 2230a_100000174977_100015196519 [0,1,0,0,0,0|3,0,0]=4 2581 B17R2.5301 Brc1cccc(c1)CNCc2cncnc2 2230a_100011243677_100000698116 [0,1,0,0,0,0|3,0,0]=4 2582 B17R2.5301 Brc1cccc(c1)CNCc2cncnc2 270004a_100000174977_100000749868 [0,1,0,0,0,0|3,0,0]=4 2583 B17R2.5301 Brc1cccc(c1)CNCc2cncnc2 270004a_100011243677_100000210085 [0,1,0,0,0,0|3,0,0]=4 2584 B17R2.5301 Brc1cccc(c1)CNCc2cncnc2 34a_100000174977_100015196519 [0,1,0,0,0,0|3,0,0]=4 2585 B17R2.5301 Brc1cccc(c1)CNCc2ncccn2 2230a_100000174977_100000703007 [0,1,0,0,0,0|3,0,0]=4 2586 B17R2.5301 Brc1cccc(c1)CNCc2ncccn2 270004a_100000174977_100011532527 [0,1,0,0,0,0|3,0,0]=4 2587 B17R2.5301 Brc1cccc(c1)CNCc2ncccn2 34a_100000174977_100000703007 [0,1,0,0,0,0|3,0,0]=4 2588 B17R2.5301 Brc1cccc(c1)COCc2ccccc2 34a_100000210790_100000698116 [0,1,0,0,0,0|0,0,0]=1 2589 B17R2.5301 Brc1cccc(c1)COCc2ccccc2 34a_100000687537_100015291786 [0,1,0,0,0,0|0,0,0]=1 2590 B17R2.5301 Brc1cccc(c1)COCc2ccccc2 7a_100000210790_100000211773 [0,1,0,0,0,0|0,0,0]=1 2591 B17R2.5301 Brc1cccc(c1)COCc2ccccc2 7a_100000687537_100000211182 [0,1,0,0,0,0|0,0,0]=1 2592 B17R2.5301 Brc1cccc(c1)COCc2ccccn2 34a_100000687537_100000721315 [0,1,0,0,0,0|1,0,0]=2 2593 B17R2.5301 Brc1cccc(c1)COCc2ccccn2 7a_100000687537_100000721315 [0,1,0,0,0,0|1,0,0]=2 2594 B17R2.5301 Brc1cccc(c1)COCc2cccnc2 34a_100000687537_100000733263 [0,1,0,0,0,0|1,0,0]=2 2595 B17R2.5301 Brc1cccc(c1)COCc2cccnc2 7a_100000687537_100000741622 [0,1,0,0,0,0|1,0,0]=2 2596 B17R2.5301 Brc1cccc(c1)COCc2cccnn2 34a_100000687537_100016990269 [0,1,0,0,0,0|2,0,0]=3 2597 B17R2.5301 Brc1cccc(c1)COCc2cccnn2 7a_100000687537_100016990269 [0,1,0,0,0,0|2,0,0]=3 2598 B17R2.5301 Brc1cccc(c1)COCc2ccncc2 7a_100000687537_100015193705 [0,1,0,0,0,0|1,0,0]=2 2599 B17R2.5301 Brc1cccc(c1)COCc2cnccn2 34a_100000687537_100016995436 [0,1,0,0,0,0|2,0,0]=3 2600 B17R2.5301 Brc1cccc(c1)COCc2cnccn2 7a_100000687537_100016995436 [0,1,0,0,0,0|2,0,0]=3 2601 B17R2.5301 Brc1cccc(c1)COCc2cncnc2 34a_100000687537_100015196519 [0,1,0,0,0,0|2,0,0]=3 2602 B17R2.5301 Brc1cccc(c1)COCc2cncnc2 7a_100000687537_100015196519 [0,1,0,0,0,0|2,0,0]=3 2603 B17R2.5301 Brc1cccc(c1)COCc2ncccn2 34a_100000687537_100000703007 [0,1,0,0,0,0|2,0,0]=3 2604 B17R2.5301 Brc1cccc(c1)COCc2ncccn2 7a_100000687537_100000703007 [0,1,0,0,0,0|2,0,0]=3 2605 B17R2.5301 Brc1cccc(c1)CSCc2ccccc2 62a_100000211182_100000211773 [0,1,0,0,0,0|0,1,0]=2 2606 B17R2.5301 Brc1cccc(c1)CSCc2ccccc2 62a_100000211773_100015291786 [0,1,0,0,0,0|0,1,0]=2 2607 B17R2.5301 Brc1cccc(c1)CSCc2ccccn2 62a_100000211773_100000721315 [0,1,0,0,0,0|1,1,0]=3 2608 B17R2.5301 Brc1cccc(c1)CSCc2ccccn2 62a_100000721315_100000211773 [0,1,0,0,0,0|1,1,0]=3 2609 B17R2.5301 Brc1cccc(c1)CSCc2cccnc2 62a_100000211773_100000741622 [0,1,0,0,0,0|1,1,0]=3 2610 B17R2.5301 Brc1cccc(c1)CSCc2cccnc2 62a_100000741622_100000211773 [0,1,0,0,0,0|1,1,0]=3 2611 B17R2.5301 Brc1cccc(c1)CSCc2cccnn2 62a_100000211773_100016990269 [0,1,0,0,0,0|2,1,0]=4 2612 B17R2.5301 Brc1cccc(c1)CSCc2cccnn2 62a_100016990269_100000211773 [0,1,0,0,0,0|2,1,0]=4 2613 B17R2.5301 Brc1cccc(c1)CSCc2ccncc2 62a_100000211773_100015193705 [0,1,0,0,0,0|1,1,0]=3 2614 B17R2.5301 Brc1cccc(c1)CSCc2ccncc2 62a_100015193705_100000211773 [0,1,0,0,0,0|1,1,0]=3 2615 B17R2.5301 Brc1cccc(c1)CSCc2cnccn2 62a_100000211773_100016995436 [0,1,0,0,0,0|2,1,0]=4 2616 B17R2.5301 Brc1cccc(c1)CSCc2cnccn2 62a_100016995436_100000211773 [0,1,0,0,0,0|2,1,0]=4 2617 B17R2.5301 Brc1cccc(c1)CSCc2cncnc2 62a_100000211773_100015196519 [0,1,0,0,0,0|2,1,0]=4 2618 B17R2.5301 Brc1cccc(c1)CSCc2cncnc2 62a_100015196519_100000211773 [0,1,0,0,0,0|2,1,0]=4 2619 B17R2.5301 Brc1cccc(c1)CSCc2ncccn2 62a_100000211773_100000703007 [0,1,0,0,0,0|2,1,0]=4 2620 B17R2.5301 Brc1cccc(c1)CSCc2ncccn2 62a_100000703007_100000211773 [0,1,0,0,0,0|2,1,0]=4 2621 B17R2.5301 Brc1cccc(c1)NCCc2ccccc2 34a_100000210019_100000765856 [0,1,0,0,0,0|2,0,0]=3 2622 B17R2.5301 Brc1cccc(c1)NN=Cc2ccccc2 4a_100000217339_100015611070 [0,1,0,0,0,0|2,0,1]=4 2623 B17R2.5301 Brc1cccc(c1)OCCc2ccccc2 34a_100000210342_100000765856 [0,1,0,0,0,0|2,0,0]=3 2624 B17R2.5301 Brc1cccc(c1)OCCc2ccccc2 7a_100000210342_100000765856 [0,1,0,0,0,0|2,0,0]=3 2625 B17R2.5301 Brc1cccc(c1)OCCc2ccccn2 7a_100000210342_100015183660 [0,1,0,0,0,0|3,0,0]=4 2626 B17R2.5301 Brc1cccc(c1)OCCc2cccnc2 7a_100000210342_200011713674 [0,1,0,0,0,0|3,0,0]=4 2627 B17R2.5301 Brc1cccc(c1)OCCc2ccncc2 7a_100000210342_100000723409 [0,1,0,0,0,0|3,0,0]=4 2628 B17R2.5301 Brc1cccc(c1)SCCc2ccccc2 62a_100000691529_100011218657 [0,1,0,0,0,0|2,0,0]=3 2629 B17R2.5301 Brc1cccc(c1)SCCc2ccccc2 62a_100000765856_100000691529 [0,1,0,0,0,0|2,0,0]=3 2630 B17R2.5301 Brc1cccc(c1)SCCc2ccccn2 62a_100000691529_100015183660 [0,1,0,0,0,0|3,0,0]=4 2631 B17R2.5301 Brc1cccc(c1)SCCc2ccccn2 62a_100015183660_100000691529 [0,1,0,0,0,0|3,0,0]=4 2632 B17R2.5301 Brc1cccc(c1)SCCc2cccnc2 62a_100000691529_200011713674 [0,1,0,0,0,0|3,0,0]=4 2633 B17R2.5301 Brc1cccc(c1)SCCc2cccnc2 62a_200011713674_100000691529 [0,1,0,0,0,0|3,0,0]=4 2634 B17R2.5301 Brc1cccc(c1)SCCc2ccncc2 62a_100000691529_100000723409 [0,1,0,0,0,0|3,0,0]=4 2635 B17R2.5301 Brc1cccc(c1)SCCc2ccncc2 62a_100000723409_100000691529 [0,1,0,0,0,0|3,0,0]=4 2636 B17R2.5301 Brc1cccc(c1)SCSc2ccccc2 62a_100000691529_100011218342 [0,1,0,0,0,0|3,0,0]=4 2637 B17R2.5301 Brc1cccc(c1)SCSc2ccccc2 62a_100011218342_100000691529 [0,1,0,0,0,0|3,0,0]=4 2638 B17R2.5301 Brc1cccc(n1)C=CCc2ccccc2 271570a_200016263579_100000684672 [0,1,0,0,0,0|2,0,1]=4 2639 B17R2.5301 Brc1cccc(n1)CNCc2ccccc2 2230a_100015324214_100009889011 [0,1,0,0,0,0|2,0,0]=3 2640 B17R2.5301 Brc1cccc(n1)CNCc2ccccc2 2230a_100016987751_100015291786 [0,1,0,0,0,0|2,0,0]=3 2641 B17R2.5301 Brc1cccc(n1)CNCc2ccccc2 270004a_100015324214_100000688028 [0,1,0,0,0,0|2,0,0]=3 2642 B17R2.5301 Brc1cccc(n1)CNCc2ccccc2 34a_100015324214_100009889011 [0,1,0,0,0,0|2,0,0]=3 2643 B17R2.5301 Brc1cccc(n1)CNCc2ccccn2 2230a_100016987751_100000721315 [0,1,0,0,0,0|3,0,0]=4 2644 B17R2.5301 Brc1cccc(n1)CNCc2ccccn2 270004a_100000210449_100000688028 [0,1,0,0,0,0|3,0,0]=4 2645 B17R2.5301 Brc1cccc(n1)CNCc2cccnc2 2230a_100016987751_100000741622 [0,1,0,0,0,0|3,0,0]=4 2646 B17R2.5301 Brc1cccc(n1)CNCc2cccnc2 270004a_100000210453_100000688028 [0,1,0,0,0,0|3,0,0]=4 2647 B17R2.5301 Brc1cccc(n1)CNCc2ccncc2 2230a_100016987751_100015193705 [0,1,0,0,0,0|3,0,0]=4 2648 B17R2.5301 Brc1cccc(n1)COCc2ccccc2 34a_100000210790_100009889011 [0,1,0,0,0,0|1,0,0]=2 2649 B17R2.5301 Brc1cccc(n1)COCc2ccccc2 34a_100000694195_100015291786 [0,1,0,0,0,0|1,0,0]=2 2650 B17R2.5301 Brc1cccc(n1)COCc2ccccc2 7a_100000210790_100009889011 [0,1,0,0,0,0|1,0,0]=2 2651 B17R2.5301 Brc1cccc(n1)COCc2ccccn2 34a_100000694195_100000721315 [0,1,0,0,0,0|2,0,0]=3 2652 B17R2.5301 Brc1cccc(n1)COCc2cccnc2 34a_100000694195_100000733263 [0,1,0,0,0,0|2,0,0]=3 2653 B17R2.5301 Brc1cccc(n1)COCc2cccnn2 34a_100000694195_100016990269 [0,1,0,0,0,0|3,0,0]=4 2654 B17R2.5301 Brc1cccc(n1)COCc2cnccn2 34a_100000694195_100016995436 [0,1,0,0,0,0|3,0,0]=4 2655 B17R2.5301 Brc1cccc(n1)COCc2cncnc2 34a_100000694195_100015196519 [0,1,0,0,0,0|3,0,0]=4 2656 B17R2.5301 Brc1cccc(n1)COCc2ncccn2 34a_100000694195_100000703007 [0,1,0,0,0,0|3,0,0]=4 2657 B17R2.5301 Brc1cccc(n1)CSCc2ccccc2 62a_100000211182_100009889011 [0,1,0,0,0,0|1,1,0]=3 2658 B17R2.5301 Brc1cccc(n1)CSCc2ccccc2 62a_100009889011_100015291786 [0,1,0,0,0,0|1,1,0]=3 2659 B17R2.5301 Brc1cccc(n1)CSCc2ccccn2 62a_100000721315_100009889011 [0,1,0,0,0,0|2,1,0]=4 2660 B17R2.5301 Brc1cccc(n1)CSCc2ccccn2 62a_100009889011_100000721315 [0,1,0,0,0,0|2,1,0]=4 2661 B17R2.5301 Brc1cccc(n1)CSCc2cccnc2 62a_100000741622_100009889011 [0,1,0,0,0,0|2,1,0]=4 2662 B17R2.5301 Brc1cccc(n1)CSCc2cccnc2 62a_100009889011_100000741622 [0,1,0,0,0,0|2,1,0]=4 2663 B17R2.5301 Brc1cccc(n1)CSCc2ccncc2 62a_100009889011_100015193705 [0,1,0,0,0,0|2,1,0]=4 2664 B17R2.5301 Brc1cccc(n1)CSCc2ccncc2 62a_100015193705_100009889011 [0,1,0,0,0,0|2,1,0]=4 2665 B17R2.5301 Brc1cccc(n1)SCCc2ccccc2 62a_100000684672_100011218657 [0,1,0,0,0,0|3,0,0]=4 2666 B17R2.5301 Brc1cccc(n1)SCCc2ccccc2 62a_100000765856_100000684672 [0,1,0,0,0,0|3,0,0]=4 2667 B17R2.5301 Brc1ccnc(c1)CNCc2ccccc2 2230a_100015324214_100010173614 [0,1,0,0,0,0|2,0,0]=3 2668 B17R2.5301 Brc1ccnc(c1)CNCc2ccccc2 270004a_100015324214_100009818557 [0,1,0,0,0,0|2,0,0]=3 2669 B17R2.5301 Brc1ccnc(c1)CNCc2ccccc2 34a_100015324214_100010173614 [0,1,0,0,0,0|2,0,0]=3 2670 B17R2.5301 Brc1ccnc(c1)CNCc2ccccn2 270004a_100000210449_100009818557 [0,1,0,0,0,0|3,0,0]=4 2671 B17R2.5301 Brc1ccnc(c1)CNCc2cccnc2 270004a_100000210453_100009818557 [0,1,0,0,0,0|3,0,0]=4 2672 B17R2.5301 Brc1ccnc(c1)COCc2ccccc2 34a_100000210790_100010173614 [0,1,0,0,0,0|1,0,0]=2 2673 B17R2.5301 Brc1ccnc(c1)COCc2ccccc2 7a_100000210790_100010173614 [0,1,0,0,0,0|1,0,0]=2 2674 B17R2.5301 Brc1ccnc(c1)CSCc2ccccc2 62a_100000211182_100010173614 [0,1,0,0,0,0|1,1,0]=3 2675 B17R2.5301 Brc1ccnc(c1)CSCc2ccccc2 62a_100010173614_100015291786 [0,1,0,0,0,0|1,1,0]=3 2676 B17R2.5301 Brc1ccnc(c1)CSCc2ccccn2 62a_100000721315_100010173614 [0,1,0,0,0,0|2,1,0]=4 2677 B17R2.5301 Brc1ccnc(c1)CSCc2ccccn2 62a_100010173614_100000721315 [0,1,0,0,0,0|2,1,0]=4 2678 B17R2.5301 Brc1ccnc(c1)CSCc2cccnc2 62a_100000741622_100010173614 [0,1,0,0,0,0|2,1,0]=4 2679 B17R2.5301 Brc1ccnc(c1)CSCc2cccnc2 62a_100010173614_100000741622 [0,1,0,0,0,0|2,1,0]=4 2680 B17R2.5301 Brc1ccnc(c1)CSCc2ccncc2 62a_100010173614_100015193705 [0,1,0,0,0,0|2,1,0]=4 2681 B17R2.5301 Brc1ccnc(c1)CSCc2ccncc2 62a_100015193705_100010173614 [0,1,0,0,0,0|2,1,0]=4 2682 B17R2.5301 Brc1cncc(c1)C=CCc2ccccc2 271570a_200016263579_100000728054 [0,1,0,0,0,0|2,0,1]=4 2683 B17R2.5301 Brc1cncc(c1)CNCc2ccccc2 207a_100011249555_100015611070 [0,1,0,0,0,0|2,0,0]=3 2684 B17R2.5301 Brc1cncc(c1)CNCc2ccccc2 207a_100015324214_100000687066 [0,1,0,0,0,0|2,0,0]=3 2685 B17R2.5301 Brc1cncc(c1)CNCc2ccccc2 2230a_100015324214_100000738771 [0,1,0,0,0,0|2,0,0]=3 2686 B17R2.5301 Brc1cncc(c1)CNCc2ccccc2 270004a_100011249555_100015611070 [0,1,0,0,0,0|2,0,0]=3 2687 B17R2.5301 Brc1cncc(c1)CNCc2ccccc2 270004a_100015324214_100000687066 [0,1,0,0,0,0|2,0,0]=3 2688 B17R2.5301 Brc1cncc(c1)CNCc2ccccc2 34a_100015324214_100000738771 [0,1,0,0,0,0|2,0,0]=3 2689 B17R2.5301 Brc1cncc(c1)CNCc2ccccn2 207a_100011249555_100000209966 [0,1,0,0,0,0|3,0,0]=4 2690 B17R2.5301 Brc1cncc(c1)CNCc2ccccn2 270004a_100000210449_100000687066 [0,1,0,0,0,0|3,0,0]=4 2691 B17R2.5301 Brc1cncc(c1)CNCc2ccccn2 270004a_100011249555_100000209966 [0,1,0,0,0,0|3,0,0]=4 2692 B17R2.5301 Brc1cncc(c1)CNCc2cccnc2 207a_100000210453_100000687066 [0,1,0,0,0,0|3,0,0]=4 2693 B17R2.5301 Brc1cncc(c1)CNCc2cccnc2 207a_100011249555_100000209961 [0,1,0,0,0,0|3,0,0]=4 2694 B17R2.5301 Brc1cncc(c1)CNCc2cccnc2 270004a_100000210453_100000687066 [0,1,0,0,0,0|3,0,0]=4 2695 B17R2.5301 Brc1cncc(c1)CNCc2cccnc2 270004a_100011249555_100000209961 [0,1,0,0,0,0|3,0,0]=4 2696 B17R2.5301 Brc1cncc(c1)CNCc2ccncc2 207a_100011249555_100000186114 [0,1,0,0,0,0|3,0,0]=4 2697 B17R2.5301 Brc1cncc(c1)COCc2ccccc2 34a_100000210790_100000738771 [0,1,0,0,0,0|1,0,0]=2 2698 B17R2.5301 Brc1cncc(c1)COCc2ccccc2 34a_100011259137_100015291786 [0,1,0,0,0,0|1,0,0]=2 2699 B17R2.5301 Brc1cncc(c1)COCc2ccccc2 7a_100000210790_100000738771 [0,1,0,0,0,0|1,0,0]=2 2700 B17R2.5301 Brc1cncc(c1)COCc2ccccc2 7a_100011259137_100000211182 [0,1,0,0,0,0|1,0,0]=2 2701 B17R2.5301 Brc1cncc(c1)COCc2ccccn2 34a_100011259137_100000721315 [0,1,0,0,0,0|2,0,0]=3 2702 B17R2.5301 Brc1cncc(c1)COCc2ccccn2 7a_100011259137_100000721315 [0,1,0,0,0,0|2,0,0]=3 2703 B17R2.5301 Brc1cncc(c1)COCc2cccnc2 34a_100011259137_100000733263 [0,1,0,0,0,0|2,0,0]=3 2704 B17R2.5301 Brc1cncc(c1)COCc2cccnc2 7a_100011259137_100000741622 [0,1,0,0,0,0|2,0,0]=3 2705 B17R2.5301 Brc1cncc(c1)COCc2cccnn2 34a_100011259137_100016990269 [0,1,0,0,0,0|3,0,0]=4 2706 B17R2.5301 Brc1cncc(c1)COCc2cccnn2 7a_100011259137_100016990269 [0,1,0,0,0,0|3,0,0]=4 2707 B17R2.5301 Brc1cncc(c1)COCc2ccncc2 7a_100011259137_100015193705 [0,1,0,0,0,0|2,0,0]=3 2708 B17R2.5301 Brc1cncc(c1)COCc2cnccn2 34a_100011259137_100016995436 [0,1,0,0,0,0|3,0,0]=4 2709 B17R2.5301 Brc1cncc(c1)COCc2cnccn2 7a_100011259137_100016995436 [0,1,0,0,0,0|3,0,0]=4 2710 B17R2.5301 Brc1cncc(c1)COCc2cncnc2 34a_100011259137_100015196519 [0,1,0,0,0,0|3,0,0]=4 2711 B17R2.5301 Brc1cncc(c1)COCc2cncnc2 7a_100011259137_100015196519 [0,1,0,0,0,0|3,0,0]=4 2712 B17R2.5301 Brc1cncc(c1)COCc2ncccn2 34a_100011259137_100000703007 [0,1,0,0,0,0|3,0,0]=4 2713 B17R2.5301 Brc1cncc(c1)COCc2ncccn2 7a_100011259137_100000703007 [0,1,0,0,0,0|3,0,0]=4 2714 B17R2.5301 Brc1cncc(c1)CSCc2ccccc2 62a_100000211182_100000738771 [0,1,0,0,0,0|1,1,0]=3 2715 B17R2.5301 Brc1cncc(c1)CSCc2ccccc2 62a_100000738771_100015291786 [0,1,0,0,0,0|1,1,0]=3 2716 B17R2.5301 Brc1cncc(c1)CSCc2ccccn2 62a_100000721315_100000738771 [0,1,0,0,0,0|2,1,0]=4 2717 B17R2.5301 Brc1cncc(c1)CSCc2ccccn2 62a_100000738771_100000721315 [0,1,0,0,0,0|2,1,0]=4 2718 B17R2.5301 Brc1cncc(c1)CSCc2cccnc2 62a_100000738771_100000741622 [0,1,0,0,0,0|2,1,0]=4 2719 B17R2.5301 Brc1cncc(c1)CSCc2cccnc2 62a_100000741622_100000738771 [0,1,0,0,0,0|2,1,0]=4 2720 B17R2.5301 Brc1cncc(c1)CSCc2ccncc2 62a_100000738771_100015193705 [0,1,0,0,0,0|2,1,0]=4 2721 B17R2.5301 Brc1cncc(c1)CSCc2ccncc2 62a_100015193705_100000738771 [0,1,0,0,0,0|2,1,0]=4 2722 B17R2.5301 Brc1cncc(c1)OCCc2ccccc2 34a_100000754920_100000765856 [0,1,0,0,0,0|3,0,0]=4 2723 B17R2.5301 Brc1cncc(c1)OCCc2ccccc2 7a_100000754920_100000765856 [0,1,0,0,0,0|3,0,0]=4 2724 B17R2.5301 Brc1cncc(c1)SCCc2ccccc2 62a_100000728054_100011218657 [0,1,0,0,0,0|3,0,0]=4 2725 B17R2.5301 Brc1cncc(c1)SCCc2ccccc2 62a_100000765856_100000728054 [0,1,0,0,0,0|3,0,0]=4 2726 B17R2.5301 C[n+]1cccc(c1)C=CCc2ccccc2 271570a_200016263579_100009996589 [0,1,0,0,0,0|2,0,1]=4 2727 B17R2.5301 C[n+]1cccc(c1)SCCc2ccccc2 62a_100000765856_100009996589 [0,1,0,0,0,0|3,0,0]=4 2728 B17R2.5301 C[n+]1cccc(c1)SCCc2ccccc2 62a_100009996589_100011218657 [0,1,0,0,0,0|3,0,0]=4 2729 B17R2.5301 Cc1cc(ccn1)C=CCc2ccccc2 271570a_200016263579_100000758586 [0,1,0,0,0,0|2,0,1]=4 2730 B17R2.5301 Cc1cc(ccn1)CNCc2ccccc2 207a_100011934566_100015611070 [0,1,0,0,0,0|2,0,0]=3 2731 B17R2.5301 Cc1cc(ccn1)CNCc2ccccc2 207a_100015324214_100011361630 [0,1,0,0,0,0|2,0,0]=3 2732 B17R2.5301 Cc1cc(ccn1)CNCc2ccccc2 2230a_100015324214_200020672517 [0,1,0,0,0,0|2,0,0]=3 2733 B17R2.5301 Cc1cc(ccn1)CNCc2ccccc2 270004a_100011934566_100015611070 [0,1,0,0,0,0|2,0,0]=3 2734 B17R2.5301 Cc1cc(ccn1)CNCc2ccccc2 270004a_100015324214_100011361630 [0,1,0,0,0,0|2,0,0]=3 2735 B17R2.5301 Cc1cc(ccn1)CNCc2ccccc2 34a_100011934566_100015291786 [0,1,0,0,0,0|2,0,0]=3 2736 B17R2.5301 Cc1cc(ccn1)CNCc2ccccc2 34a_100015324214_200020672517 [0,1,0,0,0,0|2,0,0]=3 2737 B17R2.5301 Cc1cc(ccn1)CNCc2ccccn2 207a_100011934566_100000209966 [0,1,0,0,0,0|3,0,0]=4 2738 B17R2.5301 Cc1cc(ccn1)CNCc2ccccn2 270004a_100000210449_100011361630 [0,1,0,0,0,0|3,0,0]=4 2739 B17R2.5301 Cc1cc(ccn1)CNCc2ccccn2 270004a_100011934566_100000209966 [0,1,0,0,0,0|3,0,0]=4 2740 B17R2.5301 Cc1cc(ccn1)CNCc2ccccn2 34a_100011934566_100000721315 [0,1,0,0,0,0|3,0,0]=4 2741 B17R2.5301 Cc1cc(ccn1)CNCc2cccnc2 207a_100000210453_100011361630 [0,1,0,0,0,0|3,0,0]=4 2742 B17R2.5301 Cc1cc(ccn1)CNCc2cccnc2 207a_100011934566_100000209961 [0,1,0,0,0,0|3,0,0]=4 2743 B17R2.5301 Cc1cc(ccn1)CNCc2cccnc2 270004a_100000210453_100011361630 [0,1,0,0,0,0|3,0,0]=4 2744 B17R2.5301 Cc1cc(ccn1)CNCc2cccnc2 270004a_100011934566_100000209961 [0,1,0,0,0,0|3,0,0]=4 2745 B17R2.5301 Cc1cc(ccn1)CNCc2cccnc2 34a_100011934566_100000733263 [0,1,0,0,0,0|3,0,0]=4 2746 B17R2.5301 Cc1cc(ccn1)CNCc2ccncc2 207a_100011934566_100000186114 [0,1,0,0,0,0|3,0,0]=4 2747 B17R2.5301 Cc1cc(ccn1)COCc2ccccc2 34a_100000210790_200020672517 [0,1,0,0,0,0|1,0,0]=2 2748 B17R2.5301 Cc1cc(ccn1)COCc2ccccc2 34a_100011998630_100015291786 [0,1,0,0,0,0|1,0,0]=2 2749 B17R2.5301 Cc1cc(ccn1)COCc2ccccc2 7a_100000210790_200020672517 [0,1,0,0,0,0|1,0,0]=2 2750 B17R2.5301 Cc1cc(ccn1)COCc2ccccn2 34a_100011998630_100000721315 [0,1,0,0,0,0|2,0,0]=3 2751 B17R2.5301 Cc1cc(ccn1)COCc2cccnc2 34a_100011998630_100000733263 [0,1,0,0,0,0|2,0,0]=3 2752 B17R2.5301 Cc1cc(ccn1)COCc2cccnn2 34a_100011998630_100016990269 [0,1,0,0,0,0|3,0,0]=4 2753 B17R2.5301 Cc1cc(ccn1)COCc2cnccn2 34a_100011998630_100016995436 [0,1,0,0,0,0|3,0,0]=4 2754 B17R2.5301 Cc1cc(ccn1)COCc2cncnc2 34a_100011998630_100015196519 [0,1,0,0,0,0|3,0,0]=4 2755 B17R2.5301 Cc1cc(ccn1)COCc2ncccn2 34a_100011998630_100000703007 [0,1,0,0,0,0|3,0,0]=4 2756 B17R2.5301 Cc1cc(ccn1)CSCc2ccccc2 62a_100000211182_200020672517 [0,1,0,0,0,0|1,1,0]=3 2757 B17R2.5301 Cc1cc(ccn1)CSCc2ccccc2 62a_200020672517_100015291786 [0,1,0,0,0,0|1,1,0]=3 2758 B17R2.5301 Cc1cc(ccn1)CSCc2ccccn2 62a_100000721315_200020672517 [0,1,0,0,0,0|2,1,0]=4 2759 B17R2.5301 Cc1cc(ccn1)CSCc2ccccn2 62a_200020672517_100000721315 [0,1,0,0,0,0|2,1,0]=4 2760 B17R2.5301 Cc1cc(ccn1)CSCc2cccnc2 62a_100000741622_200020672517 [0,1,0,0,0,0|2,1,0]=4 2761 B17R2.5301 Cc1cc(ccn1)CSCc2cccnc2 62a_200020672517_100000741622 [0,1,0,0,0,0|2,1,0]=4 2762 B17R2.5301 Cc1cc(ccn1)CSCc2ccncc2 62a_100015193705_200020672517 [0,1,0,0,0,0|2,1,0]=4 2763 B17R2.5301 Cc1cc(ccn1)CSCc2ccncc2 62a_200020672517_100015193705 [0,1,0,0,0,0|2,1,0]=4 2764 B17R2.5301 Cc1cc(ccn1)NCCc2ccccc2 27a_100000106460_100000758586 [0,1,0,0,0,0|3,0,0]=4 2765 B17R2.5301 Cc1cc(ccn1)OCCc2ccccc2 34a_100000688365_100000765856 [0,1,0,0,0,0|3,0,0]=4 2766 B17R2.5301 Cc1cc(ccn1)SCCc2ccccc2 62a_100000758586_100011218657 [0,1,0,0,0,0|3,0,0]=4 2767 B17R2.5301 Cc1cc(ccn1)SCCc2ccccc2 62a_100000765856_100000758586 [0,1,0,0,0,0|3,0,0]=4 2768 B17R2.5301 Cc1cccc(c1)C=CCc2ccccc2 271570a_200016263579_100011215228 [0,1,0,0,0,0|1,0,1]=3 2769 B17R2.5301 Cc1cccc(c1)C=NNc2ccccc2 4a_100015195140_100000211157 [0,1,0,0,0,0|2,0,1]=4 2770 B17R2.5301 Cc1cccc(c1)CCNc2ccccc2 34a_100000106764_100011713685 [0,1,0,0,0,0|2,0,0]=3 2771 B17R2.5301 Cc1cccc(c1)CCOc2ccccc2 34a_100000210340_100011713685 [0,1,0,0,0,0|2,0,0]=3 2772 B17R2.5301 Cc1cccc(c1)CCOc2ccccc2 7a_100000210340_100011713685 [0,1,0,0,0,0|2,0,0]=3 2773 B17R2.5301 Cc1cccc(c1)CCOc2cccnc2 34a_100000210849_100011713685 [0,1,0,0,0,0|3,0,0]=4 2774 B17R2.5301 Cc1cccc(c1)CCOc2cccnc2 7a_100000210849_100011713685 [0,1,0,0,0,0|3,0,0]=4 2775 B17R2.5301 Cc1cccc(c1)CCOc2ccncc2 34a_100000212176_100011713685 [0,1,0,0,0,0|3,0,0]=4 2776 B17R2.5301 Cc1cccc(c1)CCSc2ccccc2 62a_100000719477_100011713685 [0,1,0,0,0,0|2,0,0]=3 2777 B17R2.5301 Cc1cccc(c1)CCSc2ccccc2 62a_100011713685_100000041952 [0,1,0,0,0,0|2,0,0]=3 2778 B17R2.5301 Cc1cccc(c1)CCSc2ccccn2 62a_100011216584_100011713685 [0,1,0,0,0,0|3,0,0]=4 2779 B17R2.5301 Cc1cccc(c1)CCSc2ccccn2 62a_100011713685_100011216584 [0,1,0,0,0,0|3,0,0]=4 2780 B17R2.5301 Cc1cccc(c1)CCSc2cccnc2 62a_100000210063_100011713685 [0,1,0,0,0,0|3,0,0]=4 2781 B17R2.5301 Cc1cccc(c1)CCSc2cccnc2 62a_100011713685_100000210063 [0,1,0,0,0,0|3,0,0]=4 2782 B17R2.5301 Cc1cccc(c1)CCSc2ccncc2 62a_100000728582_100011713685 [0,1,0,0,0,0|3,0,0]=4 2783 B17R2.5301 Cc1cccc(c1)CCSc2ccncc2 62a_100011713685_100000728582 [0,1,0,0,0,0|3,0,0]=4 2784 B17R2.5301 Cc1cccc(c1)CNCc2ccccc2 207a_100000185548_100015611070 [0,1,0,0,0,0|1,0,0]=2 2785 B17R2.5301 Cc1cccc(c1)CNCc2ccccc2 207a_100015324214_100000211157 [0,1,0,0,0,0|1,0,0]=2 2786 B17R2.5301 Cc1cccc(c1)CNCc2ccccc2 2230a_100000185548_100015291786 [0,1,0,0,0,0|1,0,0]=2 2787 B17R2.5301 Cc1cccc(c1)CNCc2ccccc2 2230a_100015324214_100000211840 [0,1,0,0,0,0|1,0,0]=2 2788 B17R2.5301 Cc1cccc(c1)CNCc2ccccc2 270004a_100000185548_100015611070 [0,1,0,0,0,0|1,0,0]=2 2789 B17R2.5301 Cc1cccc(c1)CNCc2ccccc2 270004a_100015324214_100000211157 [0,1,0,0,0,0|1,0,0]=2 2790 B17R2.5301 Cc1cccc(c1)CNCc2ccccc2 34a_100000185548_100015291786 [0,1,0,0,0,0|1,0,0]=2 2791 B17R2.5301 Cc1cccc(c1)CNCc2ccccc2 34a_100015324214_100000211840 [0,1,0,0,0,0|1,0,0]=2 2792 B17R2.5301 Cc1cccc(c1)CNCc2ccccn2 207a_100000185548_100000209966 [0,1,0,0,0,0|2,0,0]=3 2793 B17R2.5301 Cc1cccc(c1)CNCc2ccccn2 2230a_100000185548_100000721315 [0,1,0,0,0,0|2,0,0]=3 2794 B17R2.5301 Cc1cccc(c1)CNCc2ccccn2 270004a_100000185548_100000209966 [0,1,0,0,0,0|2,0,0]=3 2795 B17R2.5301 Cc1cccc(c1)CNCc2ccccn2 270004a_100000210449_100000211157 [0,1,0,0,0,0|2,0,0]=3 2796 B17R2.5301 Cc1cccc(c1)CNCc2ccccn2 34a_100000185548_100000721315 [0,1,0,0,0,0|2,0,0]=3 2797 B17R2.5301 Cc1cccc(c1)CNCc2cccnc2 207a_100000185548_100000209961 [0,1,0,0,0,0|2,0,0]=3 2798 B17R2.5301 Cc1cccc(c1)CNCc2cccnc2 207a_100000210453_100000211157 [0,1,0,0,0,0|2,0,0]=3 2799 B17R2.5301 Cc1cccc(c1)CNCc2cccnc2 2230a_100000185548_100000741622 [0,1,0,0,0,0|2,0,0]=3 2800 B17R2.5301 Cc1cccc(c1)CNCc2cccnc2 270004a_100000185548_100000209961 [0,1,0,0,0,0|2,0,0]=3 2801 B17R2.5301 Cc1cccc(c1)CNCc2cccnc2 270004a_100000210453_100000211157 [0,1,0,0,0,0|2,0,0]=3 2802 B17R2.5301 Cc1cccc(c1)CNCc2cccnc2 34a_100000185548_100000733263 [0,1,0,0,0,0|2,0,0]=3 2803 B17R2.5301 Cc1cccc(c1)CNCc2cccnn2 2230a_100000185548_100016990269 [0,1,0,0,0,0|3,0,0]=4 2804 B17R2.5301 Cc1cccc(c1)CNCc2cccnn2 2230a_100159270163_100000211840 [0,1,0,0,0,0|3,0,0]=4 2805 B17R2.5301 Cc1cccc(c1)CNCc2cccnn2 34a_100000185548_100016990269 [0,1,0,0,0,0|3,0,0]=4 2806 B17R2.5301 Cc1cccc(c1)CNCc2ccncc2 207a_100000185548_100000186114 [0,1,0,0,0,0|2,0,0]=3 2807 B17R2.5301 Cc1cccc(c1)CNCc2ccncc2 2230a_100000185548_100015193705 [0,1,0,0,0,0|2,0,0]=3 2808 B17R2.5301 Cc1cccc(c1)CNCc2ccnnc2 270004a_100000185548_100011934578 [0,1,0,0,0,0|3,0,0]=4 2809 B17R2.5301 Cc1cccc(c1)CNCc2cnccn2 2230a_100000185548_100016995436 [0,1,0,0,0,0|3,0,0]=4 2810 B17R2.5301 Cc1cccc(c1)CNCc2cnccn2 270004a_100000185548_100000749867 [0,1,0,0,0,0|3,0,0]=4 2811 B17R2.5301 Cc1cccc(c1)CNCc2cnccn2 34a_100000185548_100016995436 [0,1,0,0,0,0|3,0,0]=4 2812 B17R2.5301 Cc1cccc(c1)CNCc2cncnc2 207a_100011243677_100000211157 [0,1,0,0,0,0|3,0,0]=4 2813 B17R2.5301 Cc1cccc(c1)CNCc2cncnc2 2230a_100000185548_100015196519 [0,1,0,0,0,0|3,0,0]=4 2814 B17R2.5301 Cc1cccc(c1)CNCc2cncnc2 2230a_100011243677_100000211840 [0,1,0,0,0,0|3,0,0]=4 2815 B17R2.5301 Cc1cccc(c1)CNCc2cncnc2 270004a_100000185548_100000749868 [0,1,0,0,0,0|3,0,0]=4 2816 B17R2.5301 Cc1cccc(c1)CNCc2cncnc2 270004a_100011243677_100000211157 [0,1,0,0,0,0|3,0,0]=4 2817 B17R2.5301 Cc1cccc(c1)CNCc2cncnc2 34a_100000185548_100015196519 [0,1,0,0,0,0|3,0,0]=4 2818 B17R2.5301 Cc1cccc(c1)CNCc2ncccn2 2230a_100000185548_100000703007 [0,1,0,0,0,0|3,0,0]=4 2819 B17R2.5301 Cc1cccc(c1)CNCc2ncccn2 270004a_100000185548_100011532527 [0,1,0,0,0,0|3,0,0]=4 2820 B17R2.5301 Cc1cccc(c1)CNCc2ncccn2 34a_100000185548_100000703007 [0,1,0,0,0,0|3,0,0]=4 2821 B17R2.5301 Cc1cccc(c1)COCc2ccccc2 34a_100000210790_100000211840 [0,1,0,0,0,0|0,0,0]=1 2822 B17R2.5301 Cc1cccc(c1)COCc2ccccc2 34a_100011217746_100015291786 [0,1,0,0,0,0|0,0,0]=1 2823 B17R2.5301 Cc1cccc(c1)COCc2ccccc2 7a_100000210790_100000211840 [0,1,0,0,0,0|0,0,0]=1 2824 B17R2.5301 Cc1cccc(c1)COCc2ccccc2 7a_100011217746_100000211182 [0,1,0,0,0,0|0,0,0]=1 2825 B17R2.5301 Cc1cccc(c1)COCc2ccccn2 34a_100011217746_100000721315 [0,1,0,0,0,0|1,0,0]=2 2826 B17R2.5301 Cc1cccc(c1)COCc2ccccn2 7a_100011217746_100000721315 [0,1,0,0,0,0|1,0,0]=2 2827 B17R2.5301 Cc1cccc(c1)COCc2cccnc2 34a_100011217746_100000733263 [0,1,0,0,0,0|1,0,0]=2 2828 B17R2.5301 Cc1cccc(c1)COCc2cccnc2 7a_100011217746_100000741622 [0,1,0,0,0,0|1,0,0]=2 2829 B17R2.5301 Cc1cccc(c1)COCc2cccnn2 34a_100011217746_100016990269 [0,1,0,0,0,0|2,0,0]=3 2830 B17R2.5301 Cc1cccc(c1)COCc2cccnn2 7a_100011217746_100016990269 [0,1,0,0,0,0|2,0,0]=3 2831 B17R2.5301 Cc1cccc(c1)COCc2ccncc2 7a_100011217746_100015193705 [0,1,0,0,0,0|1,0,0]=2 2832 B17R2.5301 Cc1cccc(c1)COCc2cnccn2 34a_100011217746_100016995436 [0,1,0,0,0,0|2,0,0]=3 2833 B17R2.5301 Cc1cccc(c1)COCc2cnccn2 7a_100011217746_100016995436 [0,1,0,0,0,0|2,0,0]=3 2834 B17R2.5301 Cc1cccc(c1)COCc2cncnc2 34a_100011217746_100015196519 [0,1,0,0,0,0|2,0,0]=3 2835 B17R2.5301 Cc1cccc(c1)COCc2cncnc2 7a_100011217746_100015196519 [0,1,0,0,0,0|2,0,0]=3 2836 B17R2.5301 Cc1cccc(c1)COCc2ncccn2 34a_100011217746_100000703007 [0,1,0,0,0,0|2,0,0]=3 2837 B17R2.5301 Cc1cccc(c1)COCc2ncccn2 7a_100011217746_100000703007 [0,1,0,0,0,0|2,0,0]=3 2838 B17R2.5301 Cc1cccc(c1)CSCc2ccccc2 62a_100000211182_100000211840 [0,1,0,0,0,0|0,1,0]=2 2839 B17R2.5301 Cc1cccc(c1)CSCc2ccccc2 62a_100000211840_100015291786 [0,1,0,0,0,0|0,1,0]=2 2840 B17R2.5301 Cc1cccc(c1)CSCc2ccccn2 62a_100000211840_100000721315 [0,1,0,0,0,0|1,1,0]=3 2841 B17R2.5301 Cc1cccc(c1)CSCc2ccccn2 62a_100000721315_100000211840 [0,1,0,0,0,0|1,1,0]=3 2842 B17R2.5301 Cc1cccc(c1)CSCc2cccnc2 62a_100000211840_100000741622 [0,1,0,0,0,0|1,1,0]=3 2843 B17R2.5301 Cc1cccc(c1)CSCc2cccnc2 62a_100000741622_100000211840 [0,1,0,0,0,0|1,1,0]=3 2844 B17R2.5301 Cc1cccc(c1)CSCc2cccnn2 62a_100000211840_100016990269 [0,1,0,0,0,0|2,1,0]=4 2845 B17R2.5301 Cc1cccc(c1)CSCc2cccnn2 62a_100016990269_100000211840 [0,1,0,0,0,0|2,1,0]=4 2846 B17R2.5301 Cc1cccc(c1)CSCc2ccncc2 62a_100000211840_100015193705 [0,1,0,0,0,0|1,1,0]=3 2847 B17R2.5301 Cc1cccc(c1)CSCc2ccncc2 62a_100015193705_100000211840 [0,1,0,0,0,0|1,1,0]=3 2848 B17R2.5301 Cc1cccc(c1)CSCc2cnccn2 62a_100000211840_100016995436 [0,1,0,0,0,0|2,1,0]=4 2849 B17R2.5301 Cc1cccc(c1)CSCc2cnccn2 62a_100016995436_100000211840 [0,1,0,0,0,0|2,1,0]=4 2850 B17R2.5301 Cc1cccc(c1)CSCc2cncnc2 62a_100000211840_100015196519 [0,1,0,0,0,0|2,1,0]=4 2851 B17R2.5301 Cc1cccc(c1)CSCc2cncnc2 62a_100015196519_100000211840 [0,1,0,0,0,0|2,1,0]=4 2852 B17R2.5301 Cc1cccc(c1)CSCc2ncccn2 62a_100000211840_100000703007 [0,1,0,0,0,0|2,1,0]=4 2853 B17R2.5301 Cc1cccc(c1)CSCc2ncccn2 62a_100000703007_100000211840 [0,1,0,0,0,0|2,1,0]=4 2854 B17R2.5301 Cc1cccc(c1)NCCc2ccccc2 2230a_100000188690_100000765856 [0,1,0,0,0,0|2,0,0]=3 2855 B17R2.5301 Cc1cccc(c1)NCCc2ccccc2 34a_100000188690_100000765856 [0,1,0,0,0,0|2,0,0]=3 2856 B17R2.5301 Cc1cccc(c1)NCCc2ccccn2 2230a_100000188690_100015183660 [0,1,0,0,0,0|3,0,0]=4 2857 B17R2.5301 Cc1cccc(c1)NCCc2cccnc2 2230a_100000188690_200011713674 [0,1,0,0,0,0|3,0,0]=4 2858 B17R2.5301 Cc1cccc(c1)NCCc2ccncc2 2230a_100000188690_100000723409 [0,1,0,0,0,0|3,0,0]=4 2859 B17R2.5301 Cc1cccc(c1)NCSc2ccccc2 2230a_100000188690_100011218342 [0,1,0,0,0,0|3,0,0]=4 2860 B17R2.5301 Cc1cccc(c1)NN=Cc2ccccc2 4a_100000681630_100015611070 [0,1,0,0,0,0|2,0,1]=4 2861 B17R2.5301 Cc1cccc(c1)OCCc2ccccc2 34a_100000210337_100000765856 [0,1,0,0,0,0|2,0,0]=3 2862 B17R2.5301 Cc1cccc(c1)OCCc2ccccc2 7a_100000210337_100000765856 [0,1,0,0,0,0|2,0,0]=3 2863 B17R2.5301 Cc1cccc(c1)OCCc2ccccn2 7a_100000210337_100015183660 [0,1,0,0,0,0|3,0,0]=4 2864 B17R2.5301 Cc1cccc(c1)OCCc2cccnc2 7a_100000210337_200011713674 [0,1,0,0,0,0|3,0,0]=4 2865 B17R2.5301 Cc1cccc(c1)OCCc2ccncc2 7a_100000210337_100000723409 [0,1,0,0,0,0|3,0,0]=4 2866 B17R2.5301 Cc1cccc(c1)SCCc2ccccc2 62a_100000765856_100011215228 [0,1,0,0,0,0|2,0,0]=3 2867 B17R2.5301 Cc1cccc(c1)SCCc2ccccc2 62a_100011215228_100011218657 [0,1,0,0,0,0|2,0,0]=3 2868 B17R2.5301 Cc1cccc(c1)SCCc2ccccn2 62a_100011215228_100015183660 [0,1,0,0,0,0|3,0,0]=4 2869 B17R2.5301 Cc1cccc(c1)SCCc2ccccn2 62a_100015183660_100011215228 [0,1,0,0,0,0|3,0,0]=4 2870 B17R2.5301 Cc1cccc(c1)SCCc2cccnc2 62a_100011215228_200011713674 [0,1,0,0,0,0|3,0,0]=4 2871 B17R2.5301 Cc1cccc(c1)SCCc2cccnc2 62a_200011713674_100011215228 [0,1,0,0,0,0|3,0,0]=4 2872 B17R2.5301 Cc1cccc(c1)SCCc2ccncc2 62a_100000723409_100011215228 [0,1,0,0,0,0|3,0,0]=4 2873 B17R2.5301 Cc1cccc(c1)SCCc2ccncc2 62a_100011215228_100000723409 [0,1,0,0,0,0|3,0,0]=4 2874 B17R2.5301 Cc1cccc(c1)SCSc2ccccc2 62a_100011215228_100011218342 [0,1,0,0,0,0|3,0,0]=4 2875 B17R2.5301 Cc1cccc(c1)SCSc2ccccc2 62a_100011218342_100011215228 [0,1,0,0,0,0|3,0,0]=4 2876 B17R2.5301 Cc1cccc(n1)C=CCc2ccccc2 271570a_200016263579_100000742759 [0,1,0,0,0,0|2,0,1]=4 2877 B17R2.5301 Cc1cccc(n1)CNCc2ccccc2 207a_100015324214_100011215050 [0,1,0,0,0,0|2,0,0]=3 2878 B17R2.5301 Cc1cccc(n1)CNCc2ccccc2 2230a_100015324214_100000757606 [0,1,0,0,0,0|2,0,0]=3 2879 B17R2.5301 Cc1cccc(n1)CNCc2ccccc2 270004a_100015324214_100011215050 [0,1,0,0,0,0|2,0,0]=3 2880 B17R2.5301 Cc1cccc(n1)CNCc2ccccc2 34a_100000701342_100015291786 [0,1,0,0,0,0|2,0,0]=3 2881 B17R2.5301 Cc1cccc(n1)CNCc2ccccc2 34a_100015324214_100000757606 [0,1,0,0,0,0|2,0,0]=3 2882 B17R2.5301 Cc1cccc(n1)CNCc2ccccn2 270004a_100000210449_100011215050 [0,1,0,0,0,0|3,0,0]=4 2883 B17R2.5301 Cc1cccc(n1)CNCc2ccccn2 34a_100000701342_100000721315 [0,1,0,0,0,0|3,0,0]=4 2884 B17R2.5301 Cc1cccc(n1)CNCc2cccnc2 207a_100000210453_100011215050 [0,1,0,0,0,0|3,0,0]=4 2885 B17R2.5301 Cc1cccc(n1)CNCc2cccnc2 270004a_100000210453_100011215050 [0,1,0,0,0,0|3,0,0]=4 2886 B17R2.5301 Cc1cccc(n1)CNCc2cccnc2 34a_100000701342_100000733263 [0,1,0,0,0,0|3,0,0]=4 2887 B17R2.5301 Cc1cccc(n1)COCc2ccccc2 34a_100000210790_100000757606 [0,1,0,0,0,0|1,0,0]=2 2888 B17R2.5301 Cc1cccc(n1)COCc2ccccc2 34a_100000690600_100015291786 [0,1,0,0,0,0|1,0,0]=2 2889 B17R2.5301 Cc1cccc(n1)COCc2ccccc2 7a_100000210790_100000757606 [0,1,0,0,0,0|1,0,0]=2 2890 B17R2.5301 Cc1cccc(n1)COCc2ccccn2 34a_100000690600_100000721315 [0,1,0,0,0,0|2,0,0]=3 2891 B17R2.5301 Cc1cccc(n1)COCc2cccnc2 34a_100000690600_100000733263 [0,1,0,0,0,0|2,0,0]=3 2892 B17R2.5301 Cc1cccc(n1)COCc2cccnn2 34a_100000690600_100016990269 [0,1,0,0,0,0|3,0,0]=4 2893 B17R2.5301 Cc1cccc(n1)COCc2cnccn2 34a_100000690600_100016995436 [0,1,0,0,0,0|3,0,0]=4 2894 B17R2.5301 Cc1cccc(n1)COCc2cncnc2 34a_100000690600_100015196519 [0,1,0,0,0,0|3,0,0]=4 2895 B17R2.5301 Cc1cccc(n1)COCc2ncccn2 34a_100000690600_100000703007 [0,1,0,0,0,0|3,0,0]=4 2896 B17R2.5301 Cc1cccc(n1)CSCc2ccccc2 62a_100000211182_100000757606 [0,1,0,0,0,0|1,1,0]=3 2897 B17R2.5301 Cc1cccc(n1)CSCc2ccccc2 62a_100000757606_100015291786 [0,1,0,0,0,0|1,1,0]=3 2898 B17R2.5301 Cc1cccc(n1)CSCc2ccccn2 62a_100000721315_100000757606 [0,1,0,0,0,0|2,1,0]=4 2899 B17R2.5301 Cc1cccc(n1)CSCc2ccccn2 62a_100000757606_100000721315 [0,1,0,0,0,0|2,1,0]=4 2900 B17R2.5301 Cc1cccc(n1)CSCc2cccnc2 62a_100000741622_100000757606 [0,1,0,0,0,0|2,1,0]=4 2901 B17R2.5301 Cc1cccc(n1)CSCc2cccnc2 62a_100000757606_100000741622 [0,1,0,0,0,0|2,1,0]=4 2902 B17R2.5301 Cc1cccc(n1)CSCc2ccncc2 62a_100000757606_100015193705 [0,1,0,0,0,0|2,1,0]=4 2903 B17R2.5301 Cc1cccc(n1)CSCc2ccncc2 62a_100015193705_100000757606 [0,1,0,0,0,0|2,1,0]=4 2904 B17R2.5301 Cc1cccc(n1)SCCc2ccccc2 62a_100000742759_100011218657 [0,1,0,0,0,0|3,0,0]=4 2905 B17R2.5301 Cc1cccc(n1)SCCc2ccccc2 62a_100000765856_100000742759 [0,1,0,0,0,0|3,0,0]=4 2906 B17R2.5301 Cc1ccnc(c1)C=CCc2ccccc2 271570a_200016263579_100000750283 [0,1,0,0,0,0|2,0,1]=4 2907 B17R2.5301 Cc1ccnc(c1)CNCc2ccccc2 207a_100015324214_100011361488 [0,1,0,0,0,0|2,0,0]=3 2908 B17R2.5301 Cc1ccnc(c1)CNCc2ccccc2 2230a_100015324214_100000718516 [0,1,0,0,0,0|2,0,0]=3 2909 B17R2.5301 Cc1ccnc(c1)CNCc2ccccc2 270004a_100015324214_100011361488 [0,1,0,0,0,0|2,0,0]=3 2910 B17R2.5301 Cc1ccnc(c1)CNCc2ccccc2 34a_100015324214_100000718516 [0,1,0,0,0,0|2,0,0]=3 2911 B17R2.5301 Cc1ccnc(c1)CNCc2ccccn2 270004a_100000210449_100011361488 [0,1,0,0,0,0|3,0,0]=4 2912 B17R2.5301 Cc1ccnc(c1)CNCc2cccnc2 207a_100000210453_100011361488 [0,1,0,0,0,0|3,0,0]=4 2913 B17R2.5301 Cc1ccnc(c1)CNCc2cccnc2 270004a_100000210453_100011361488 [0,1,0,0,0,0|3,0,0]=4 2914 B17R2.5301 Cc1ccnc(c1)COCc2ccccc2 34a_100000210790_100000718516 [0,1,0,0,0,0|1,0,0]=2 2915 B17R2.5301 Cc1ccnc(c1)COCc2ccccc2 34a_100011998357_100015291786 [0,1,0,0,0,0|1,0,0]=2 2916 B17R2.5301 Cc1ccnc(c1)COCc2ccccc2 7a_100000210790_100000718516 [0,1,0,0,0,0|1,0,0]=2 2917 B17R2.5301 Cc1ccnc(c1)COCc2ccccn2 34a_100011998357_100000721315 [0,1,0,0,0,0|2,0,0]=3 2918 B17R2.5301 Cc1ccnc(c1)COCc2cccnc2 34a_100011998357_100000733263 [0,1,0,0,0,0|2,0,0]=3 2919 B17R2.5301 Cc1ccnc(c1)COCc2cccnn2 34a_100011998357_100016990269 [0,1,0,0,0,0|3,0,0]=4 2920 B17R2.5301 Cc1ccnc(c1)COCc2cnccn2 34a_100011998357_100016995436 [0,1,0,0,0,0|3,0,0]=4 2921 B17R2.5301 Cc1ccnc(c1)COCc2cncnc2 34a_100011998357_100015196519 [0,1,0,0,0,0|3,0,0]=4 2922 B17R2.5301 Cc1ccnc(c1)COCc2ncccn2 34a_100011998357_100000703007 [0,1,0,0,0,0|3,0,0]=4 2923 B17R2.5301 Cc1ccnc(c1)CSCc2ccccc2 62a_100000211182_100000718516 [0,1,0,0,0,0|1,1,0]=3 2924 B17R2.5301 Cc1ccnc(c1)CSCc2ccccc2 62a_100000718516_100015291786 [0,1,0,0,0,0|1,1,0]=3 2925 B17R2.5301 Cc1ccnc(c1)CSCc2ccccn2 62a_100000718516_100000721315 [0,1,0,0,0,0|2,1,0]=4 2926 B17R2.5301 Cc1ccnc(c1)CSCc2ccccn2 62a_100000721315_100000718516 [0,1,0,0,0,0|2,1,0]=4 2927 B17R2.5301 Cc1ccnc(c1)CSCc2cccnc2 62a_100000718516_100000741622 [0,1,0,0,0,0|2,1,0]=4 2928 B17R2.5301 Cc1ccnc(c1)CSCc2cccnc2 62a_100000741622_100000718516 [0,1,0,0,0,0|2,1,0]=4 2929 B17R2.5301 Cc1ccnc(c1)CSCc2ccncc2 62a_100000718516_100015193705 [0,1,0,0,0,0|2,1,0]=4 2930 B17R2.5301 Cc1ccnc(c1)CSCc2ccncc2 62a_100015193705_100000718516 [0,1,0,0,0,0|2,1,0]=4 2931 B17R2.5301 Cc1ccnc(c1)SCCc2ccccc2 62a_100000750283_100011218657 [0,1,0,0,0,0|3,0,0]=4 2932 B17R2.5301 Cc1ccnc(c1)SCCc2ccccc2 62a_100000765856_100000750283 [0,1,0,0,0,0|3,0,0]=4 2933 B17R2.5301 Cc1ccnc(n1)CNCc2ccccc2 2230a_100015186494_100015291786 [0,1,0,0,0,0|3,0,0]=4 2934 B17R2.5301 Cc1cncc(c1)C=CCc2ccccc2 271570a_200016263579_100000760492 [0,1,0,0,0,0|2,0,1]=4 2935 B17R2.5301 Cc1cncc(c1)CNCc2ccccc2 207a_100000692839_100015611070 [0,1,0,0,0,0|2,0,0]=3 2936 B17R2.5301 Cc1cncc(c1)CNCc2ccccc2 207a_100015324214_100011998712 [0,1,0,0,0,0|2,0,0]=3 2937 B17R2.5301 Cc1cncc(c1)CNCc2ccccc2 2230a_100000692839_100015291786 [0,1,0,0,0,0|2,0,0]=3 2938 B17R2.5301 Cc1cncc(c1)CNCc2ccccc2 2230a_100015324214_100000716715 [0,1,0,0,0,0|2,0,0]=3 2939 B17R2.5301 Cc1cncc(c1)CNCc2ccccc2 270004a_100000692839_100015611070 [0,1,0,0,0,0|2,0,0]=3 2940 B17R2.5301 Cc1cncc(c1)CNCc2ccccc2 270004a_100015324214_100011998712 [0,1,0,0,0,0|2,0,0]=3 2941 B17R2.5301 Cc1cncc(c1)CNCc2ccccc2 34a_100000692839_100015291786 [0,1,0,0,0,0|2,0,0]=3 2942 B17R2.5301 Cc1cncc(c1)CNCc2ccccc2 34a_100015324214_100000716715 [0,1,0,0,0,0|2,0,0]=3 2943 B17R2.5301 Cc1cncc(c1)CNCc2ccccn2 207a_100000692839_100000209966 [0,1,0,0,0,0|3,0,0]=4 2944 B17R2.5301 Cc1cncc(c1)CNCc2ccccn2 2230a_100000692839_100000721315 [0,1,0,0,0,0|3,0,0]=4 2945 B17R2.5301 Cc1cncc(c1)CNCc2ccccn2 270004a_100000210449_100011998712 [0,1,0,0,0,0|3,0,0]=4 2946 B17R2.5301 Cc1cncc(c1)CNCc2ccccn2 270004a_100000692839_100000209966 [0,1,0,0,0,0|3,0,0]=4 2947 B17R2.5301 Cc1cncc(c1)CNCc2ccccn2 34a_100000692839_100000721315 [0,1,0,0,0,0|3,0,0]=4 2948 B17R2.5301 Cc1cncc(c1)CNCc2cccnc2 207a_100000210453_100011998712 [0,1,0,0,0,0|3,0,0]=4 2949 B17R2.5301 Cc1cncc(c1)CNCc2cccnc2 207a_100000692839_100000209961 [0,1,0,0,0,0|3,0,0]=4 2950 B17R2.5301 Cc1cncc(c1)CNCc2cccnc2 2230a_100000692839_100000741622 [0,1,0,0,0,0|3,0,0]=4 2951 B17R2.5301 Cc1cncc(c1)CNCc2cccnc2 270004a_100000210453_100011998712 [0,1,0,0,0,0|3,0,0]=4 2952 B17R2.5301 Cc1cncc(c1)CNCc2cccnc2 270004a_100000692839_100000209961 [0,1,0,0,0,0|3,0,0]=4 2953 B17R2.5301 Cc1cncc(c1)CNCc2cccnc2 34a_100000692839_100000733263 [0,1,0,0,0,0|3,0,0]=4 2954 B17R2.5301 Cc1cncc(c1)CNCc2ccncc2 207a_100000692839_100000186114 [0,1,0,0,0,0|3,0,0]=4 2955 B17R2.5301 Cc1cncc(c1)CNCc2ccncc2 2230a_100000692839_100015193705 [0,1,0,0,0,0|3,0,0]=4 2956 B17R2.5301 Cc1cncc(c1)COCc2ccccc2 34a_100000210790_100000716715 [0,1,0,0,0,0|1,0,0]=2 2957 B17R2.5301 Cc1cncc(c1)COCc2ccccc2 34a_100011998709_100015291786 [0,1,0,0,0,0|1,0,0]=2 2958 B17R2.5301 Cc1cncc(c1)COCc2ccccc2 7a_100000210790_100000716715 [0,1,0,0,0,0|1,0,0]=2 2959 B17R2.5301 Cc1cncc(c1)COCc2ccccc2 7a_100011998709_100000211182 [0,1,0,0,0,0|1,0,0]=2 2960 B17R2.5301 Cc1cncc(c1)COCc2ccccn2 34a_100011998709_100000721315 [0,1,0,0,0,0|2,0,0]=3 2961 B17R2.5301 Cc1cncc(c1)COCc2ccccn2 7a_100011998709_100000721315 [0,1,0,0,0,0|2,0,0]=3 2962 B17R2.5301 Cc1cncc(c1)COCc2cccnc2 34a_100011998709_100000733263 [0,1,0,0,0,0|2,0,0]=3 2963 B17R2.5301 Cc1cncc(c1)COCc2cccnc2 7a_100011998709_100000741622 [0,1,0,0,0,0|2,0,0]=3 2964 B17R2.5301 Cc1cncc(c1)COCc2cccnn2 34a_100011998709_100016990269 [0,1,0,0,0,0|3,0,0]=4 2965 B17R2.5301 Cc1cncc(c1)COCc2cccnn2 7a_100011998709_100016990269 [0,1,0,0,0,0|3,0,0]=4 2966 B17R2.5301 Cc1cncc(c1)COCc2ccncc2 7a_100011998709_100015193705 [0,1,0,0,0,0|2,0,0]=3 2967 B17R2.5301 Cc1cncc(c1)COCc2cnccn2 34a_100011998709_100016995436 [0,1,0,0,0,0|3,0,0]=4 2968 B17R2.5301 Cc1cncc(c1)COCc2cnccn2 7a_100011998709_100016995436 [0,1,0,0,0,0|3,0,0]=4 2969 B17R2.5301 Cc1cncc(c1)COCc2cncnc2 34a_100011998709_100015196519 [0,1,0,0,0,0|3,0,0]=4 2970 B17R2.5301 Cc1cncc(c1)COCc2cncnc2 7a_100011998709_100015196519 [0,1,0,0,0,0|3,0,0]=4 2971 B17R2.5301 Cc1cncc(c1)COCc2ncccn2 34a_100011998709_100000703007 [0,1,0,0,0,0|3,0,0]=4 2972 B17R2.5301 Cc1cncc(c1)COCc2ncccn2 7a_100011998709_100000703007 [0,1,0,0,0,0|3,0,0]=4 2973 B17R2.5301 Cc1cncc(c1)CSCc2ccccc2 62a_100000211182_100000716715 [0,1,0,0,0,0|1,1,0]=3 2974 B17R2.5301 Cc1cncc(c1)CSCc2ccccc2 62a_100000716715_100015291786 [0,1,0,0,0,0|1,1,0]=3 2975 B17R2.5301 Cc1cncc(c1)CSCc2ccccn2 62a_100000716715_100000721315 [0,1,0,0,0,0|2,1,0]=4 2976 B17R2.5301 Cc1cncc(c1)CSCc2ccccn2 62a_100000721315_100000716715 [0,1,0,0,0,0|2,1,0]=4 2977 B17R2.5301 Cc1cncc(c1)CSCc2cccnc2 62a_100000716715_100000741622 [0,1,0,0,0,0|2,1,0]=4 2978 B17R2.5301 Cc1cncc(c1)CSCc2cccnc2 62a_100000741622_100000716715 [0,1,0,0,0,0|2,1,0]=4 2979 B17R2.5301 Cc1cncc(c1)CSCc2ccncc2 62a_100000716715_100015193705 [0,1,0,0,0,0|2,1,0]=4 2980 B17R2.5301 Cc1cncc(c1)CSCc2ccncc2 62a_100015193705_100000716715 [0,1,0,0,0,0|2,1,0]=4 2981 B17R2.5301 Cc1cncc(c1)OCCc2ccccc2 34a_100011830280_100000765856 [0,1,0,0,0,0|3,0,0]=4 2982 B17R2.5301 Cc1cncc(c1)OCCc2ccccc2 7a_100011830280_100000765856 [0,1,0,0,0,0|3,0,0]=4 2983 B17R2.5301 Cc1cncc(c1)SCCc2ccccc2 62a_100000760492_100011218657 [0,1,0,0,0,0|3,0,0]=4 2984 B17R2.5301 Cc1cncc(c1)SCCc2ccccc2 62a_100000765856_100000760492 [0,1,0,0,0,0|3,0,0]=4 2985 B17R2.5301 Cc1cncc(n1)CNCc2ccccc2 207a_100015324214_100000100294 [0,1,0,0,0,0|3,0,0]=4 2986 B17R2.5301 Cc1cncc(n1)CNCc2ccccc2 270004a_100015324214_100000100294 [0,1,0,0,0,0|3,0,0]=4 2987 B17R2.5301 Cc1cnnc(c1)COCc2ccccc2 34a_100016212594_100015291786 [0,1,0,0,0,0|2,0,0]=3 2988 B17R2.5301 Cc1cnnc(c1)COCc2ccccn2 34a_100016212594_100000721315 [0,1,0,0,0,0|3,0,0]=4 2989 B17R2.5301 Cc1cnnc(c1)COCc2cccnc2 34a_100016212594_100000733263 [0,1,0,0,0,0|3,0,0]=4 2990 B17R2.5301 Cc1nccc(n1)CNCc2ccccc2 270004a_100015324214_100011361539 [0,1,0,0,0,0|3,0,0]=4 2991 B17R2.5301 Clc1cc(ccn1)C=CCc2ccccc2 271570a_200016263579_100000035001 [0,1,0,0,0,0|2,0,1]=4 2992 B17R2.5301 Clc1cc(ccn1)CNCc2ccccc2 2230a_100015205668_100015291786 [0,1,0,0,0,0|2,0,0]=3 2993 B17R2.5301 Clc1cc(ccn1)CNCc2ccccc2 2230a_100015324214_100000764220 [0,1,0,0,0,0|2,0,0]=3 2994 B17R2.5301 Clc1cc(ccn1)CNCc2ccccc2 270004a_100015205668_100015611070 [0,1,0,0,0,0|2,0,0]=3 2995 B17R2.5301 Clc1cc(ccn1)CNCc2ccccc2 270004a_100015324214_100011290808 [0,1,0,0,0,0|2,0,0]=3 2996 B17R2.5301 Clc1cc(ccn1)CNCc2ccccc2 34a_100015205668_100015291786 [0,1,0,0,0,0|2,0,0]=3 2997 B17R2.5301 Clc1cc(ccn1)CNCc2ccccc2 34a_100015324214_100000764220 [0,1,0,0,0,0|2,0,0]=3 2998 B17R2.5301 Clc1cc(ccn1)CNCc2ccccn2 2230a_100015205668_100000721315 [0,1,0,0,0,0|3,0,0]=4 2999 B17R2.5301 Clc1cc(ccn1)CNCc2ccccn2 270004a_100000210449_100011290808 [0,1,0,0,0,0|3,0,0]=4 3000 B17R2.5301 Clc1cc(ccn1)CNCc2ccccn2 270004a_100015205668_100000209966 [0,1,0,0,0,0|3,0,0]=4 3001 B17R2.5301 Clc1cc(ccn1)CNCc2ccccn2 34a_100015205668_100000721315 [0,1,0,0,0,0|3,0,0]=4 3002 B17R2.5301 Clc1cc(ccn1)CNCc2cccnc2 2230a_100015205668_100000741622 [0,1,0,0,0,0|3,0,0]=4 3003 B17R2.5301 Clc1cc(ccn1)CNCc2cccnc2 270004a_100000210453_100011290808 [0,1,0,0,0,0|3,0,0]=4 3004 B17R2.5301 Clc1cc(ccn1)CNCc2cccnc2 270004a_100015205668_100000209961 [0,1,0,0,0,0|3,0,0]=4 3005 B17R2.5301 Clc1cc(ccn1)CNCc2cccnc2 34a_100015205668_100000733263 [0,1,0,0,0,0|3,0,0]=4 3006 B17R2.5301 Clc1cc(ccn1)CNCc2ccncc2 2230a_100015205668_100015193705 [0,1,0,0,0,0|3,0,0]=4 3007 B17R2.5301 Clc1cc(ccn1)COCc2ccccc2 34a_100000210790_100000764220 [0,1,0,0,0,0|1,0,0]=2 3008 B17R2.5301 Clc1cc(ccn1)COCc2ccccc2 34a_100000748751_100015291786 [0,1,0,0,0,0|1,0,0]=2 3009 B17R2.5301 Clc1cc(ccn1)COCc2ccccc2 7a_100000210790_100000764220 [0,1,0,0,0,0|1,0,0]=2 3010 B17R2.5301 Clc1cc(ccn1)COCc2ccccn2 34a_100000748751_100000721315 [0,1,0,0,0,0|2,0,0]=3 3011 B17R2.5301 Clc1cc(ccn1)COCc2cccnc2 34a_100000748751_100000733263 [0,1,0,0,0,0|2,0,0]=3 3012 B17R2.5301 Clc1cc(ccn1)COCc2cccnn2 34a_100000748751_100016990269 [0,1,0,0,0,0|3,0,0]=4 3013 B17R2.5301 Clc1cc(ccn1)COCc2cnccn2 34a_100000748751_100016995436 [0,1,0,0,0,0|3,0,0]=4 3014 B17R2.5301 Clc1cc(ccn1)COCc2cncnc2 34a_100000748751_100015196519 [0,1,0,0,0,0|3,0,0]=4 3015 B17R2.5301 Clc1cc(ccn1)COCc2ncccn2 34a_100000748751_100000703007 [0,1,0,0,0,0|3,0,0]=4 3016 B17R2.5301 Clc1cc(ccn1)CSCc2ccccc2 62a_100000211182_100000764220 [0,1,0,0,0,0|1,1,0]=3 3017 B17R2.5301 Clc1cc(ccn1)CSCc2ccccc2 62a_100000764220_100015291786 [0,1,0,0,0,0|1,1,0]=3 3018 B17R2.5301 Clc1cc(ccn1)CSCc2ccccn2 62a_100000721315_100000764220 [0,1,0,0,0,0|2,1,0]=4 3019 B17R2.5301 Clc1cc(ccn1)CSCc2ccccn2 62a_100000764220_100000721315 [0,1,0,0,0,0|2,1,0]=4 3020 B17R2.5301 Clc1cc(ccn1)CSCc2cccnc2 62a_100000741622_100000764220 [0,1,0,0,0,0|2,1,0]=4 3021 B17R2.5301 Clc1cc(ccn1)CSCc2cccnc2 62a_100000764220_100000741622 [0,1,0,0,0,0|2,1,0]=4 3022 B17R2.5301 Clc1cc(ccn1)CSCc2ccncc2 62a_100000764220_100015193705 [0,1,0,0,0,0|2,1,0]=4 3023 B17R2.5301 Clc1cc(ccn1)CSCc2ccncc2 62a_100015193705_100000764220 [0,1,0,0,0,0|2,1,0]=4 3024 B17R2.5301 Clc1cc(ccn1)OCCc2ccccc2 34a_100000762945_100000765856 [0,1,0,0,0,0|3,0,0]=4 3025 B17R2.5301 Clc1cc(ccn1)SCCc2ccccc2 62a_100000035001_100011218657 [0,1,0,0,0,0|3,0,0]=4 3026 B17R2.5301 Clc1cc(ccn1)SCCc2ccccc2 62a_100000765856_100000035001 [0,1,0,0,0,0|3,0,0]=4 3027 B17R2.5301 Clc1cccc(c1)C=CCc2ccccc2 271570a_200016263579_100000699651 [0,1,0,0,0,0|1,0,1]=3 3028 B17R2.5301 Clc1cccc(c1)C=NNc2ccccc2 4a_100015195140_100000210801 [0,1,0,0,0,0|2,0,1]=4 3029 B17R2.5301 Clc1cccc(c1)CCNc2ccccc2 34a_100000106764_100011713710 [0,1,0,0,0,0|2,0,0]=3 3030 B17R2.5301 Clc1cccc(c1)CCOc2ccccc2 34a_100000210340_100011713710 [0,1,0,0,0,0|2,0,0]=3 3031 B17R2.5301 Clc1cccc(c1)CCOc2ccccc2 7a_100000210340_100011713710 [0,1,0,0,0,0|2,0,0]=3 3032 B17R2.5301 Clc1cccc(c1)CCOc2cccnc2 34a_100000210849_100011713710 [0,1,0,0,0,0|3,0,0]=4 3033 B17R2.5301 Clc1cccc(c1)CCOc2cccnc2 7a_100000210849_100011713710 [0,1,0,0,0,0|3,0,0]=4 3034 B17R2.5301 Clc1cccc(c1)CCOc2ccncc2 34a_100000212176_100011713710 [0,1,0,0,0,0|3,0,0]=4 3035 B17R2.5301 Clc1cccc(c1)CCSc2ccccc2 62a_100000719477_100011713710 [0,1,0,0,0,0|2,0,0]=3 3036 B17R2.5301 Clc1cccc(c1)CCSc2ccccc2 62a_100011713710_100000041952 [0,1,0,0,0,0|2,0,0]=3 3037 B17R2.5301 Clc1cccc(c1)CCSc2ccccn2 62a_100011216584_100011713710 [0,1,0,0,0,0|3,0,0]=4 3038 B17R2.5301 Clc1cccc(c1)CCSc2ccccn2 62a_100011713710_100011216584 [0,1,0,0,0,0|3,0,0]=4 3039 B17R2.5301 Clc1cccc(c1)CCSc2cccnc2 62a_100000210063_100011713710 [0,1,0,0,0,0|3,0,0]=4 3040 B17R2.5301 Clc1cccc(c1)CCSc2cccnc2 62a_100011713710_100000210063 [0,1,0,0,0,0|3,0,0]=4 3041 B17R2.5301 Clc1cccc(c1)CCSc2ccncc2 62a_100000728582_100011713710 [0,1,0,0,0,0|3,0,0]=4 3042 B17R2.5301 Clc1cccc(c1)CCSc2ccncc2 62a_100011713710_100000728582 [0,1,0,0,0,0|3,0,0]=4 3043 B17R2.5301 Clc1cccc(c1)CNCc2ccccc2 207a_100000174878_100015611070 [0,1,0,0,0,0|1,0,0]=2 3044 B17R2.5301 Clc1cccc(c1)CNCc2ccccc2 207a_100015324214_100000210801 [0,1,0,0,0,0|1,0,0]=2 3045 B17R2.5301 Clc1cccc(c1)CNCc2ccccc2 2230a_100000174878_100015291786 [0,1,0,0,0,0|1,0,0]=2 3046 B17R2.5301 Clc1cccc(c1)CNCc2ccccc2 2230a_100015324214_100000181238 [0,1,0,0,0,0|1,0,0]=2 3047 B17R2.5301 Clc1cccc(c1)CNCc2ccccc2 270004a_100000174878_100015611070 [0,1,0,0,0,0|1,0,0]=2 3048 B17R2.5301 Clc1cccc(c1)CNCc2ccccc2 270004a_100015324214_100000210801 [0,1,0,0,0,0|1,0,0]=2 3049 B17R2.5301 Clc1cccc(c1)CNCc2ccccc2 34a_100000174878_100015291786 [0,1,0,0,0,0|1,0,0]=2 3050 B17R2.5301 Clc1cccc(c1)CNCc2ccccc2 34a_100015324214_100000187163 [0,1,0,0,0,0|1,0,0]=2 3051 B17R2.5301 Clc1cccc(c1)CNCc2ccccn2 207a_100000174878_100000209966 [0,1,0,0,0,0|2,0,0]=3 3052 B17R2.5301 Clc1cccc(c1)CNCc2ccccn2 2230a_100000174878_100000721315 [0,1,0,0,0,0|2,0,0]=3 3053 B17R2.5301 Clc1cccc(c1)CNCc2ccccn2 270004a_100000174878_100000209966 [0,1,0,0,0,0|2,0,0]=3 3054 B17R2.5301 Clc1cccc(c1)CNCc2ccccn2 270004a_100000210449_100000210801 [0,1,0,0,0,0|2,0,0]=3 3055 B17R2.5301 Clc1cccc(c1)CNCc2ccccn2 34a_100000174878_100000721315 [0,1,0,0,0,0|2,0,0]=3 3056 B17R2.5301 Clc1cccc(c1)CNCc2cccnc2 207a_100000174878_100000209961 [0,1,0,0,0,0|2,0,0]=3 3057 B17R2.5301 Clc1cccc(c1)CNCc2cccnc2 207a_100000210453_100000210801 [0,1,0,0,0,0|2,0,0]=3 3058 B17R2.5301 Clc1cccc(c1)CNCc2cccnc2 2230a_100000174878_100000741622 [0,1,0,0,0,0|2,0,0]=3 3059 B17R2.5301 Clc1cccc(c1)CNCc2cccnc2 270004a_100000174878_100000209961 [0,1,0,0,0,0|2,0,0]=3 3060 B17R2.5301 Clc1cccc(c1)CNCc2cccnc2 270004a_100000210453_100000210801 [0,1,0,0,0,0|2,0,0]=3 3061 B17R2.5301 Clc1cccc(c1)CNCc2cccnc2 34a_100000174878_100000733263 [0,1,0,0,0,0|2,0,0]=3 3062 B17R2.5301 Clc1cccc(c1)CNCc2cccnn2 2230a_100000174878_100016990269 [0,1,0,0,0,0|3,0,0]=4 3063 B17R2.5301 Clc1cccc(c1)CNCc2cccnn2 2230a_100159270163_100000181238 [0,1,0,0,0,0|3,0,0]=4 3064 B17R2.5301 Clc1cccc(c1)CNCc2cccnn2 34a_100000174878_100016990269 [0,1,0,0,0,0|3,0,0]=4 3065 B17R2.5301 Clc1cccc(c1)CNCc2ccncc2 207a_100000174878_100000186114 [0,1,0,0,0,0|2,0,0]=3 3066 B17R2.5301 Clc1cccc(c1)CNCc2ccncc2 2230a_100000174878_100015193705 [0,1,0,0,0,0|2,0,0]=3 3067 B17R2.5301 Clc1cccc(c1)CNCc2ccnnc2 270004a_100000174878_100011934578 [0,1,0,0,0,0|3,0,0]=4 3068 B17R2.5301 Clc1cccc(c1)CNCc2cnccn2 2230a_100000174878_100016995436 [0,1,0,0,0,0|3,0,0]=4 3069 B17R2.5301 Clc1cccc(c1)CNCc2cnccn2 270004a_100000174878_100000749867 [0,1,0,0,0,0|3,0,0]=4 3070 B17R2.5301 Clc1cccc(c1)CNCc2cnccn2 34a_100000174878_100016995436 [0,1,0,0,0,0|3,0,0]=4 3071 B17R2.5301 Clc1cccc(c1)CNCc2cncnc2 207a_100011243677_100000210801 [0,1,0,0,0,0|3,0,0]=4 3072 B17R2.5301 Clc1cccc(c1)CNCc2cncnc2 2230a_100000174878_100015196519 [0,1,0,0,0,0|3,0,0]=4 3073 B17R2.5301 Clc1cccc(c1)CNCc2cncnc2 2230a_100011243677_100000181238 [0,1,0,0,0,0|3,0,0]=4 3074 B17R2.5301 Clc1cccc(c1)CNCc2cncnc2 270004a_100000174878_100000749868 [0,1,0,0,0,0|3,0,0]=4 3075 B17R2.5301 Clc1cccc(c1)CNCc2cncnc2 270004a_100011243677_100000210801 [0,1,0,0,0,0|3,0,0]=4 3076 B17R2.5301 Clc1cccc(c1)CNCc2cncnc2 34a_100000174878_100015196519 [0,1,0,0,0,0|3,0,0]=4 3077 B17R2.5301 Clc1cccc(c1)CNCc2ncccn2 2230a_100000174878_100000703007 [0,1,0,0,0,0|3,0,0]=4 3078 B17R2.5301 Clc1cccc(c1)CNCc2ncccn2 270004a_100000174878_100011532527 [0,1,0,0,0,0|3,0,0]=4 3079 B17R2.5301 Clc1cccc(c1)CNCc2ncccn2 34a_100000174878_100000703007 [0,1,0,0,0,0|3,0,0]=4 3080 B17R2.5301 Clc1cccc(c1)COCc2ccccc2 34a_100000210790_100000187163 [0,1,0,0,0,0|0,0,0]=1 3081 B17R2.5301 Clc1cccc(c1)COCc2ccccc2 34a_100000241301_100015291786 [0,1,0,0,0,0|0,0,0]=1 3082 B17R2.5301 Clc1cccc(c1)COCc2ccccc2 7a_100000210790_100000187163 [0,1,0,0,0,0|0,0,0]=1 3083 B17R2.5301 Clc1cccc(c1)COCc2ccccc2 7a_100000241301_100000211182 [0,1,0,0,0,0|0,0,0]=1 3084 B17R2.5301 Clc1cccc(c1)COCc2ccccn2 34a_100000241301_100000721315 [0,1,0,0,0,0|1,0,0]=2 3085 B17R2.5301 Clc1cccc(c1)COCc2ccccn2 7a_100000241301_100000721315 [0,1,0,0,0,0|1,0,0]=2 3086 B17R2.5301 Clc1cccc(c1)COCc2cccnc2 34a_100000241301_100000733263 [0,1,0,0,0,0|1,0,0]=2 3087 B17R2.5301 Clc1cccc(c1)COCc2cccnc2 7a_100000241301_100000741622 [0,1,0,0,0,0|1,0,0]=2 3088 B17R2.5301 Clc1cccc(c1)COCc2cccnn2 34a_100000241301_100016990269 [0,1,0,0,0,0|2,0,0]=3 3089 B17R2.5301 Clc1cccc(c1)COCc2cccnn2 7a_100000241301_100016990269 [0,1,0,0,0,0|2,0,0]=3 3090 B17R2.5301 Clc1cccc(c1)COCc2ccncc2 7a_100000241301_100015193705 [0,1,0,0,0,0|1,0,0]=2 3091 B17R2.5301 Clc1cccc(c1)COCc2cnccn2 34a_100000241301_100016995436 [0,1,0,0,0,0|2,0,0]=3 3092 B17R2.5301 Clc1cccc(c1)COCc2cnccn2 7a_100000241301_100016995436 [0,1,0,0,0,0|2,0,0]=3 3093 B17R2.5301 Clc1cccc(c1)COCc2cncnc2 34a_100000241301_100015196519 [0,1,0,0,0,0|2,0,0]=3 3094 B17R2.5301 Clc1cccc(c1)COCc2cncnc2 7a_100000241301_100015196519 [0,1,0,0,0,0|2,0,0]=3 3095 B17R2.5301 Clc1cccc(c1)COCc2ncccn2 34a_100000241301_100000703007 [0,1,0,0,0,0|2,0,0]=3 3096 B17R2.5301 Clc1cccc(c1)COCc2ncccn2 7a_100000241301_100000703007 [0,1,0,0,0,0|2,0,0]=3 3097 B17R2.5301 Clc1cccc(c1)CSCc2ccccc2 62a_100000187163_100015291786 [0,1,0,0,0,0|0,1,0]=2 3098 B17R2.5301 Clc1cccc(c1)CSCc2ccccc2 62a_100000211182_100000187163 [0,1,0,0,0,0|0,1,0]=2 3099 B17R2.5301 Clc1cccc(c1)CSCc2ccccn2 62a_100000187163_100000721315 [0,1,0,0,0,0|1,1,0]=3 3100 B17R2.5301 Clc1cccc(c1)CSCc2ccccn2 62a_100000721315_100000187163 [0,1,0,0,0,0|1,1,0]=3 3101 B17R2.5301 Clc1cccc(c1)CSCc2cccnc2 62a_100000187163_100000741622 [0,1,0,0,0,0|1,1,0]=3 3102 B17R2.5301 Clc1cccc(c1)CSCc2cccnc2 62a_100000741622_100000187163 [0,1,0,0,0,0|1,1,0]=3 3103 B17R2.5301 Clc1cccc(c1)CSCc2cccnn2 62a_100000187163_100016990269 [0,1,0,0,0,0|2,1,0]=4 3104 B17R2.5301 Clc1cccc(c1)CSCc2cccnn2 62a_100016990269_100000187163 [0,1,0,0,0,0|2,1,0]=4 3105 B17R2.5301 Clc1cccc(c1)CSCc2ccncc2 62a_100000187163_100015193705 [0,1,0,0,0,0|1,1,0]=3 3106 B17R2.5301 Clc1cccc(c1)CSCc2ccncc2 62a_100015193705_100000187163 [0,1,0,0,0,0|1,1,0]=3 3107 B17R2.5301 Clc1cccc(c1)CSCc2cnccn2 62a_100000187163_100016995436 [0,1,0,0,0,0|2,1,0]=4 3108 B17R2.5301 Clc1cccc(c1)CSCc2cnccn2 62a_100016995436_100000187163 [0,1,0,0,0,0|2,1,0]=4 3109 B17R2.5301 Clc1cccc(c1)CSCc2cncnc2 62a_100000187163_100015196519 [0,1,0,0,0,0|2,1,0]=4 3110 B17R2.5301 Clc1cccc(c1)CSCc2cncnc2 62a_100015196519_100000187163 [0,1,0,0,0,0|2,1,0]=4 3111 B17R2.5301 Clc1cccc(c1)CSCc2ncccn2 62a_100000187163_100000703007 [0,1,0,0,0,0|2,1,0]=4 3112 B17R2.5301 Clc1cccc(c1)CSCc2ncccn2 62a_100000703007_100000187163 [0,1,0,0,0,0|2,1,0]=4 3113 B17R2.5301 Clc1cccc(c1)NCCc2ccccc2 34a_100000185859_100000765856 [0,1,0,0,0,0|2,0,0]=3 3114 B17R2.5301 Clc1cccc(c1)NN=Cc2ccccc2 4a_100000184277_100015611070 [0,1,0,0,0,0|2,0,1]=4 3115 B17R2.5301 Clc1cccc(c1)OCCc2ccccc2 34a_100000210295_100000765856 [0,1,0,0,0,0|2,0,0]=3 3116 B17R2.5301 Clc1cccc(c1)OCCc2ccccc2 7a_100000210295_100000765856 [0,1,0,0,0,0|2,0,0]=3 3117 B17R2.5301 Clc1cccc(c1)OCCc2ccccn2 7a_100000210295_100015183660 [0,1,0,0,0,0|3,0,0]=4 3118 B17R2.5301 Clc1cccc(c1)OCCc2cccnc2 7a_100000210295_200011713674 [0,1,0,0,0,0|3,0,0]=4 3119 B17R2.5301 Clc1cccc(c1)OCCc2ccncc2 7a_100000210295_100000723409 [0,1,0,0,0,0|3,0,0]=4 3120 B17R2.5301 Clc1cccc(c1)SCCc2ccccc2 62a_100000699651_100011218657 [0,1,0,0,0,0|2,0,0]=3 3121 B17R2.5301 Clc1cccc(c1)SCCc2ccccc2 62a_100000765856_100000699651 [0,1,0,0,0,0|2,0,0]=3 3122 B17R2.5301 Clc1cccc(c1)SCCc2ccccn2 62a_100000699651_100015183660 [0,1,0,0,0,0|3,0,0]=4 3123 B17R2.5301 Clc1cccc(c1)SCCc2ccccn2 62a_100015183660_100000699651 [0,1,0,0,0,0|3,0,0]=4 3124 B17R2.5301 Clc1cccc(c1)SCCc2cccnc2 62a_100000699651_200011713674 [0,1,0,0,0,0|3,0,0]=4 3125 B17R2.5301 Clc1cccc(c1)SCCc2cccnc2 62a_200011713674_100000699651 [0,1,0,0,0,0|3,0,0]=4 3126 B17R2.5301 Clc1cccc(c1)SCCc2ccncc2 62a_100000699651_100000723409 [0,1,0,0,0,0|3,0,0]=4 3127 B17R2.5301 Clc1cccc(c1)SCCc2ccncc2 62a_100000723409_100000699651 [0,1,0,0,0,0|3,0,0]=4 3128 B17R2.5301 Clc1cccc(c1)SCSc2ccccc2 62a_100000699651_100011218342 [0,1,0,0,0,0|3,0,0]=4 3129 B17R2.5301 Clc1cccc(c1)SCSc2ccccc2 62a_100011218342_100000699651 [0,1,0,0,0,0|3,0,0]=4 3130 B17R2.5301 Clc1cccc(n1)CNCc2ccccc2 2230a_100015324214_100000086093 [0,1,0,0,0,0|2,0,0]=3 3131 B17R2.5301 Clc1cccc(n1)CNCc2ccccc2 2230a_100016990191_100015291786 [0,1,0,0,0,0|2,0,0]=3 3132 B17R2.5301 Clc1cccc(n1)CNCc2ccccc2 270004a_100015324214_100011361687 [0,1,0,0,0,0|2,0,0]=3 3133 B17R2.5301 Clc1cccc(n1)CNCc2ccccc2 34a_100015324214_100000086093 [0,1,0,0,0,0|2,0,0]=3 3134 B17R2.5301 Clc1cccc(n1)CNCc2ccccn2 2230a_100016990191_100000721315 [0,1,0,0,0,0|3,0,0]=4 3135 B17R2.5301 Clc1cccc(n1)CNCc2ccccn2 270004a_100000210449_100011361687 [0,1,0,0,0,0|3,0,0]=4 3136 B17R2.5301 Clc1cccc(n1)CNCc2cccnc2 2230a_100016990191_100000741622 [0,1,0,0,0,0|3,0,0]=4 3137 B17R2.5301 Clc1cccc(n1)CNCc2cccnc2 270004a_100000210453_100011361687 [0,1,0,0,0,0|3,0,0]=4 3138 B17R2.5301 Clc1cccc(n1)CNCc2ccncc2 2230a_100016990191_100015193705 [0,1,0,0,0,0|3,0,0]=4 3139 B17R2.5301 Clc1cccc(n1)COCc2ccccc2 34a_100000210790_100000086093 [0,1,0,0,0,0|1,0,0]=2 3140 B17R2.5301 Clc1cccc(n1)COCc2ccccc2 34a_100011998359_100015291786 [0,1,0,0,0,0|1,0,0]=2 3141 B17R2.5301 Clc1cccc(n1)COCc2ccccc2 7a_100000210790_100000086093 [0,1,0,0,0,0|1,0,0]=2 3142 B17R2.5301 Clc1cccc(n1)COCc2ccccn2 34a_100011998359_100000721315 [0,1,0,0,0,0|2,0,0]=3 3143 B17R2.5301 Clc1cccc(n1)COCc2cccnc2 34a_100011998359_100000733263 [0,1,0,0,0,0|2,0,0]=3 3144 B17R2.5301 Clc1cccc(n1)COCc2cccnn2 34a_100011998359_100016990269 [0,1,0,0,0,0|3,0,0]=4 3145 B17R2.5301 Clc1cccc(n1)COCc2cnccn2 34a_100011998359_100016995436 [0,1,0,0,0,0|3,0,0]=4 3146 B17R2.5301 Clc1cccc(n1)COCc2cncnc2 34a_100011998359_100015196519 [0,1,0,0,0,0|3,0,0]=4 3147 B17R2.5301 Clc1cccc(n1)COCc2ncccn2 34a_100011998359_100000703007 [0,1,0,0,0,0|3,0,0]=4 3148 B17R2.5301 Clc1cccc(n1)CSCc2ccccc2 62a_100000086093_100015291786 [0,1,0,0,0,0|1,1,0]=3 3149 B17R2.5301 Clc1cccc(n1)CSCc2ccccc2 62a_100000211182_100000086093 [0,1,0,0,0,0|1,1,0]=3 3150 B17R2.5301 Clc1cccc(n1)CSCc2ccccn2 62a_100000086093_100000721315 [0,1,0,0,0,0|2,1,0]=4 3151 B17R2.5301 Clc1cccc(n1)CSCc2ccccn2 62a_100000721315_100000086093 [0,1,0,0,0,0|2,1,0]=4 3152 B17R2.5301 Clc1cccc(n1)CSCc2cccnc2 62a_100000086093_100000741622 [0,1,0,0,0,0|2,1,0]=4 3153 B17R2.5301 Clc1cccc(n1)CSCc2cccnc2 62a_100000741622_100000086093 [0,1,0,0,0,0|2,1,0]=4 3154 B17R2.5301 Clc1cccc(n1)CSCc2ccncc2 62a_100000086093_100015193705 [0,1,0,0,0,0|2,1,0]=4 3155 B17R2.5301 Clc1cccc(n1)CSCc2ccncc2 62a_100015193705_100000086093 [0,1,0,0,0,0|2,1,0]=4 3156 B17R2.5301 Clc1cccc(n1)SCCc2ccccc2 62a_100000051397_100011218657 [0,1,0,0,0,0|3,0,0]=4 3157 B17R2.5301 Clc1cccc(n1)SCCc2ccccc2 62a_100000765856_100000051397 [0,1,0,0,0,0|3,0,0]=4 3158 B17R2.5301 Clc1ccnc(c1)C=CCc2ccccc2 271570a_200016263579_100010167805 [0,1,0,0,0,0|2,0,1]=4 3159 B17R2.5301 Clc1ccnc(c1)CNCc2ccccc2 2230a_100015324214_100016988179 [0,1,0,0,0,0|2,0,0]=3 3160 B17R2.5301 Clc1ccnc(c1)CNCc2ccccc2 270004a_100015324214_100011998288 [0,1,0,0,0,0|2,0,0]=3 3161 B17R2.5301 Clc1ccnc(c1)CNCc2ccccc2 34a_100015324214_100016988179 [0,1,0,0,0,0|2,0,0]=3 3162 B17R2.5301 Clc1ccnc(c1)CNCc2ccccn2 270004a_100000210449_100011998288 [0,1,0,0,0,0|3,0,0]=4 3163 B17R2.5301 Clc1ccnc(c1)CNCc2cccnc2 270004a_100000210453_100011998288 [0,1,0,0,0,0|3,0,0]=4 3164 B17R2.5301 Clc1ccnc(c1)COCc2ccccc2 34a_100000210790_100016988179 [0,1,0,0,0,0|1,0,0]=2 3165 B17R2.5301 Clc1ccnc(c1)COCc2ccccc2 34a_100000748867_100015291786 [0,1,0,0,0,0|1,0,0]=2 3166 B17R2.5301 Clc1ccnc(c1)COCc2ccccc2 7a_100000210790_100016988179 [0,1,0,0,0,0|1,0,0]=2 3167 B17R2.5301 Clc1ccnc(c1)COCc2ccccn2 34a_100000748867_100000721315 [0,1,0,0,0,0|2,0,0]=3 3168 B17R2.5301 Clc1ccnc(c1)COCc2cccnc2 34a_100000748867_100000733263 [0,1,0,0,0,0|2,0,0]=3 3169 B17R2.5301 Clc1ccnc(c1)COCc2cccnn2 34a_100000748867_100016990269 [0,1,0,0,0,0|3,0,0]=4 3170 B17R2.5301 Clc1ccnc(c1)COCc2cnccn2 34a_100000748867_100016995436 [0,1,0,0,0,0|3,0,0]=4 3171 B17R2.5301 Clc1ccnc(c1)COCc2cncnc2 34a_100000748867_100015196519 [0,1,0,0,0,0|3,0,0]=4 3172 B17R2.5301 Clc1ccnc(c1)COCc2ncccn2 34a_100000748867_100000703007 [0,1,0,0,0,0|3,0,0]=4 3173 B17R2.5301 Clc1ccnc(c1)CSCc2ccccc2 62a_100000211182_100016988179 [0,1,0,0,0,0|1,1,0]=3 3174 B17R2.5301 Clc1ccnc(c1)CSCc2ccccc2 62a_100016988179_100015291786 [0,1,0,0,0,0|1,1,0]=3 3175 B17R2.5301 Clc1ccnc(c1)CSCc2ccccn2 62a_100000721315_100016988179 [0,1,0,0,0,0|2,1,0]=4 3176 B17R2.5301 Clc1ccnc(c1)CSCc2ccccn2 62a_100016988179_100000721315 [0,1,0,0,0,0|2,1,0]=4 3177 B17R2.5301 Clc1ccnc(c1)CSCc2cccnc2 62a_100000741622_100016988179 [0,1,0,0,0,0|2,1,0]=4 3178 B17R2.5301 Clc1ccnc(c1)CSCc2cccnc2 62a_100016988179_100000741622 [0,1,0,0,0,0|2,1,0]=4 3179 B17R2.5301 Clc1ccnc(c1)CSCc2ccncc2 62a_100015193705_100016988179 [0,1,0,0,0,0|2,1,0]=4 3180 B17R2.5301 Clc1ccnc(c1)CSCc2ccncc2 62a_100016988179_100015193705 [0,1,0,0,0,0|2,1,0]=4 3181 B17R2.5301 Clc1ccnc(c1)SCCc2ccccc2 62a_100000765856_100010167805 [0,1,0,0,0,0|3,0,0]=4 3182 B17R2.5301 Clc1ccnc(c1)SCCc2ccccc2 62a_100010167805_100011218657 [0,1,0,0,0,0|3,0,0]=4 3183 B17R2.5301 Clc1cncc(c1)C=CCc2ccccc2 271570a_200016263579_100000049639 [0,1,0,0,0,0|2,0,1]=4 3184 B17R2.5301 Clc1cncc(c1)CNCc2ccccc2 207a_100015324214_100000088910 [0,1,0,0,0,0|2,0,0]=3 3185 B17R2.5301 Clc1cncc(c1)CNCc2ccccc2 207a_200020614424_100015611070 [0,1,0,0,0,0|2,0,0]=3 3186 B17R2.5301 Clc1cncc(c1)CNCc2ccccc2 2230a_100015324214_100016992070 [0,1,0,0,0,0|2,0,0]=3 3187 B17R2.5301 Clc1cncc(c1)CNCc2ccccc2 2230a_200020614424_100015291786 [0,1,0,0,0,0|2,0,0]=3 3188 B17R2.5301 Clc1cncc(c1)CNCc2ccccc2 270004a_100015324214_100000088910 [0,1,0,0,0,0|2,0,0]=3 3189 B17R2.5301 Clc1cncc(c1)CNCc2ccccc2 270004a_200020614424_100015611070 [0,1,0,0,0,0|2,0,0]=3 3190 B17R2.5301 Clc1cncc(c1)CNCc2ccccc2 34a_100015324214_100016992070 [0,1,0,0,0,0|2,0,0]=3 3191 B17R2.5301 Clc1cncc(c1)CNCc2ccccn2 207a_200020614424_100000209966 [0,1,0,0,0,0|3,0,0]=4 3192 B17R2.5301 Clc1cncc(c1)CNCc2ccccn2 2230a_200020614424_100000721315 [0,1,0,0,0,0|3,0,0]=4 3193 B17R2.5301 Clc1cncc(c1)CNCc2ccccn2 270004a_100000210449_100000088910 [0,1,0,0,0,0|3,0,0]=4 3194 B17R2.5301 Clc1cncc(c1)CNCc2ccccn2 270004a_200020614424_100000209966 [0,1,0,0,0,0|3,0,0]=4 3195 B17R2.5301 Clc1cncc(c1)CNCc2cccnc2 207a_100000210453_100000088910 [0,1,0,0,0,0|3,0,0]=4 3196 B17R2.5301 Clc1cncc(c1)CNCc2cccnc2 207a_200020614424_100000209961 [0,1,0,0,0,0|3,0,0]=4 3197 B17R2.5301 Clc1cncc(c1)CNCc2cccnc2 2230a_200020614424_100000741622 [0,1,0,0,0,0|3,0,0]=4 3198 B17R2.5301 Clc1cncc(c1)CNCc2cccnc2 270004a_100000210453_100000088910 [0,1,0,0,0,0|3,0,0]=4 3199 B17R2.5301 Clc1cncc(c1)CNCc2cccnc2 270004a_200020614424_100000209961 [0,1,0,0,0,0|3,0,0]=4 3200 B17R2.5301 Clc1cncc(c1)CNCc2ccncc2 207a_200020614424_100000186114 [0,1,0,0,0,0|3,0,0]=4 3201 B17R2.5301 Clc1cncc(c1)CNCc2ccncc2 2230a_200020614424_100015193705 [0,1,0,0,0,0|3,0,0]=4 3202 B17R2.5301 Clc1cncc(c1)COCc2ccccc2 34a_100000092867_100015291786 [0,1,0,0,0,0|1,0,0]=2 3203 B17R2.5301 Clc1cncc(c1)COCc2ccccc2 34a_100000210790_100016992070 [0,1,0,0,0,0|1,0,0]=2 3204 B17R2.5301 Clc1cncc(c1)COCc2ccccc2 7a_100000092867_100000211182 [0,1,0,0,0,0|1,0,0]=2 3205 B17R2.5301 Clc1cncc(c1)COCc2ccccc2 7a_100000210790_100016992070 [0,1,0,0,0,0|1,0,0]=2 3206 B17R2.5301 Clc1cncc(c1)COCc2ccccn2 34a_100000092867_100000721315 [0,1,0,0,0,0|2,0,0]=3 3207 B17R2.5301 Clc1cncc(c1)COCc2ccccn2 7a_100000092867_100000721315 [0,1,0,0,0,0|2,0,0]=3 3208 B17R2.5301 Clc1cncc(c1)COCc2cccnc2 34a_100000092867_100000733263 [0,1,0,0,0,0|2,0,0]=3 3209 B17R2.5301 Clc1cncc(c1)COCc2cccnc2 7a_100000092867_100000741622 [0,1,0,0,0,0|2,0,0]=3 3210 B17R2.5301 Clc1cncc(c1)COCc2cccnn2 34a_100000092867_100016990269 [0,1,0,0,0,0|3,0,0]=4 3211 B17R2.5301 Clc1cncc(c1)COCc2cccnn2 7a_100000092867_100016990269 [0,1,0,0,0,0|3,0,0]=4 3212 B17R2.5301 Clc1cncc(c1)COCc2ccncc2 7a_100000092867_100015193705 [0,1,0,0,0,0|2,0,0]=3 3213 B17R2.5301 Clc1cncc(c1)COCc2cnccn2 34a_100000092867_100016995436 [0,1,0,0,0,0|3,0,0]=4 3214 B17R2.5301 Clc1cncc(c1)COCc2cnccn2 7a_100000092867_100016995436 [0,1,0,0,0,0|3,0,0]=4 3215 B17R2.5301 Clc1cncc(c1)COCc2cncnc2 34a_100000092867_100015196519 [0,1,0,0,0,0|3,0,0]=4 3216 B17R2.5301 Clc1cncc(c1)COCc2cncnc2 7a_100000092867_100015196519 [0,1,0,0,0,0|3,0,0]=4 3217 B17R2.5301 Clc1cncc(c1)COCc2ncccn2 34a_100000092867_100000703007 [0,1,0,0,0,0|3,0,0]=4 3218 B17R2.5301 Clc1cncc(c1)COCc2ncccn2 7a_100000092867_100000703007 [0,1,0,0,0,0|3,0,0]=4 3219 B17R2.5301 Clc1cncc(c1)CSCc2ccccc2 62a_100000211182_100016992070 [0,1,0,0,0,0|1,1,0]=3 3220 B17R2.5301 Clc1cncc(c1)CSCc2ccccc2 62a_100016992070_100015291786 [0,1,0,0,0,0|1,1,0]=3 3221 B17R2.5301 Clc1cncc(c1)CSCc2ccccn2 62a_100000721315_100016992070 [0,1,0,0,0,0|2,1,0]=4 3222 B17R2.5301 Clc1cncc(c1)CSCc2ccccn2 62a_100016992070_100000721315 [0,1,0,0,0,0|2,1,0]=4 3223 B17R2.5301 Clc1cncc(c1)CSCc2cccnc2 62a_100000741622_100016992070 [0,1,0,0,0,0|2,1,0]=4 3224 B17R2.5301 Clc1cncc(c1)CSCc2cccnc2 62a_100016992070_100000741622 [0,1,0,0,0,0|2,1,0]=4 3225 B17R2.5301 Clc1cncc(c1)CSCc2ccncc2 62a_100015193705_100016992070 [0,1,0,0,0,0|2,1,0]=4 3226 B17R2.5301 Clc1cncc(c1)CSCc2ccncc2 62a_100016992070_100015193705 [0,1,0,0,0,0|2,1,0]=4 3227 B17R2.5301 Clc1cncc(c1)OCCc2ccccc2 7a_100000032511_100000765856 [0,1,0,0,0,0|3,0,0]=4 3228 B17R2.5301 Clc1cncc(c1)SCCc2ccccc2 62a_100000049639_100011218657 [0,1,0,0,0,0|3,0,0]=4 3229 B17R2.5301 Clc1cncc(c1)SCCc2ccccc2 62a_100000765856_100000049639 [0,1,0,0,0,0|3,0,0]=4 3230 B17R2.5301 Clc1nccc(n1)CNCc2ccccc2 2230a_100015324214_100000099655 [0,1,0,0,0,0|3,0,0]=4 3231 B17R2.5301 Clc1nccc(n1)CNCc2ccccc2 34a_100015324214_100000099655 [0,1,0,0,0,0|3,0,0]=4 3232 B17R2.5301 Clc1nccc(n1)COCc2ccccc2 34a_100000210790_100000099655 [0,1,0,0,0,0|2,0,0]=3 3233 B17R2.5301 Clc1nccc(n1)COCc2ccccc2 7a_100000210790_100000099655 [0,1,0,0,0,0|2,0,0]=3 3234 B17R2.5301 Clc1nccc(n1)CSCc2ccccc2 62a_100000099655_100015291786 [0,1,0,0,0,0|2,1,0]=4 3235 B17R2.5301 Clc1nccc(n1)CSCc2ccccc2 62a_100000211182_100000099655 [0,1,0,0,0,0|2,1,0]=4 3236 B17R2.5301 Fc1cc(ccn1)C=CCc2ccccc2 271570a_200016263579_100009816116 [0,1,0,0,0,0|2,0,1]=4 3237 B17R2.5301 Fc1cc(ccn1)CNCc2ccccc2 2230a_100015188774_100015291786 [0,1,0,0,0,0|2,0,0]=3 3238 B17R2.5301 Fc1cc(ccn1)CNCc2ccccc2 270004a_100015188774_100015611070 [0,1,0,0,0,0|2,0,0]=3 3239 B17R2.5301 Fc1cc(ccn1)CNCc2ccccc2 270004a_100015324214_100000068331 [0,1,0,0,0,0|2,0,0]=3 3240 B17R2.5301 Fc1cc(ccn1)CNCc2ccccc2 34a_100015188774_100015291786 [0,1,0,0,0,0|2,0,0]=3 3241 B17R2.5301 Fc1cc(ccn1)CNCc2ccccn2 2230a_100015188774_100000721315 [0,1,0,0,0,0|3,0,0]=4 3242 B17R2.5301 Fc1cc(ccn1)CNCc2ccccn2 270004a_100000210449_100000068331 [0,1,0,0,0,0|3,0,0]=4 3243 B17R2.5301 Fc1cc(ccn1)CNCc2ccccn2 270004a_100015188774_100000209966 [0,1,0,0,0,0|3,0,0]=4 3244 B17R2.5301 Fc1cc(ccn1)CNCc2ccccn2 34a_100015188774_100000721315 [0,1,0,0,0,0|3,0,0]=4 3245 B17R2.5301 Fc1cc(ccn1)CNCc2cccnc2 2230a_100015188774_100000741622 [0,1,0,0,0,0|3,0,0]=4 3246 B17R2.5301 Fc1cc(ccn1)CNCc2cccnc2 270004a_100000210453_100000068331 [0,1,0,0,0,0|3,0,0]=4 3247 B17R2.5301 Fc1cc(ccn1)CNCc2cccnc2 270004a_100015188774_100000209961 [0,1,0,0,0,0|3,0,0]=4 3248 B17R2.5301 Fc1cc(ccn1)CNCc2cccnc2 34a_100015188774_100000733263 [0,1,0,0,0,0|3,0,0]=4 3249 B17R2.5301 Fc1cc(ccn1)CNCc2ccncc2 2230a_100015188774_100015193705 [0,1,0,0,0,0|3,0,0]=4 3250 B17R2.5301 Fc1cc(ccn1)COCc2ccccc2 34a_100000082451_100015291786 [0,1,0,0,0,0|1,0,0]=2 3251 B17R2.5301 Fc1cc(ccn1)COCc2ccccn2 34a_100000082451_100000721315 [0,1,0,0,0,0|2,0,0]=3 3252 B17R2.5301 Fc1cc(ccn1)COCc2cccnc2 34a_100000082451_100000733263 [0,1,0,0,0,0|2,0,0]=3 3253 B17R2.5301 Fc1cc(ccn1)COCc2cccnn2 34a_100000082451_100016990269 [0,1,0,0,0,0|3,0,0]=4 3254 B17R2.5301 Fc1cc(ccn1)COCc2cnccn2 34a_100000082451_100016995436 [0,1,0,0,0,0|3,0,0]=4 3255 B17R2.5301 Fc1cc(ccn1)COCc2cncnc2 34a_100000082451_100015196519 [0,1,0,0,0,0|3,0,0]=4 3256 B17R2.5301 Fc1cc(ccn1)COCc2ncccn2 34a_100000082451_100000703007 [0,1,0,0,0,0|3,0,0]=4 3257 B17R2.5301 Fc1cc(ccn1)NCCc2ccccc2 27a_100000106460_100009816116 [0,1,0,0,0,0|3,0,0]=4 3258 B17R2.5301 Fc1cc(ccn1)OCCc2ccccc2 34a_100000732698_100000765856 [0,1,0,0,0,0|3,0,0]=4 3259 B17R2.5301 Fc1cc(ccn1)SCCc2ccccc2 62a_100000765856_100009816116 [0,1,0,0,0,0|3,0,0]=4 3260 B17R2.5301 Fc1cc(ccn1)SCCc2ccccc2 62a_100009816116_100011218657 [0,1,0,0,0,0|3,0,0]=4 3261 B17R2.5301 Fc1cccc(c1)C=CCc2ccccc2 271570a_200016263579_100000685547 [0,1,0,0,0,0|1,0,1]=3 3262 B17R2.5301 Fc1cccc(c1)C=NNc2ccccc2 4a_100015195140_100000210812 [0,1,0,0,0,0|2,0,1]=4 3263 B17R2.5301 Fc1cccc(c1)CCNc2ccccc2 34a_100000106764_100011217235 [0,1,0,0,0,0|2,0,0]=3 3264 B17R2.5301 Fc1cccc(c1)CCOc2ccccc2 34a_100000210340_100011217235 [0,1,0,0,0,0|2,0,0]=3 3265 B17R2.5301 Fc1cccc(c1)CCOc2ccccc2 7a_100000210340_100011217235 [0,1,0,0,0,0|2,0,0]=3 3266 B17R2.5301 Fc1cccc(c1)CCOc2cccnc2 34a_100000210849_100011217235 [0,1,0,0,0,0|3,0,0]=4 3267 B17R2.5301 Fc1cccc(c1)CCOc2cccnc2 7a_100000210849_100011217235 [0,1,0,0,0,0|3,0,0]=4 3268 B17R2.5301 Fc1cccc(c1)CCOc2ccncc2 34a_100000212176_100011217235 [0,1,0,0,0,0|3,0,0]=4 3269 B17R2.5301 Fc1cccc(c1)CCSc2ccccc2 62a_100000719477_100011217235 [0,1,0,0,0,0|2,0,0]=3 3270 B17R2.5301 Fc1cccc(c1)CCSc2ccccc2 62a_100011217235_100000041952 [0,1,0,0,0,0|2,0,0]=3 3271 B17R2.5301 Fc1cccc(c1)CCSc2ccccn2 62a_100011216584_100011217235 [0,1,0,0,0,0|3,0,0]=4 3272 B17R2.5301 Fc1cccc(c1)CCSc2ccccn2 62a_100011217235_100011216584 [0,1,0,0,0,0|3,0,0]=4 3273 B17R2.5301 Fc1cccc(c1)CCSc2cccnc2 62a_100000210063_100011217235 [0,1,0,0,0,0|3,0,0]=4 3274 B17R2.5301 Fc1cccc(c1)CCSc2cccnc2 62a_100011217235_100000210063 [0,1,0,0,0,0|3,0,0]=4 3275 B17R2.5301 Fc1cccc(c1)CCSc2ccncc2 62a_100000728582_100011217235 [0,1,0,0,0,0|3,0,0]=4 3276 B17R2.5301 Fc1cccc(c1)CCSc2ccncc2 62a_100011217235_100000728582 [0,1,0,0,0,0|3,0,0]=4 3277 B17R2.5301 Fc1cccc(c1)CNCc2ccccc2 207a_100000174948_100015611070 [0,1,0,0,0,0|1,0,0]=2 3278 B17R2.5301 Fc1cccc(c1)CNCc2ccccc2 207a_100015324214_100000210812 [0,1,0,0,0,0|1,0,0]=2 3279 B17R2.5301 Fc1cccc(c1)CNCc2ccccc2 2230a_100000174948_100015291786 [0,1,0,0,0,0|1,0,0]=2 3280 B17R2.5301 Fc1cccc(c1)CNCc2ccccc2 2230a_100015324214_100000230114 [0,1,0,0,0,0|1,0,0]=2 3281 B17R2.5301 Fc1cccc(c1)CNCc2ccccc2 270004a_100000174948_100015611070 [0,1,0,0,0,0|1,0,0]=2 3282 B17R2.5301 Fc1cccc(c1)CNCc2ccccc2 270004a_100015324214_100000210812 [0,1,0,0,0,0|1,0,0]=2 3283 B17R2.5301 Fc1cccc(c1)CNCc2ccccc2 34a_100000174948_100015291786 [0,1,0,0,0,0|1,0,0]=2 3284 B17R2.5301 Fc1cccc(c1)CNCc2ccccc2 34a_100015324214_100000187166 [0,1,0,0,0,0|1,0,0]=2 3285 B17R2.5301 Fc1cccc(c1)CNCc2ccccn2 207a_100000174948_100000209966 [0,1,0,0,0,0|2,0,0]=3 3286 B17R2.5301 Fc1cccc(c1)CNCc2ccccn2 2230a_100000174948_100000721315 [0,1,0,0,0,0|2,0,0]=3 3287 B17R2.5301 Fc1cccc(c1)CNCc2ccccn2 270004a_100000174948_100000209966 [0,1,0,0,0,0|2,0,0]=3 3288 B17R2.5301 Fc1cccc(c1)CNCc2ccccn2 270004a_100000210449_100000210812 [0,1,0,0,0,0|2,0,0]=3 3289 B17R2.5301 Fc1cccc(c1)CNCc2ccccn2 34a_100000174948_100000721315 [0,1,0,0,0,0|2,0,0]=3 3290 B17R2.5301 Fc1cccc(c1)CNCc2cccnc2 207a_100000174948_100000209961 [0,1,0,0,0,0|2,0,0]=3 3291 B17R2.5301 Fc1cccc(c1)CNCc2cccnc2 207a_100000210453_100000210812 [0,1,0,0,0,0|2,0,0]=3 3292 B17R2.5301 Fc1cccc(c1)CNCc2cccnc2 2230a_100000174948_100000741622 [0,1,0,0,0,0|2,0,0]=3 3293 B17R2.5301 Fc1cccc(c1)CNCc2cccnc2 270004a_100000174948_100000209961 [0,1,0,0,0,0|2,0,0]=3 3294 B17R2.5301 Fc1cccc(c1)CNCc2cccnc2 270004a_100000210453_100000210812 [0,1,0,0,0,0|2,0,0]=3 3295 B17R2.5301 Fc1cccc(c1)CNCc2cccnc2 34a_100000174948_100000733263 [0,1,0,0,0,0|2,0,0]=3 3296 B17R2.5301 Fc1cccc(c1)CNCc2cccnn2 2230a_100000174948_100016990269 [0,1,0,0,0,0|3,0,0]=4 3297 B17R2.5301 Fc1cccc(c1)CNCc2cccnn2 2230a_100159270163_100000230114 [0,1,0,0,0,0|3,0,0]=4 3298 B17R2.5301 Fc1cccc(c1)CNCc2cccnn2 34a_100000174948_100016990269 [0,1,0,0,0,0|3,0,0]=4 3299 B17R2.5301 Fc1cccc(c1)CNCc2ccncc2 207a_100000174948_100000186114 [0,1,0,0,0,0|2,0,0]=3 3300 B17R2.5301 Fc1cccc(c1)CNCc2ccncc2 2230a_100000174948_100015193705 [0,1,0,0,0,0|2,0,0]=3 3301 B17R2.5301 Fc1cccc(c1)CNCc2ccnnc2 270004a_100000174948_100011934578 [0,1,0,0,0,0|3,0,0]=4 3302 B17R2.5301 Fc1cccc(c1)CNCc2cnccn2 2230a_100000174948_100016995436 [0,1,0,0,0,0|3,0,0]=4 3303 B17R2.5301 Fc1cccc(c1)CNCc2cnccn2 270004a_100000174948_100000749867 [0,1,0,0,0,0|3,0,0]=4 3304 B17R2.5301 Fc1cccc(c1)CNCc2cnccn2 34a_100000174948_100016995436 [0,1,0,0,0,0|3,0,0]=4 3305 B17R2.5301 Fc1cccc(c1)CNCc2cncnc2 207a_100011243677_100000210812 [0,1,0,0,0,0|3,0,0]=4 3306 B17R2.5301 Fc1cccc(c1)CNCc2cncnc2 2230a_100000174948_100015196519 [0,1,0,0,0,0|3,0,0]=4 3307 B17R2.5301 Fc1cccc(c1)CNCc2cncnc2 2230a_100011243677_100000230114 [0,1,0,0,0,0|3,0,0]=4 3308 B17R2.5301 Fc1cccc(c1)CNCc2cncnc2 270004a_100000174948_100000749868 [0,1,0,0,0,0|3,0,0]=4 3309 B17R2.5301 Fc1cccc(c1)CNCc2cncnc2 270004a_100011243677_100000210812 [0,1,0,0,0,0|3,0,0]=4 3310 B17R2.5301 Fc1cccc(c1)CNCc2cncnc2 34a_100000174948_100015196519 [0,1,0,0,0,0|3,0,0]=4 3311 B17R2.5301 Fc1cccc(c1)CNCc2ncccn2 2230a_100000174948_100000703007 [0,1,0,0,0,0|3,0,0]=4 3312 B17R2.5301 Fc1cccc(c1)CNCc2ncccn2 270004a_100000174948_100011532527 [0,1,0,0,0,0|3,0,0]=4 3313 B17R2.5301 Fc1cccc(c1)CNCc2ncccn2 34a_100000174948_100000703007 [0,1,0,0,0,0|3,0,0]=4 3314 B17R2.5301 Fc1cccc(c1)COCc2ccccc2 34a_100000210790_100000187166 [0,1,0,0,0,0|0,0,0]=1 3315 B17R2.5301 Fc1cccc(c1)COCc2ccccc2 34a_100000210976_100015291786 [0,1,0,0,0,0|0,0,0]=1 3316 B17R2.5301 Fc1cccc(c1)COCc2ccccc2 7a_100000210790_100000230114 [0,1,0,0,0,0|0,0,0]=1 3317 B17R2.5301 Fc1cccc(c1)COCc2ccccc2 7a_100000210976_100000211182 [0,1,0,0,0,0|0,0,0]=1 3318 B17R2.5301 Fc1cccc(c1)COCc2ccccn2 34a_100000210976_100000721315 [0,1,0,0,0,0|1,0,0]=2 3319 B17R2.5301 Fc1cccc(c1)COCc2ccccn2 7a_100000210976_100000721315 [0,1,0,0,0,0|1,0,0]=2 3320 B17R2.5301 Fc1cccc(c1)COCc2cccnc2 34a_100000210976_100000733263 [0,1,0,0,0,0|1,0,0]=2 3321 B17R2.5301 Fc1cccc(c1)COCc2cccnc2 7a_100000210976_100000741622 [0,1,0,0,0,0|1,0,0]=2 3322 B17R2.5301 Fc1cccc(c1)COCc2cccnn2 34a_100000210976_100016990269 [0,1,0,0,0,0|2,0,0]=3 3323 B17R2.5301 Fc1cccc(c1)COCc2cccnn2 7a_100000210976_100016990269 [0,1,0,0,0,0|2,0,0]=3 3324 B17R2.5301 Fc1cccc(c1)COCc2ccncc2 7a_100000210976_100015193705 [0,1,0,0,0,0|1,0,0]=2 3325 B17R2.5301 Fc1cccc(c1)COCc2cnccn2 34a_100000210976_100016995436 [0,1,0,0,0,0|2,0,0]=3 3326 B17R2.5301 Fc1cccc(c1)COCc2cnccn2 7a_100000210976_100016995436 [0,1,0,0,0,0|2,0,0]=3 3327 B17R2.5301 Fc1cccc(c1)COCc2cncnc2 34a_100000210976_100015196519 [0,1,0,0,0,0|2,0,0]=3 3328 B17R2.5301 Fc1cccc(c1)COCc2cncnc2 7a_100000210976_100015196519 [0,1,0,0,0,0|2,0,0]=3 3329 B17R2.5301 Fc1cccc(c1)COCc2ncccn2 34a_100000210976_100000703007 [0,1,0,0,0,0|2,0,0]=3 3330 B17R2.5301 Fc1cccc(c1)COCc2ncccn2 7a_100000210976_100000703007 [0,1,0,0,0,0|2,0,0]=3 3331 B17R2.5301 Fc1cccc(c1)CSCc2ccccc2 62a_100000211182_100000230114 [0,1,0,0,0,0|0,1,0]=2 3332 B17R2.5301 Fc1cccc(c1)CSCc2ccccc2 62a_100000230114_100015291786 [0,1,0,0,0,0|0,1,0]=2 3333 B17R2.5301 Fc1cccc(c1)CSCc2ccccn2 62a_100000230114_100000721315 [0,1,0,0,0,0|1,1,0]=3 3334 B17R2.5301 Fc1cccc(c1)CSCc2ccccn2 62a_100000721315_100000230114 [0,1,0,0,0,0|1,1,0]=3 3335 B17R2.5301 Fc1cccc(c1)CSCc2cccnc2 62a_100000230114_100000741622 [0,1,0,0,0,0|1,1,0]=3 3336 B17R2.5301 Fc1cccc(c1)CSCc2cccnc2 62a_100000741622_100000230114 [0,1,0,0,0,0|1,1,0]=3 3337 B17R2.5301 Fc1cccc(c1)CSCc2cccnn2 62a_100000230114_100016990269 [0,1,0,0,0,0|2,1,0]=4 3338 B17R2.5301 Fc1cccc(c1)CSCc2cccnn2 62a_100016990269_100000230114 [0,1,0,0,0,0|2,1,0]=4 3339 B17R2.5301 Fc1cccc(c1)CSCc2ccncc2 62a_100000230114_100015193705 [0,1,0,0,0,0|1,1,0]=3 3340 B17R2.5301 Fc1cccc(c1)CSCc2ccncc2 62a_100015193705_100000230114 [0,1,0,0,0,0|1,1,0]=3 3341 B17R2.5301 Fc1cccc(c1)CSCc2cnccn2 62a_100000230114_100016995436 [0,1,0,0,0,0|2,1,0]=4 3342 B17R2.5301 Fc1cccc(c1)CSCc2cnccn2 62a_100016995436_100000230114 [0,1,0,0,0,0|2,1,0]=4 3343 B17R2.5301 Fc1cccc(c1)CSCc2cncnc2 62a_100000230114_100015196519 [0,1,0,0,0,0|2,1,0]=4 3344 B17R2.5301 Fc1cccc(c1)CSCc2cncnc2 62a_100015196519_100000230114 [0,1,0,0,0,0|2,1,0]=4 3345 B17R2.5301 Fc1cccc(c1)CSCc2ncccn2 62a_100000230114_100000703007 [0,1,0,0,0,0|2,1,0]=4 3346 B17R2.5301 Fc1cccc(c1)CSCc2ncccn2 62a_100000703007_100000230114 [0,1,0,0,0,0|2,1,0]=4 3347 B17R2.5301 Fc1cccc(c1)NCCc2ccccc2 34a_100000210047_100000765856 [0,1,0,0,0,0|2,0,0]=3 3348 B17R2.5301 Fc1cccc(c1)NN=Cc2ccccc2 4a_100000745080_100015611070 [0,1,0,0,0,0|2,0,1]=4 3349 B17R2.5301 Fc1cccc(c1)OCCc2ccccc2 34a_100000210426_100000765856 [0,1,0,0,0,0|2,0,0]=3 3350 B17R2.5301 Fc1cccc(c1)OCCc2ccccc2 7a_100000210426_100000765856 [0,1,0,0,0,0|2,0,0]=3 3351 B17R2.5301 Fc1cccc(c1)OCCc2ccccn2 7a_100000210426_100015183660 [0,1,0,0,0,0|3,0,0]=4 3352 B17R2.5301 Fc1cccc(c1)OCCc2cccnc2 7a_100000210426_200011713674 [0,1,0,0,0,0|3,0,0]=4 3353 B17R2.5301 Fc1cccc(c1)OCCc2ccncc2 7a_100000210426_100000723409 [0,1,0,0,0,0|3,0,0]=4 3354 B17R2.5301 Fc1cccc(c1)SCCc2ccccc2 62a_100000685547_100011218657 [0,1,0,0,0,0|2,0,0]=3 3355 B17R2.5301 Fc1cccc(c1)SCCc2ccccc2 62a_100000765856_100000685547 [0,1,0,0,0,0|2,0,0]=3 3356 B17R2.5301 Fc1cccc(c1)SCCc2ccccn2 62a_100000685547_100015183660 [0,1,0,0,0,0|3,0,0]=4 3357 B17R2.5301 Fc1cccc(c1)SCCc2ccccn2 62a_100015183660_100000685547 [0,1,0,0,0,0|3,0,0]=4 3358 B17R2.5301 Fc1cccc(c1)SCCc2cccnc2 62a_100000685547_200011713674 [0,1,0,0,0,0|3,0,0]=4 3359 B17R2.5301 Fc1cccc(c1)SCCc2cccnc2 62a_200011713674_100000685547 [0,1,0,0,0,0|3,0,0]=4 3360 B17R2.5301 Fc1cccc(c1)SCCc2ccncc2 62a_100000685547_100000723409 [0,1,0,0,0,0|3,0,0]=4 3361 B17R2.5301 Fc1cccc(c1)SCCc2ccncc2 62a_100000723409_100000685547 [0,1,0,0,0,0|3,0,0]=4 3362 B17R2.5301 Fc1cccc(c1)SCSc2ccccc2 62a_100000685547_100011218342 [0,1,0,0,0,0|3,0,0]=4 3363 B17R2.5301 Fc1cccc(c1)SCSc2ccccc2 62a_100011218342_100000685547 [0,1,0,0,0,0|3,0,0]=4 3364 B17R2.5301 Fc1cccc(n1)C=CCc2ccccc2 271570a_200016263579_100009815982 [0,1,0,0,0,0|2,0,1]=4 3365 B17R2.5301 Fc1cccc(n1)CNCc2ccccc2 2230a_100015188798_100015291786 [0,1,0,0,0,0|2,0,0]=3 3366 B17R2.5301 Fc1cccc(n1)CNCc2ccccc2 2230a_100015324214_100009819644 [0,1,0,0,0,0|2,0,0]=3 3367 B17R2.5301 Fc1cccc(n1)CNCc2ccccc2 270004a_100015324214_100000050434 [0,1,0,0,0,0|2,0,0]=3 3368 B17R2.5301 Fc1cccc(n1)CNCc2ccccc2 34a_100015188798_100015291786 [0,1,0,0,0,0|2,0,0]=3 3369 B17R2.5301 Fc1cccc(n1)CNCc2ccccc2 34a_100015324214_100009819644 [0,1,0,0,0,0|2,0,0]=3 3370 B17R2.5301 Fc1cccc(n1)CNCc2ccccn2 2230a_100015188798_100000721315 [0,1,0,0,0,0|3,0,0]=4 3371 B17R2.5301 Fc1cccc(n1)CNCc2ccccn2 270004a_100000210449_100000050434 [0,1,0,0,0,0|3,0,0]=4 3372 B17R2.5301 Fc1cccc(n1)CNCc2ccccn2 34a_100015188798_100000721315 [0,1,0,0,0,0|3,0,0]=4 3373 B17R2.5301 Fc1cccc(n1)CNCc2cccnc2 2230a_100015188798_100000741622 [0,1,0,0,0,0|3,0,0]=4 3374 B17R2.5301 Fc1cccc(n1)CNCc2cccnc2 270004a_100000210453_100000050434 [0,1,0,0,0,0|3,0,0]=4 3375 B17R2.5301 Fc1cccc(n1)CNCc2cccnc2 34a_100015188798_100000733263 [0,1,0,0,0,0|3,0,0]=4 3376 B17R2.5301 Fc1cccc(n1)CNCc2ccncc2 2230a_100015188798_100015193705 [0,1,0,0,0,0|3,0,0]=4 3377 B17R2.5301 Fc1cccc(n1)COCc2ccccc2 34a_100000086748_100015291786 [0,1,0,0,0,0|1,0,0]=2 3378 B17R2.5301 Fc1cccc(n1)COCc2ccccc2 34a_100000210790_100009819644 [0,1,0,0,0,0|1,0,0]=2 3379 B17R2.5301 Fc1cccc(n1)COCc2ccccc2 7a_100000210790_100009819644 [0,1,0,0,0,0|1,0,0]=2 3380 B17R2.5301 Fc1cccc(n1)COCc2ccccn2 34a_100000086748_100000721315 [0,1,0,0,0,0|2,0,0]=3 3381 B17R2.5301 Fc1cccc(n1)COCc2cccnc2 34a_100000086748_100000733263 [0,1,0,0,0,0|2,0,0]=3 3382 B17R2.5301 Fc1cccc(n1)COCc2cccnn2 34a_100000086748_100016990269 [0,1,0,0,0,0|3,0,0]=4 3383 B17R2.5301 Fc1cccc(n1)COCc2cnccn2 34a_100000086748_100016995436 [0,1,0,0,0,0|3,0,0]=4 3384 B17R2.5301 Fc1cccc(n1)COCc2cncnc2 34a_100000086748_100015196519 [0,1,0,0,0,0|3,0,0]=4 3385 B17R2.5301 Fc1cccc(n1)COCc2ncccn2 34a_100000086748_100000703007 [0,1,0,0,0,0|3,0,0]=4 3386 B17R2.5301 Fc1cccc(n1)CSCc2ccccc2 62a_100000211182_100009819644 [0,1,0,0,0,0|1,1,0]=3 3387 B17R2.5301 Fc1cccc(n1)CSCc2ccccc2 62a_100009819644_100015291786 [0,1,0,0,0,0|1,1,0]=3 3388 B17R2.5301 Fc1cccc(n1)CSCc2ccccn2 62a_100000721315_100009819644 [0,1,0,0,0,0|2,1,0]=4 3389 B17R2.5301 Fc1cccc(n1)CSCc2ccccn2 62a_100009819644_100000721315 [0,1,0,0,0,0|2,1,0]=4 3390 B17R2.5301 Fc1cccc(n1)CSCc2cccnc2 62a_100000741622_100009819644 [0,1,0,0,0,0|2,1,0]=4 3391 B17R2.5301 Fc1cccc(n1)CSCc2cccnc2 62a_100009819644_100000741622 [0,1,0,0,0,0|2,1,0]=4 3392 B17R2.5301 Fc1cccc(n1)CSCc2ccncc2 62a_100009819644_100015193705 [0,1,0,0,0,0|2,1,0]=4 3393 B17R2.5301 Fc1cccc(n1)CSCc2ccncc2 62a_100015193705_100009819644 [0,1,0,0,0,0|2,1,0]=4 3394 B17R2.5301 Fc1cccc(n1)NCCc2ccccc2 27a_100000106460_100009815982 [0,1,0,0,0,0|3,0,0]=4 3395 B17R2.5301 Fc1cccc(n1)OCCc2ccccc2 34a_100011432558_100000765856 [0,1,0,0,0,0|3,0,0]=4 3396 B17R2.5301 Fc1cccc(n1)SCCc2ccccc2 62a_100000765856_100009815982 [0,1,0,0,0,0|3,0,0]=4 3397 B17R2.5301 Fc1cccc(n1)SCCc2ccccc2 62a_100009815982_100011218657 [0,1,0,0,0,0|3,0,0]=4 3398 B17R2.5301 Fc1ccnc(c1)C=CCc2ccccc2 271570a_200016263579_100009817058 [0,1,0,0,0,0|2,0,1]=4 3399 B17R2.5301 Fc1ccnc(c1)NCCc2ccccc2 27a_100000106460_100000764206 [0,1,0,0,0,0|3,0,0]=4 3400 B17R2.5301 Fc1ccnc(c1)SCCc2ccccc2 62a_100000764206_100011218657 [0,1,0,0,0,0|3,0,0]=4 3401 B17R2.5301 Fc1ccnc(c1)SCCc2ccccc2 62a_100000765856_100000764206 [0,1,0,0,0,0|3,0,0]=4 3402 B17R2.5301 Fc1cncc(c1)C=CCc2ccccc2 271570a_200016263579_100000744099 [0,1,0,0,0,0|2,0,1]=4 3403 B17R2.5301 Fc1cncc(c1)CNCc2ccccc2 207a_100011962886_100015611070 [0,1,0,0,0,0|2,0,0]=3 3404 B17R2.5301 Fc1cncc(c1)CNCc2ccccc2 207a_100015324214_100011361476 [0,1,0,0,0,0|2,0,0]=3 3405 B17R2.5301 Fc1cncc(c1)CNCc2ccccc2 2230a_100011962886_100015291786 [0,1,0,0,0,0|2,0,0]=3 3406 B17R2.5301 Fc1cncc(c1)CNCc2ccccc2 2230a_100015324214_100000725299 [0,1,0,0,0,0|2,0,0]=3 3407 B17R2.5301 Fc1cncc(c1)CNCc2ccccc2 270004a_100011962886_100015611070 [0,1,0,0,0,0|2,0,0]=3 3408 B17R2.5301 Fc1cncc(c1)CNCc2ccccc2 270004a_100015324214_100011361476 [0,1,0,0,0,0|2,0,0]=3 3409 B17R2.5301 Fc1cncc(c1)CNCc2ccccc2 34a_100011962886_100015291786 [0,1,0,0,0,0|2,0,0]=3 3410 B17R2.5301 Fc1cncc(c1)CNCc2ccccc2 34a_100015324214_100000725299 [0,1,0,0,0,0|2,0,0]=3 3411 B17R2.5301 Fc1cncc(c1)CNCc2ccccn2 207a_100011962886_100000209966 [0,1,0,0,0,0|3,0,0]=4 3412 B17R2.5301 Fc1cncc(c1)CNCc2ccccn2 2230a_100011962886_100000721315 [0,1,0,0,0,0|3,0,0]=4 3413 B17R2.5301 Fc1cncc(c1)CNCc2ccccn2 270004a_100000210449_100011361476 [0,1,0,0,0,0|3,0,0]=4 3414 B17R2.5301 Fc1cncc(c1)CNCc2ccccn2 270004a_100011962886_100000209966 [0,1,0,0,0,0|3,0,0]=4 3415 B17R2.5301 Fc1cncc(c1)CNCc2ccccn2 34a_100011962886_100000721315 [0,1,0,0,0,0|3,0,0]=4 3416 B17R2.5301 Fc1cncc(c1)CNCc2cccnc2 207a_100000210453_100011361476 [0,1,0,0,0,0|3,0,0]=4 3417 B17R2.5301 Fc1cncc(c1)CNCc2cccnc2 207a_100011962886_100000209961 [0,1,0,0,0,0|3,0,0]=4 3418 B17R2.5301 Fc1cncc(c1)CNCc2cccnc2 2230a_100011962886_100000741622 [0,1,0,0,0,0|3,0,0]=4 3419 B17R2.5301 Fc1cncc(c1)CNCc2cccnc2 270004a_100000210453_100011361476 [0,1,0,0,0,0|3,0,0]=4 3420 B17R2.5301 Fc1cncc(c1)CNCc2cccnc2 270004a_100011962886_100000209961 [0,1,0,0,0,0|3,0,0]=4 3421 B17R2.5301 Fc1cncc(c1)CNCc2cccnc2 34a_100011962886_100000733263 [0,1,0,0,0,0|3,0,0]=4 3422 B17R2.5301 Fc1cncc(c1)CNCc2ccncc2 207a_100011962886_100000186114 [0,1,0,0,0,0|3,0,0]=4 3423 B17R2.5301 Fc1cncc(c1)CNCc2ccncc2 2230a_100011962886_100015193705 [0,1,0,0,0,0|3,0,0]=4 3424 B17R2.5301 Fc1cncc(c1)COCc2ccccc2 34a_100000210790_100000725299 [0,1,0,0,0,0|1,0,0]=2 3425 B17R2.5301 Fc1cncc(c1)COCc2ccccc2 34a_100011962875_100015291786 [0,1,0,0,0,0|1,0,0]=2 3426 B17R2.5301 Fc1cncc(c1)COCc2ccccc2 7a_100000210790_100000725299 [0,1,0,0,0,0|1,0,0]=2 3427 B17R2.5301 Fc1cncc(c1)COCc2ccccc2 7a_100011962875_100000211182 [0,1,0,0,0,0|1,0,0]=2 3428 B17R2.5301 Fc1cncc(c1)COCc2ccccn2 34a_100011962875_100000721315 [0,1,0,0,0,0|2,0,0]=3 3429 B17R2.5301 Fc1cncc(c1)COCc2ccccn2 7a_100011962875_100000721315 [0,1,0,0,0,0|2,0,0]=3 3430 B17R2.5301 Fc1cncc(c1)COCc2cccnc2 34a_100011962875_100000733263 [0,1,0,0,0,0|2,0,0]=3 3431 B17R2.5301 Fc1cncc(c1)COCc2cccnc2 7a_100011962875_100000741622 [0,1,0,0,0,0|2,0,0]=3 3432 B17R2.5301 Fc1cncc(c1)COCc2cccnn2 34a_100011962875_100016990269 [0,1,0,0,0,0|3,0,0]=4 3433 B17R2.5301 Fc1cncc(c1)COCc2cccnn2 7a_100011962875_100016990269 [0,1,0,0,0,0|3,0,0]=4 3434 B17R2.5301 Fc1cncc(c1)COCc2ccncc2 7a_100011962875_100015193705 [0,1,0,0,0,0|2,0,0]=3 3435 B17R2.5301 Fc1cncc(c1)COCc2cnccn2 34a_100011962875_100016995436 [0,1,0,0,0,0|3,0,0]=4 3436 B17R2.5301 Fc1cncc(c1)COCc2cnccn2 7a_100011962875_100016995436 [0,1,0,0,0,0|3,0,0]=4 3437 B17R2.5301 Fc1cncc(c1)COCc2cncnc2 34a_100011962875_100015196519 [0,1,0,0,0,0|3,0,0]=4 3438 B17R2.5301 Fc1cncc(c1)COCc2cncnc2 7a_100011962875_100015196519 [0,1,0,0,0,0|3,0,0]=4 3439 B17R2.5301 Fc1cncc(c1)COCc2ncccn2 34a_100011962875_100000703007 [0,1,0,0,0,0|3,0,0]=4 3440 B17R2.5301 Fc1cncc(c1)COCc2ncccn2 7a_100011962875_100000703007 [0,1,0,0,0,0|3,0,0]=4 3441 B17R2.5301 Fc1cncc(c1)CSCc2ccccc2 62a_100000211182_100000725299 [0,1,0,0,0,0|1,1,0]=3 3442 B17R2.5301 Fc1cncc(c1)CSCc2ccccc2 62a_100000725299_100015291786 [0,1,0,0,0,0|1,1,0]=3 3443 B17R2.5301 Fc1cncc(c1)CSCc2ccccn2 62a_100000721315_100000725299 [0,1,0,0,0,0|2,1,0]=4 3444 B17R2.5301 Fc1cncc(c1)CSCc2ccccn2 62a_100000725299_100000721315 [0,1,0,0,0,0|2,1,0]=4 3445 B17R2.5301 Fc1cncc(c1)CSCc2cccnc2 62a_100000725299_100000741622 [0,1,0,0,0,0|2,1,0]=4 3446 B17R2.5301 Fc1cncc(c1)CSCc2cccnc2 62a_100000741622_100000725299 [0,1,0,0,0,0|2,1,0]=4 3447 B17R2.5301 Fc1cncc(c1)CSCc2ccncc2 62a_100000725299_100015193705 [0,1,0,0,0,0|2,1,0]=4 3448 B17R2.5301 Fc1cncc(c1)CSCc2ccncc2 62a_100015193705_100000725299 [0,1,0,0,0,0|2,1,0]=4 3449 B17R2.5301 Fc1cncc(c1)OCCc2ccccc2 34a_100011830296_100000765856 [0,1,0,0,0,0|3,0,0]=4 3450 B17R2.5301 Fc1cncc(c1)OCCc2ccccc2 7a_100011830296_100000765856 [0,1,0,0,0,0|3,0,0]=4 3451 B17R2.5301 Fc1cncc(c1)SCCc2ccccc2 62a_100000744099_100011218657 [0,1,0,0,0,0|3,0,0]=4 3452 B17R2.5301 Fc1cncc(c1)SCCc2ccccc2 62a_100000765856_100000744099 [0,1,0,0,0,0|3,0,0]=4 3453 B17R2.5301 Ic1cccc(c1)C=NNc2ccccc2 4a_100015195140_100000014684 [0,1,0,0,0,0|2,0,1]=4 3454 B17R2.5301 Ic1cccc(c1)CNCc2ccccc2 207a_100000106179_100015611070 [0,1,0,0,0,0|1,0,0]=2 3455 B17R2.5301 Ic1cccc(c1)CNCc2ccccc2 207a_100015324214_100000014684 [0,1,0,0,0,0|1,0,0]=2 3456 B17R2.5301 Ic1cccc(c1)CNCc2ccccc2 2230a_100000106179_100015291786 [0,1,0,0,0,0|1,0,0]=2 3457 B17R2.5301 Ic1cccc(c1)CNCc2ccccc2 2230a_100015324214_100011218688 [0,1,0,0,0,0|1,0,0]=2 3458 B17R2.5301 Ic1cccc(c1)CNCc2ccccc2 270004a_100000106179_100015611070 [0,1,0,0,0,0|1,0,0]=2 3459 B17R2.5301 Ic1cccc(c1)CNCc2ccccc2 270004a_100015324214_100000014684 [0,1,0,0,0,0|1,0,0]=2 3460 B17R2.5301 Ic1cccc(c1)CNCc2ccccc2 34a_100000106179_100015291786 [0,1,0,0,0,0|1,0,0]=2 3461 B17R2.5301 Ic1cccc(c1)CNCc2ccccc2 34a_100015324214_100011218688 [0,1,0,0,0,0|1,0,0]=2 3462 B17R2.5301 Ic1cccc(c1)CNCc2ccccn2 207a_100000106179_100000209966 [0,1,0,0,0,0|2,0,0]=3 3463 B17R2.5301 Ic1cccc(c1)CNCc2ccccn2 2230a_100000106179_100000721315 [0,1,0,0,0,0|2,0,0]=3 3464 B17R2.5301 Ic1cccc(c1)CNCc2ccccn2 270004a_100000106179_100000209966 [0,1,0,0,0,0|2,0,0]=3 3465 B17R2.5301 Ic1cccc(c1)CNCc2ccccn2 270004a_100000210449_100000014684 [0,1,0,0,0,0|2,0,0]=3 3466 B17R2.5301 Ic1cccc(c1)CNCc2ccccn2 34a_100000106179_100000721315 [0,1,0,0,0,0|2,0,0]=3 3467 B17R2.5301 Ic1cccc(c1)CNCc2cccnc2 207a_100000106179_100000209961 [0,1,0,0,0,0|2,0,0]=3 3468 B17R2.5301 Ic1cccc(c1)CNCc2cccnc2 207a_100000210453_100000014684 [0,1,0,0,0,0|2,0,0]=3 3469 B17R2.5301 Ic1cccc(c1)CNCc2cccnc2 2230a_100000106179_100000741622 [0,1,0,0,0,0|2,0,0]=3 3470 B17R2.5301 Ic1cccc(c1)CNCc2cccnc2 270004a_100000106179_100000209961 [0,1,0,0,0,0|2,0,0]=3 3471 B17R2.5301 Ic1cccc(c1)CNCc2cccnc2 270004a_100000210453_100000014684 [0,1,0,0,0,0|2,0,0]=3 3472 B17R2.5301 Ic1cccc(c1)CNCc2cccnc2 34a_100000106179_100000733263 [0,1,0,0,0,0|2,0,0]=3 3473 B17R2.5301 Ic1cccc(c1)CNCc2cccnn2 2230a_100000106179_100016990269 [0,1,0,0,0,0|3,0,0]=4 3474 B17R2.5301 Ic1cccc(c1)CNCc2cccnn2 2230a_100159270163_100011218688 [0,1,0,0,0,0|3,0,0]=4 3475 B17R2.5301 Ic1cccc(c1)CNCc2cccnn2 34a_100000106179_100016990269 [0,1,0,0,0,0|3,0,0]=4 3476 B17R2.5301 Ic1cccc(c1)CNCc2ccncc2 207a_100000106179_100000186114 [0,1,0,0,0,0|2,0,0]=3 3477 B17R2.5301 Ic1cccc(c1)CNCc2ccncc2 2230a_100000106179_100015193705 [0,1,0,0,0,0|2,0,0]=3 3478 B17R2.5301 Ic1cccc(c1)CNCc2ccnnc2 270004a_100000106179_100011934578 [0,1,0,0,0,0|3,0,0]=4 3479 B17R2.5301 Ic1cccc(c1)CNCc2cnccn2 2230a_100000106179_100016995436 [0,1,0,0,0,0|3,0,0]=4 3480 B17R2.5301 Ic1cccc(c1)CNCc2cnccn2 270004a_100000106179_100000749867 [0,1,0,0,0,0|3,0,0]=4 3481 B17R2.5301 Ic1cccc(c1)CNCc2cnccn2 34a_100000106179_100016995436 [0,1,0,0,0,0|3,0,0]=4 3482 B17R2.5301 Ic1cccc(c1)CNCc2cncnc2 207a_100011243677_100000014684 [0,1,0,0,0,0|3,0,0]=4 3483 B17R2.5301 Ic1cccc(c1)CNCc2cncnc2 2230a_100000106179_100015196519 [0,1,0,0,0,0|3,0,0]=4 3484 B17R2.5301 Ic1cccc(c1)CNCc2cncnc2 2230a_100011243677_100011218688 [0,1,0,0,0,0|3,0,0]=4 3485 B17R2.5301 Ic1cccc(c1)CNCc2cncnc2 270004a_100000106179_100000749868 [0,1,0,0,0,0|3,0,0]=4 3486 B17R2.5301 Ic1cccc(c1)CNCc2cncnc2 270004a_100011243677_100000014684 [0,1,0,0,0,0|3,0,0]=4 3487 B17R2.5301 Ic1cccc(c1)CNCc2cncnc2 34a_100000106179_100015196519 [0,1,0,0,0,0|3,0,0]=4 3488 B17R2.5301 Ic1cccc(c1)CNCc2ncccn2 2230a_100000106179_100000703007 [0,1,0,0,0,0|3,0,0]=4 3489 B17R2.5301 Ic1cccc(c1)CNCc2ncccn2 270004a_100000106179_100011532527 [0,1,0,0,0,0|3,0,0]=4 3490 B17R2.5301 Ic1cccc(c1)CNCc2ncccn2 34a_100000106179_100000703007 [0,1,0,0,0,0|3,0,0]=4 3491 B17R2.5301 Ic1cccc(c1)COCc2ccccc2 34a_100000210790_100011218688 [0,1,0,0,0,0|0,0,0]=1 3492 B17R2.5301 Ic1cccc(c1)COCc2ccccc2 34a_100011215336_100015291786 [0,1,0,0,0,0|0,0,0]=1 3493 B17R2.5301 Ic1cccc(c1)COCc2ccccc2 7a_100000210790_100011218688 [0,1,0,0,0,0|0,0,0]=1 3494 B17R2.5301 Ic1cccc(c1)COCc2ccccc2 7a_100011215336_100000211182 [0,1,0,0,0,0|0,0,0]=1 3495 B17R2.5301 Ic1cccc(c1)COCc2ccccn2 34a_100011215336_100000721315 [0,1,0,0,0,0|1,0,0]=2 3496 B17R2.5301 Ic1cccc(c1)COCc2ccccn2 7a_100011215336_100000721315 [0,1,0,0,0,0|1,0,0]=2 3497 B17R2.5301 Ic1cccc(c1)COCc2cccnc2 34a_100011215336_100000733263 [0,1,0,0,0,0|1,0,0]=2 3498 B17R2.5301 Ic1cccc(c1)COCc2cccnc2 7a_100011215336_100000741622 [0,1,0,0,0,0|1,0,0]=2 3499 B17R2.5301 Ic1cccc(c1)COCc2cccnn2 34a_100011215336_100016990269 [0,1,0,0,0,0|2,0,0]=3 3500 B17R2.5301 Ic1cccc(c1)COCc2cccnn2 7a_100011215336_100016990269 [0,1,0,0,0,0|2,0,0]=3 3501 B17R2.5301 Ic1cccc(c1)COCc2ccncc2 7a_100011215336_100015193705 [0,1,0,0,0,0|1,0,0]=2 3502 B17R2.5301 Ic1cccc(c1)COCc2cnccn2 34a_100011215336_100016995436 [0,1,0,0,0,0|2,0,0]=3 3503 B17R2.5301 Ic1cccc(c1)COCc2cnccn2 7a_100011215336_100016995436 [0,1,0,0,0,0|2,0,0]=3 3504 B17R2.5301 Ic1cccc(c1)COCc2cncnc2 34a_100011215336_100015196519 [0,1,0,0,0,0|2,0,0]=3 3505 B17R2.5301 Ic1cccc(c1)COCc2cncnc2 7a_100011215336_100015196519 [0,1,0,0,0,0|2,0,0]=3 3506 B17R2.5301 Ic1cccc(c1)COCc2ncccn2 34a_100011215336_100000703007 [0,1,0,0,0,0|2,0,0]=3 3507 B17R2.5301 Ic1cccc(c1)COCc2ncccn2 7a_100011215336_100000703007 [0,1,0,0,0,0|2,0,0]=3 3508 B17R2.5301 Ic1cccc(c1)CSCc2ccccc2 62a_100000211182_100011218688 [0,1,0,0,0,0|0,1,0]=2 3509 B17R2.5301 Ic1cccc(c1)CSCc2ccccc2 62a_100011218688_100015291786 [0,1,0,0,0,0|0,1,0]=2 3510 B17R2.5301 Ic1cccc(c1)CSCc2ccccn2 62a_100000721315_100011218688 [0,1,0,0,0,0|1,1,0]=3 3511 B17R2.5301 Ic1cccc(c1)CSCc2ccccn2 62a_100011218688_100000721315 [0,1,0,0,0,0|1,1,0]=3 3512 B17R2.5301 Ic1cccc(c1)CSCc2cccnc2 62a_100000741622_100011218688 [0,1,0,0,0,0|1,1,0]=3 3513 B17R2.5301 Ic1cccc(c1)CSCc2cccnc2 62a_100011218688_100000741622 [0,1,0,0,0,0|1,1,0]=3 3514 B17R2.5301 Ic1cccc(c1)CSCc2cccnn2 62a_100011218688_100016990269 [0,1,0,0,0,0|2,1,0]=4 3515 B17R2.5301 Ic1cccc(c1)CSCc2cccnn2 62a_100016990269_100011218688 [0,1,0,0,0,0|2,1,0]=4 3516 B17R2.5301 Ic1cccc(c1)CSCc2ccncc2 62a_100011218688_100015193705 [0,1,0,0,0,0|1,1,0]=3 3517 B17R2.5301 Ic1cccc(c1)CSCc2ccncc2 62a_100015193705_100011218688 [0,1,0,0,0,0|1,1,0]=3 3518 B17R2.5301 Ic1cccc(c1)CSCc2cnccn2 62a_100011218688_100016995436 [0,1,0,0,0,0|2,1,0]=4 3519 B17R2.5301 Ic1cccc(c1)CSCc2cnccn2 62a_100016995436_100011218688 [0,1,0,0,0,0|2,1,0]=4 3520 B17R2.5301 Ic1cccc(c1)CSCc2cncnc2 62a_100011218688_100015196519 [0,1,0,0,0,0|2,1,0]=4 3521 B17R2.5301 Ic1cccc(c1)CSCc2cncnc2 62a_100015196519_100011218688 [0,1,0,0,0,0|2,1,0]=4 3522 B17R2.5301 Ic1cccc(c1)CSCc2ncccn2 62a_100000703007_100011218688 [0,1,0,0,0,0|2,1,0]=4 3523 B17R2.5301 Ic1cccc(c1)CSCc2ncccn2 62a_100011218688_100000703007 [0,1,0,0,0,0|2,1,0]=4 3524 B17R2.5301 Ic1cccc(c1)NCCc2ccccc2 34a_100000211102_100000765856 [0,1,0,0,0,0|2,0,0]=3 3525 B17R2.5301 Ic1cccc(c1)NN=Cc2ccccc2 4a_100020605690_100015611070 [0,1,0,0,0,0|2,0,1]=4 3526 B17R2.5301 Ic1cccc(c1)OCCc2ccccc2 34a_100000211634_100000765856 [0,1,0,0,0,0|2,0,0]=3 3527 B17R2.5301 Ic1cccc(c1)OCCc2ccccc2 7a_100000211634_100000765856 [0,1,0,0,0,0|2,0,0]=3 3528 B17R2.5301 Ic1cccc(c1)OCCc2ccccn2 7a_100000211634_100015183660 [0,1,0,0,0,0|3,0,0]=4 3529 B17R2.5301 Ic1cccc(c1)OCCc2cccnc2 7a_100000211634_200011713674 [0,1,0,0,0,0|3,0,0]=4 3530 B17R2.5301 Ic1cccc(c1)OCCc2ccncc2 7a_100000211634_100000723409 [0,1,0,0,0,0|3,0,0]=4 3531 B17R2.5301 Nc1cc(ccn1)C=CCc2ccccc2 271570a_200016263579_100000744379 [0,1,0,0,0,0|2,0,1]=4 3532 B17R2.5301 Nc1cc(ccn1)OCCc2ccccc2 34a_100011834064_100000765856 [0,1,0,0,0,0|3,0,0]=4 3533 B17R2.5301 Nc1cc(ccn1)SCCc2ccccc2 62a_100000049665_100011218657 [0,1,0,0,0,0|3,0,0]=4 3534 B17R2.5301 Nc1cc(ccn1)SCCc2ccccc2 62a_100000765856_100000049665 [0,1,0,0,0,0|3,0,0]=4 3535 B17R2.5301 Nc1cccc(c1)C=CCc2ccccc2 271570a_200016263579_100000210019 [0,1,0,0,0,0|1,0,1]=3 3536 B17R2.5301 Nc1cccc(c1)COCc2ccccc2 34a_100000211919_100015291786 [0,1,0,0,0,0|0,0,0]=1 3537 B17R2.5301 Nc1cccc(c1)COCc2ccccn2 34a_100000211919_100000721315 [0,1,0,0,0,0|1,0,0]=2 3538 B17R2.5301 Nc1cccc(c1)COCc2cccnc2 34a_100000211919_100000733263 [0,1,0,0,0,0|1,0,0]=2 3539 B17R2.5301 Nc1cccc(c1)COCc2cccnn2 34a_100000211919_100016990269 [0,1,0,0,0,0|2,0,0]=3 3540 B17R2.5301 Nc1cccc(c1)COCc2cnccn2 34a_100000211919_100016995436 [0,1,0,0,0,0|2,0,0]=3 3541 B17R2.5301 Nc1cccc(c1)COCc2cncnc2 34a_100000211919_100015196519 [0,1,0,0,0,0|2,0,0]=3 3542 B17R2.5301 Nc1cccc(c1)COCc2ncccn2 34a_100000211919_100000703007 [0,1,0,0,0,0|2,0,0]=3 3543 B17R2.5301 Nc1cccc(c1)OCCc2ccccc2 34a_100000210217_100000765856 [0,1,0,0,0,0|2,0,0]=3 3544 B17R2.5301 Nc1cccc(c1)SCCc2ccccc2 62a_100000210019_100011218657 [0,1,0,0,0,0|2,0,0]=3 3545 B17R2.5301 Nc1cccc(c1)SCCc2ccccc2 62a_100000765856_100000210019 [0,1,0,0,0,0|2,0,0]=3 3546 B17R2.5301 Nc1cccc(c1)SCCc2ccccn2 62a_100000210019_100015183660 [0,1,0,0,0,0|3,0,0]=4 3547 B17R2.5301 Nc1cccc(c1)SCCc2ccccn2 62a_100015183660_100000210019 [0,1,0,0,0,0|3,0,0]=4 3548 B17R2.5301 Nc1cccc(c1)SCCc2cccnc2 62a_100000210019_200011713674 [0,1,0,0,0,0|3,0,0]=4 3549 B17R2.5301 Nc1cccc(c1)SCCc2cccnc2 62a_200011713674_100000210019 [0,1,0,0,0,0|3,0,0]=4 3550 B17R2.5301 Nc1cccc(c1)SCCc2ccncc2 62a_100000210019_100000723409 [0,1,0,0,0,0|3,0,0]=4 3551 B17R2.5301 Nc1cccc(c1)SCCc2ccncc2 62a_100000723409_100000210019 [0,1,0,0,0,0|3,0,0]=4 3552 B17R2.5301 Nc1cccc(c1)SCSc2ccccc2 62a_100000210019_100011218342 [0,1,0,0,0,0|3,0,0]=4 3553 B17R2.5301 Nc1cccc(c1)SCSc2ccccc2 62a_100011218342_100000210019 [0,1,0,0,0,0|3,0,0]=4 3554 B17R2.5301 Nc1cccc(n1)C=CCc2ccccc2 271570a_200016263579_100000740741 [0,1,0,0,0,0|2,0,1]=4 3555 B17R2.5301 Nc1cccc(n1)SCCc2ccccc2 62a_100000740741_100011218657 [0,1,0,0,0,0|3,0,0]=4 3556 B17R2.5301 Nc1cccc(n1)SCCc2ccccc2 62a_100000765856_100000740741 [0,1,0,0,0,0|3,0,0]=4 3557 B17R2.5301 Nc1ccnc(c1)C=CCc2ccccc2 271570a_200016263579_100009814236 [0,1,0,0,0,0|2,0,1]=4 3558 B17R2.5301 Nc1ccnc(c1)COCc2ccccc2 34a_100000692640_100015291786 [0,1,0,0,0,0|1,0,0]=2 3559 B17R2.5301 Nc1ccnc(c1)COCc2ccccn2 34a_100000692640_100000721315 [0,1,0,0,0,0|2,0,0]=3 3560 B17R2.5301 Nc1ccnc(c1)COCc2cccnc2 34a_100000692640_100000733263 [0,1,0,0,0,0|2,0,0]=3 3561 B17R2.5301 Nc1ccnc(c1)COCc2cccnn2 34a_100000692640_100016990269 [0,1,0,0,0,0|3,0,0]=4 3562 B17R2.5301 Nc1ccnc(c1)COCc2cnccn2 34a_100000692640_100016995436 [0,1,0,0,0,0|3,0,0]=4 3563 B17R2.5301 Nc1ccnc(c1)COCc2cncnc2 34a_100000692640_100015196519 [0,1,0,0,0,0|3,0,0]=4 3564 B17R2.5301 Nc1ccnc(c1)COCc2ncccn2 34a_100000692640_100000703007 [0,1,0,0,0,0|3,0,0]=4 3565 B17R2.5301 Nc1ccnc(c1)SCCc2ccccc2 62a_100000765856_100009814236 [0,1,0,0,0,0|3,0,0]=4 3566 B17R2.5301 Nc1ccnc(c1)SCCc2ccccc2 62a_100009814236_100011218657 [0,1,0,0,0,0|3,0,0]=4 3567 B17R2.5301 Nc1cncc(c1)C=CCc2ccccc2 271570a_200016263579_100000687067 [0,1,0,0,0,0|2,0,1]=4 3568 B17R2.5301 Nc1cncc(c1)COCc2ccccc2 34a_100000085308_100015291786 [0,1,0,0,0,0|1,0,0]=2 3569 B17R2.5301 Nc1cncc(c1)COCc2ccccn2 34a_100000085308_100000721315 [0,1,0,0,0,0|2,0,0]=3 3570 B17R2.5301 Nc1cncc(c1)COCc2cccnc2 34a_100000085308_100000733263 [0,1,0,0,0,0|2,0,0]=3 3571 B17R2.5301 Nc1cncc(c1)COCc2cccnn2 34a_100000085308_100016990269 [0,1,0,0,0,0|3,0,0]=4 3572 B17R2.5301 Nc1cncc(c1)COCc2cnccn2 34a_100000085308_100016995436 [0,1,0,0,0,0|3,0,0]=4 3573 B17R2.5301 Nc1cncc(c1)COCc2cncnc2 34a_100000085308_100015196519 [0,1,0,0,0,0|3,0,0]=4 3574 B17R2.5301 Nc1cncc(c1)COCc2ncccn2 34a_100000085308_100000703007 [0,1,0,0,0,0|3,0,0]=4 3575 B17R2.5301 Nc1cncc(c1)OCCc2ccccc2 34a_100011997051_100000765856 [0,1,0,0,0,0|3,0,0]=4 3576 B17R2.5301 Nc1cncc(c1)SCCc2ccccc2 62a_100000687067_100011218657 [0,1,0,0,0,0|3,0,0]=4 3577 B17R2.5301 Nc1cncc(c1)SCCc2ccccc2 62a_100000765856_100000687067 [0,1,0,0,0,0|3,0,0]=4 3578 B17R2.5301 O=c1cc(cc[nH]1)C=CCc2ccccc2 271570a_200016263579_100009816521 [0,1,0,0,0,0|2,0,1]=4 3579 B17R2.5301 O=c1cc(cc[nH]1)NCCc2ccccc2 27a_100000106460_100000061649 [0,1,0,0,0,0|3,0,0]=4 3580 B17R2.5301 O=c1cc(cc[nH]1)OCCc2ccccc2 34a_100000032262_100000765856 [0,1,0,0,0,0|3,0,0]=4 3581 B17R2.5301 O=c1cc(cc[nH]1)SCCc2ccccc2 62a_100000765856_100009816521 [0,1,0,0,0,0|3,0,0]=4 3582 B17R2.5301 O=c1cc(cc[nH]1)SCCc2ccccc2 62a_100009816521_100011218657 [0,1,0,0,0,0|3,0,0]=4 3583 B17R2.5301 O=c1cc[nH]c(c1)SCCc2ccccc2 62a_100009817434_100011218657 [0,1,0,0,0,0|3,0,0]=4 3584 B17R2.5301 O=c1cccc([nH]1)C=CCc2ccccc2 271570a_200016263579_100000761760 [0,1,0,0,0,0|2,0,1]=4 3585 B17R2.5301 O=c1cccc([nH]1)CNCc2ccccc2 207a_100015324214_100011935257 [0,1,0,0,0,0|2,0,0]=3 3586 B17R2.5301 O=c1cccc([nH]1)CNCc2ccccc2 2230a_100000696482_100015291786 [0,1,0,0,0,0|2,0,0]=3 3587 B17R2.5301 O=c1cccc([nH]1)CNCc2ccccn2 2230a_100000696482_100000721315 [0,1,0,0,0,0|3,0,0]=4 3588 B17R2.5301 O=c1cccc([nH]1)CNCc2cccnc2 207a_100000210453_100011935257 [0,1,0,0,0,0|3,0,0]=4 3589 B17R2.5301 O=c1cccc([nH]1)CNCc2cccnc2 2230a_100000696482_100000741622 [0,1,0,0,0,0|3,0,0]=4 3590 B17R2.5301 O=c1cccc([nH]1)CNCc2ccncc2 2230a_100000696482_100015193705 [0,1,0,0,0,0|3,0,0]=4 3591 B17R2.5301 O=c1cccc([nH]1)OCCc2ccccc2 34a_100000033347_100000765856 [0,1,0,0,0,0|3,0,0]=4 3592 B17R2.5301 O=c1cccc([nH]1)SCCc2ccccc2 62a_100000765856_100000752884 [0,1,0,0,0,0|3,0,0]=4 3593 B17R2.5301 Oc1cc(ccn1)CNCc2ccccc2 207a_100015324214_100000688113 [0,1,0,0,0,0|2,0,0]=3 3594 B17R2.5301 Oc1cc(ccn1)CNCc2cccnc2 207a_100000210453_100000688113 [0,1,0,0,0,0|3,0,0]=4 3595 B17R2.5301 Oc1cccc(c1)C=CCc2ccccc2 271570a_200016263579_100000211634 [0,1,0,0,0,0|1,0,1]=3 3596 B17R2.5301 Oc1cccc(c1)C=NNc2ccccc2 4a_100015195140_100000188321 [0,1,0,0,0,0|2,0,1]=4 3597 B17R2.5301 Oc1cccc(c1)CNCc2ccccc2 207a_100000743036_100015611070 [0,1,0,0,0,0|1,0,0]=2 3598 B17R2.5301 Oc1cccc(c1)CNCc2ccccc2 207a_100015324214_100000188321 [0,1,0,0,0,0|1,0,0]=2 3599 B17R2.5301 Oc1cccc(c1)CNCc2ccccc2 2230a_100000743036_100015291786 [0,1,0,0,0,0|1,0,0]=2 3600 B17R2.5301 Oc1cccc(c1)CNCc2ccccc2 2230a_100015324214_100011660834 [0,1,0,0,0,0|1,0,0]=2 3601 B17R2.5301 Oc1cccc(c1)CNCc2ccccc2 270004a_100000743036_100015611070 [0,1,0,0,0,0|1,0,0]=2 3602 B17R2.5301 Oc1cccc(c1)CNCc2ccccc2 270004a_100015324214_100000188321 [0,1,0,0,0,0|1,0,0]=2 3603 B17R2.5301 Oc1cccc(c1)CNCc2ccccc2 34a_100000743036_100015291786 [0,1,0,0,0,0|1,0,0]=2 3604 B17R2.5301 Oc1cccc(c1)CNCc2ccccc2 34a_100015324214_100011660834 [0,1,0,0,0,0|1,0,0]=2 3605 B17R2.5301 Oc1cccc(c1)CNCc2ccccn2 207a_100000743036_100000209966 [0,1,0,0,0,0|2,0,0]=3 3606 B17R2.5301 Oc1cccc(c1)CNCc2ccccn2 2230a_100000743036_100000721315 [0,1,0,0,0,0|2,0,0]=3 3607 B17R2.5301 Oc1cccc(c1)CNCc2ccccn2 270004a_100000210449_100000188321 [0,1,0,0,0,0|2,0,0]=3 3608 B17R2.5301 Oc1cccc(c1)CNCc2ccccn2 270004a_100000743036_100000209966 [0,1,0,0,0,0|2,0,0]=3 3609 B17R2.5301 Oc1cccc(c1)CNCc2ccccn2 34a_100000743036_100000721315 [0,1,0,0,0,0|2,0,0]=3 3610 B17R2.5301 Oc1cccc(c1)CNCc2cccnc2 207a_100000210453_100000188321 [0,1,0,0,0,0|2,0,0]=3 3611 B17R2.5301 Oc1cccc(c1)CNCc2cccnc2 207a_100000743036_100000209961 [0,1,0,0,0,0|2,0,0]=3 3612 B17R2.5301 Oc1cccc(c1)CNCc2cccnc2 2230a_100000743036_100000741622 [0,1,0,0,0,0|2,0,0]=3 3613 B17R2.5301 Oc1cccc(c1)CNCc2cccnc2 270004a_100000210453_100000188321 [0,1,0,0,0,0|2,0,0]=3 3614 B17R2.5301 Oc1cccc(c1)CNCc2cccnc2 270004a_100000743036_100000209961 [0,1,0,0,0,0|2,0,0]=3 3615 B17R2.5301 Oc1cccc(c1)CNCc2cccnc2 34a_100000743036_100000733263 [0,1,0,0,0,0|2,0,0]=3 3616 B17R2.5301 Oc1cccc(c1)CNCc2cccnn2 2230a_100000743036_100016990269 [0,1,0,0,0,0|3,0,0]=4 3617 B17R2.5301 Oc1cccc(c1)CNCc2cccnn2 2230a_100159270163_100011660834 [0,1,0,0,0,0|3,0,0]=4 3618 B17R2.5301 Oc1cccc(c1)CNCc2cccnn2 34a_100000743036_100016990269 [0,1,0,0,0,0|3,0,0]=4 3619 B17R2.5301 Oc1cccc(c1)CNCc2ccncc2 207a_100000743036_100000186114 [0,1,0,0,0,0|2,0,0]=3 3620 B17R2.5301 Oc1cccc(c1)CNCc2ccncc2 2230a_100000743036_100015193705 [0,1,0,0,0,0|2,0,0]=3 3621 B17R2.5301 Oc1cccc(c1)CNCc2ccnnc2 270004a_100000743036_100011934578 [0,1,0,0,0,0|3,0,0]=4 3622 B17R2.5301 Oc1cccc(c1)CNCc2cnccn2 2230a_100000743036_100016995436 [0,1,0,0,0,0|3,0,0]=4 3623 B17R2.5301 Oc1cccc(c1)CNCc2cnccn2 270004a_100000743036_100000749867 [0,1,0,0,0,0|3,0,0]=4 3624 B17R2.5301 Oc1cccc(c1)CNCc2cnccn2 34a_100000743036_100016995436 [0,1,0,0,0,0|3,0,0]=4 3625 B17R2.5301 Oc1cccc(c1)CNCc2cncnc2 207a_100011243677_100000188321 [0,1,0,0,0,0|3,0,0]=4 3626 B17R2.5301 Oc1cccc(c1)CNCc2cncnc2 2230a_100000743036_100015196519 [0,1,0,0,0,0|3,0,0]=4 3627 B17R2.5301 Oc1cccc(c1)CNCc2cncnc2 2230a_100011243677_100011660834 [0,1,0,0,0,0|3,0,0]=4 3628 B17R2.5301 Oc1cccc(c1)CNCc2cncnc2 270004a_100000743036_100000749868 [0,1,0,0,0,0|3,0,0]=4 3629 B17R2.5301 Oc1cccc(c1)CNCc2cncnc2 270004a_100011243677_100000188321 [0,1,0,0,0,0|3,0,0]=4 3630 B17R2.5301 Oc1cccc(c1)CNCc2cncnc2 34a_100000743036_100015196519 [0,1,0,0,0,0|3,0,0]=4 3631 B17R2.5301 Oc1cccc(c1)CNCc2ncccn2 2230a_100000743036_100000703007 [0,1,0,0,0,0|3,0,0]=4 3632 B17R2.5301 Oc1cccc(c1)CNCc2ncccn2 270004a_100000743036_100011532527 [0,1,0,0,0,0|3,0,0]=4 3633 B17R2.5301 Oc1cccc(c1)CNCc2ncccn2 34a_100000743036_100000703007 [0,1,0,0,0,0|3,0,0]=4 3634 B17R2.5301 Oc1cccc(c1)COCc2ccccc2 34a_100000210790_100011660834 [0,1,0,0,0,0|0,0,0]=1 3635 B17R2.5301 Oc1cccc(c1)COCc2ccccc2 7a_100000210790_100000084143 [0,1,0,0,0,0|0,0,0]=1 3636 B17R2.5301 Oc1cccc(c1)CSCc2ccccc2 62a_100000211182_100011660834 [0,1,0,0,0,0|0,1,0]=2 3637 B17R2.5301 Oc1cccc(c1)CSCc2ccccc2 62a_100011660834_100015291786 [0,1,0,0,0,0|0,1,0]=2 3638 B17R2.5301 Oc1cccc(c1)CSCc2ccccn2 62a_100000721315_100011660834 [0,1,0,0,0,0|1,1,0]=3 3639 B17R2.5301 Oc1cccc(c1)CSCc2ccccn2 62a_100011660834_100000721315 [0,1,0,0,0,0|1,1,0]=3 3640 B17R2.5301 Oc1cccc(c1)CSCc2cccnc2 62a_100000741622_100011660834 [0,1,0,0,0,0|1,1,0]=3 3641 B17R2.5301 Oc1cccc(c1)CSCc2cccnc2 62a_100011660834_100000741622 [0,1,0,0,0,0|1,1,0]=3 3642 B17R2.5301 Oc1cccc(c1)CSCc2cccnn2 62a_100011660834_100016990269 [0,1,0,0,0,0|2,1,0]=4 3643 B17R2.5301 Oc1cccc(c1)CSCc2cccnn2 62a_100016990269_100011660834 [0,1,0,0,0,0|2,1,0]=4 3644 B17R2.5301 Oc1cccc(c1)CSCc2ccncc2 62a_100011660834_100015193705 [0,1,0,0,0,0|1,1,0]=3 3645 B17R2.5301 Oc1cccc(c1)CSCc2ccncc2 62a_100015193705_100011660834 [0,1,0,0,0,0|1,1,0]=3 3646 B17R2.5301 Oc1cccc(c1)CSCc2cnccn2 62a_100011660834_100016995436 [0,1,0,0,0,0|2,1,0]=4 3647 B17R2.5301 Oc1cccc(c1)CSCc2cnccn2 62a_100016995436_100011660834 [0,1,0,0,0,0|2,1,0]=4 3648 B17R2.5301 Oc1cccc(c1)CSCc2cncnc2 62a_100011660834_100015196519 [0,1,0,0,0,0|2,1,0]=4 3649 B17R2.5301 Oc1cccc(c1)CSCc2cncnc2 62a_100015196519_100011660834 [0,1,0,0,0,0|2,1,0]=4 3650 B17R2.5301 Oc1cccc(c1)CSCc2ncccn2 62a_100000703007_100011660834 [0,1,0,0,0,0|2,1,0]=4 3651 B17R2.5301 Oc1cccc(c1)CSCc2ncccn2 62a_100011660834_100000703007 [0,1,0,0,0,0|2,1,0]=4 3652 B17R2.5301 Oc1cccc(c1)NCCc2ccccc2 34a_100000210217_100000765856 [0,1,0,0,0,0|2,0,0]=3 3653 B17R2.5301 Oc1cccc(c1)SCCc2ccccc2 62a_100000765856_100000211634 [0,1,0,0,0,0|2,0,0]=3 3654 B17R2.5301 Oc1cccc(c1)SCCc2ccccn2 62a_100015183660_100000211634 [0,1,0,0,0,0|3,0,0]=4 3655 B17R2.5301 Oc1cccc(c1)SCCc2cccnc2 62a_200011713674_100000211634 [0,1,0,0,0,0|3,0,0]=4 3656 B17R2.5301 Oc1cccc(c1)SCCc2ccncc2 62a_100000723409_100000211634 [0,1,0,0,0,0|3,0,0]=4 3657 B17R2.5301 Oc1cccc(c1)SCSc2ccccc2 62a_100011218342_100000211634 [0,1,0,0,0,0|3,0,0]=4 3658 B17R2.5301 Oc1ccnc(c1)C=CCc2ccccc2 271570a_200016263579_100000762945 [0,1,0,0,0,0|2,0,1]=4 3659 B17R2.5301 Oc1ccnc(c1)SCCc2ccccc2 62a_100000765856_100000762945 [0,1,0,0,0,0|3,0,0]=4 3660 B17R2.5301 Oc1cncc(c1)C=CCc2ccccc2 271570a_200016263579_100000754920 [0,1,0,0,0,0|2,0,1]=4 3661 B17R2.5301 Oc1cncc(c1)CNCc2ccccc2 207a_100015324214_100012187055 [0,1,0,0,0,0|2,0,0]=3 3662 B17R2.5301 Oc1cncc(c1)CNCc2ccccc2 270004a_100015324214_100012187055 [0,1,0,0,0,0|2,0,0]=3 3663 B17R2.5301 Oc1cncc(c1)CNCc2ccccn2 270004a_100000210449_100012187055 [0,1,0,0,0,0|3,0,0]=4 3664 B17R2.5301 Oc1cncc(c1)CNCc2cccnc2 207a_100000210453_100012187055 [0,1,0,0,0,0|3,0,0]=4 3665 B17R2.5301 Oc1cncc(c1)CNCc2cccnc2 270004a_100000210453_100012187055 [0,1,0,0,0,0|3,0,0]=4 3666 B17R2.5301 Oc1cncc(c1)SCCc2ccccc2 62a_100000754920_100011218657 [0,1,0,0,0,0|3,0,0]=4 3667 B17R2.5301 Oc1cncc(c1)SCCc2ccccc2 62a_100000765856_100000754920 [0,1,0,0,0,0|3,0,0]=4 3668 B17R2.5301 [O-][n+]1cccc(c1)C=CCc2ccccc2 271570a_200016263579_100009815978 [0,1,0,0,0,0|2,0,1]=4 3669 B17R2.5301 [O-][n+]1cccc(c1)COCc2ccccc2 34a_100000037817_100015291786 [0,1,0,0,0,0|1,0,0]=2 3670 B17R2.5301 [O-][n+]1cccc(c1)COCc2ccccc2 7a_100000037817_100000211182 [0,1,0,0,0,0|1,0,0]=2 3671 B17R2.5301 [O-][n+]1cccc(c1)COCc2ccccn2 34a_100000037817_100000721315 [0,1,0,0,0,0|2,0,0]=3 3672 B17R2.5301 [O-][n+]1cccc(c1)COCc2ccccn2 7a_100000037817_100000721315 [0,1,0,0,0,0|2,0,0]=3 3673 B17R2.5301 [O-][n+]1cccc(c1)COCc2cccnc2 34a_100000037817_100000733263 [0,1,0,0,0,0|2,0,0]=3 3674 B17R2.5301 [O-][n+]1cccc(c1)COCc2cccnc2 7a_100000037817_100000741622 [0,1,0,0,0,0|2,0,0]=3 3675 B17R2.5301 [O-][n+]1cccc(c1)COCc2cccnn2 34a_100000037817_100016990269 [0,1,0,0,0,0|3,0,0]=4 3676 B17R2.5301 [O-][n+]1cccc(c1)COCc2cccnn2 7a_100000037817_100016990269 [0,1,0,0,0,0|3,0,0]=4 3677 B17R2.5301 [O-][n+]1cccc(c1)COCc2ccncc2 7a_100000037817_100015193705 [0,1,0,0,0,0|2,0,0]=3 3678 B17R2.5301 [O-][n+]1cccc(c1)COCc2cnccn2 34a_100000037817_100016995436 [0,1,0,0,0,0|3,0,0]=4 3679 B17R2.5301 [O-][n+]1cccc(c1)COCc2cnccn2 7a_100000037817_100016995436 [0,1,0,0,0,0|3,0,0]=4 3680 B17R2.5301 [O-][n+]1cccc(c1)COCc2cncnc2 34a_100000037817_100015196519 [0,1,0,0,0,0|3,0,0]=4 3681 B17R2.5301 [O-][n+]1cccc(c1)COCc2cncnc2 7a_100000037817_100015196519 [0,1,0,0,0,0|3,0,0]=4 3682 B17R2.5301 [O-][n+]1cccc(c1)COCc2ncccn2 34a_100000037817_100000703007 [0,1,0,0,0,0|3,0,0]=4 3683 B17R2.5301 [O-][n+]1cccc(c1)COCc2ncccn2 7a_100000037817_100000703007 [0,1,0,0,0,0|3,0,0]=4 3684 B17R2.5301 [O-][n+]1cccc(c1)OCCc2ccccc2 34a_100000039713_100000765856 [0,1,0,0,0,0|3,0,0]=4 3685 B17R2.5301 [O-][n+]1cccc(c1)OCCc2ccccc2 7a_100000039713_100000765856 [0,1,0,0,0,0|3,0,0]=4 3686 B17R2.5301 [O-][n+]1cccc(c1)SCCc2ccccc2 62a_100000765856_100009815978 [0,1,0,0,0,0|3,0,0]=4 3687 B17R2.5301 [S]c1cccc(c1)C=CCc2ccccc2 271570a_200016263579_114929384022 [0,1,0,0,0,0|1,0,1]=3 3688 B17R2.5301 [S]c1cccc(c1)SCCc2ccccc2 62a_100000765856_114929384022 [0,1,0,0,0,0|2,0,0]=3 3689 B17R2.5301 [S]c1cccc(c1)SCCc2ccccc2 62a_114929384022_100011218657 [0,1,0,0,0,0|2,0,0]=3 3690 B17R2.5301 [S]c1cccc(c1)SCCc2ccccn2 62a_100015183660_114929384022 [0,1,0,0,0,0|3,0,0]=4 3691 B17R2.5301 [S]c1cccc(c1)SCCc2ccccn2 62a_114929384022_100015183660 [0,1,0,0,0,0|3,0,0]=4 3692 B17R2.5301 [S]c1cccc(c1)SCCc2cccnc2 62a_114929384022_200011713674 [0,1,0,0,0,0|3,0,0]=4 3693 B17R2.5301 [S]c1cccc(c1)SCCc2cccnc2 62a_200011713674_114929384022 [0,1,0,0,0,0|3,0,0]=4 3694 B17R2.5301 [S]c1cccc(c1)SCCc2ccncc2 62a_100000723409_114929384022 [0,1,0,0,0,0|3,0,0]=4 3695 B17R2.5301 [S]c1cccc(c1)SCCc2ccncc2 62a_114929384022_100000723409 [0,1,0,0,0,0|3,0,0]=4 3696 B17R2.5301 [S]c1cccc(c1)SCSc2ccccc2 62a_100011218342_114929384022 [0,1,0,0,0,0|3,0,0]=4 3697 B17R2.5301 [S]c1cccc(c1)SCSc2ccccc2 62a_114929384022_100011218342 [0,1,0,0,0,0|3,0,0]=4 3698 B15R1.35 CC=CC=CC=NNCc1ccccc1 4a_100000007032_100000691131 [0,0,1,0,0,0|2,0,1]=4 3699 B15R1.157 C/C=C/CC(=O)COCc1ccccc1 1458a_100000230186_100102629194 [0,0,1,0,0,0|1,0,2]=4 3700 B15R1.157 C=CC=CC(=O)C/C=C/c1ccccc1 1458a_100016291481_100016265936 [0,0,1,0,0,0|2,0,1]=4 3701 B15R1.157 C=CC=CC(=O)CC#Cc1ccccc1 1458a_100016291481_100011352542 [0,0,1,0,0,0|2,0,1]=4 3702 B15R1.157 C=CC=CC(=O)CCCc1ccccc1 1458a_100016291481_100000211621 [0,0,1,0,0,0|2,0,0]=3 3703 B15R1.157 C=CC=CC(=O)CCOc1ccccc1 1458a_100016291481_100000184471 [0,0,1,0,0,0|3,0,0]=4 3704 B15R1.157 C=CC=CC(=O)CCSc1ccccc1 1458a_100016291481_100000246102 [0,0,1,0,0,0|3,0,0]=4 3705 B15R1.157 C=CC=CC(=O)CSCc1ccccc1 1458a_100016291481_200011217039 [0,0,1,0,0,0|1,1,0]=3 3706 B15R1.157 C=CC=CC(=O)NCCc1ccccc1 1626a_100000106460_100016291481 [0,0,1,0,0,0|3,0,0]=4 3707 B15R1.157 C=CC=CC(=O)NNCc1ccccc1 22a_100000007032_100016291481 [0,0,1,0,0,0|3,0,0]=4 3708 B15R1.157 C=CCCC(=O)COCc1ccccc1 1458a_100000230186_100000754431 [0,0,1,0,0,0|1,0,2]=4 3709 B15R1.157 C=CCNC(=O)COCc1ccccc1 1626a_100020586998_100000230186 [0,0,1,0,0,0|2,0,1]=4 3710 B15R1.157 C=CCNC(=O)COCc1ccccc1 240690a_100020586998_100000230186 [0,0,1,0,0,0|2,0,1]=4 3711 B15R1.157 C=CCNC(=O)COCc1ccccc1 527a_100020586998_100000230186 [0,0,1,0,0,0|2,0,1]=4 3712 B15R1.157 C=CCNC(=O)COCc1ccccc1 7a_100000210790_100000183597 [0,0,1,0,0,0|2,0,1]=4 3713 B15R1.157 C=CCOC(=O)COCc1ccccc1 34a_100000210790_100000033060 [0,0,1,0,0,0|2,0,1]=4 3714 B15R1.157 C=CCOC(=O)COCc1ccccc1 7a_100000210790_100000033060 [0,0,1,0,0,0|2,0,1]=4 3715 B15R1.157 CC=CCC(=O)COCc1ccccc1 1458a_100000230186_100000070051 [0,0,1,0,0,0|1,0,2]=4 3716 B17R3.8 c1ccc(cc1)c2c[nH]c3c2cccc3 271570a_100012356747_100000210277 [0,0,0,1,0,0|2,0,1]=4 3717 B17R3.8 c1ccc(cc1)c2coc3c2cccc3 271570a_100000084643_100000210277 [0,0,0,1,0,0|2,0,1]=4 3718 B17R3.8 c1ccc(cc1)c2coc3c2cccc3 271570a_100011218836_100009812202 [0,0,0,1,0,0|2,0,1]=4 3719 B17R3.8 c1ccc(cc1)c2csc3c2cccc3 271570a_100000038073_100000210277 [0,0,0,1,0,0|2,0,1]=4 3720 B17R3.8 c1ccc(cc1)c2csc3c2cccc3 271570a_100011218836_100009813928 [0,0,0,1,0,0|2,0,1]=4 3721 B17R3.8 c1ccc(cc1)c2n[nH]c3c2cccc3 271570a_100011218836_100000050141 [0,0,0,1,0,0|2,0,1]=4 3722 B17R3.1939 c1ccc(cc1)OC2Cc3c2cccc3 7a_100000210340_100009813401 [0,0,0,1,0,0|2,0,0]=3 3723 B17R3.1939 c1ccc(cc1)SC2Cc3c2cccc3 62a_100000719477_100009813401 [0,0,0,1,0,0|2,0,0]=3 3724 B17R3.1939 c1ccc(cc1)SC2Cc3c2cccc3 62a_100009813401_100000041952 [0,0,0,1,0,0|2,0,0]=3 3725 B17R3.1939 c1ccc(nc1)SC2Cc3c2cccc3 62a_100009813401_100011216584 [0,0,0,1,0,0|3,0,0]=4 3726 B17R3.1939 c1ccc(nc1)SC2Cc3c2cccc3 62a_100011216584_100009813401 [0,0,0,1,0,0|3,0,0]=4 3727 B17R3.1939 c1ccc2c(c1)CC2Sc3ccncc3 62a_100000728582_100009813401 [0,0,0,1,0,0|3,0,0]=4 3728 B17R3.1939 c1ccc2c(c1)CC2Sc3ccncc3 62a_100009813401_100000728582 [0,0,0,1,0,0|3,0,0]=4 3729 B17R3.1939 c1cncc(c1)OC2Cc3c2cccc3 7a_100000210849_100009813401 [0,0,0,1,0,0|3,0,0]=4 3730 B17R3.1939 c1cncc(c1)SC2Cc3c2cccc3 62a_100000210063_100009813401 [0,0,0,1,0,0|3,0,0]=4 3731 B17R3.1939 c1cncc(c1)SC2Cc3c2cccc3 62a_100009813401_100000210063 [0,0,0,1,0,0|3,0,0]=4 3732 B15R2.2195 C(#Cc1ccccc1)c2ccccc2 271570a_100000069678_100000210277 [0,0,0,0,1,0|0,0,2]=3 3733 B15R2.2195 C(#Cc1ccccn1)c2ccccc2 271570a_100000069678_100011216584 [0,0,0,0,1,0|1,0,2]=4 3734 B15R2.2195 C(#Cc1cccnc1)c2ccccc2 271570a_100000069678_100000752921 [0,0,0,0,1,0|1,0,2]=4 3735 B15R2.2195 C(#Cc1ccncc1)c2ccccc2 271570a_100000069678_100000035832 [0,0,0,0,1,0|1,0,2]=4 3736 B15R2.2195 C(=Cc1ccccc1)c2ccccc2 271570a_100102527694_100000210277 [0,0,0,0,1,0|0,0,2]=3 3737 B15R2.2195 C(=Cc1ccccn1)c2ccccc2 271570a_100102527694_100011216584 [0,0,0,0,1,0|1,0,2]=4 3738 B15R2.2195 C(=Cc1cccnc1)c2ccccc2 271570a_100102525586_100000210277 [0,0,0,0,1,0|1,0,2]=4 3739 B15R2.2195 C(=Cc1cccnc1)c2ccccc2 271570a_100102527694_100000752921 [0,0,0,0,1,0|1,0,2]=4 3740 B15R2.2195 C(=Cc1ccncc1)c2ccccc2 271570a_100102527694_100000035832 [0,0,0,0,1,0|1,0,2]=4 3741 B15R2.2195 c1cc(ccn1)COc2cncnc2 7a_100000754086_100015193705 [0,0,0,0,1,0|3,0,0]=4 3742 B15R2.2195 c1cc(ccn1)CSc2ccncc2 62a_100000728582_100015193705 [0,0,0,0,1,0|2,1,0]=4 3743 B15R2.2195 c1cc(ccn1)CSc2ccncc2 62a_100015193705_100000728582 [0,0,0,0,1,0|2,1,0]=4 3744 B15R2.2195 c1cc(ccn1)OCc2cnccn2 34a_100000212176_100016995436 [0,0,0,0,1,0|3,0,0]=4 3745 B15R2.2195 c1cc(ccn1)OCc2cncnc2 34a_100000212176_100015196519 [0,0,0,0,1,0|3,0,0]=4 3746 B15R2.2195 c1ccc(cc1)CNc2ccccc2 207a_100000106764_100015611070 [0,0,0,0,1,0|1,0,0]=2 3747 B15R2.2195 c1ccc(cc1)CNc2ccccc2 270302a_100000106764_100015611070 [0,0,0,0,1,0|1,0,0]=2 3748 B15R2.2195 c1ccc(cc1)CNc2ccccc2 34a_100000106764_100015291786 [0,0,0,0,1,0|1,0,0]=2 3749 B15R2.2195 c1ccc(cc1)CNc2cccnn2 27a_100015324214_100016991348 [0,0,0,0,1,0|3,0,0]=4 3750 B15R2.2195 c1ccc(cc1)CNc2ccncn2 27a_100015324214_100000703185 [0,0,0,0,1,0|3,0,0]=4 3751 B15R2.2195 c1ccc(cc1)CNc2cnccn2 27a_100015324214_100000211759 [0,0,0,0,1,0|3,0,0]=4 3752 B15R2.2195 c1ccc(cc1)CNc2ncccn2 27a_100015324214_100000211032 [0,0,0,0,1,0|3,0,0]=4 3753 B15R2.2195 c1ccc(cc1)COc2ccccc2 34a_100000210340_100015291786 [0,0,0,0,1,0|0,0,0]=1 3754 B15R2.2195 c1ccc(cc1)COc2ccccc2 7a_100000210340_100000211182 [0,0,0,0,1,0|0,0,0]=1 3755 B15R2.2195 c1ccc(cc1)COc2cccnc2 34a_100000210849_100015291786 [0,0,0,0,1,0|1,0,0]=2 3756 B15R2.2195 c1ccc(cc1)COc2cccnc2 7a_100000210849_100000211182 [0,0,0,0,1,0|1,0,0]=2 3757 B15R2.2195 c1ccc(cc1)COc2ccncc2 34a_100000212176_100015291786 [0,0,0,0,1,0|1,0,0]=2 3758 B15R2.2195 c1ccc(cc1)COc2ccnnc2 34a_100015204005_100015291786 [0,0,0,0,1,0|2,0,0]=3 3759 B15R2.2195 c1ccc(cc1)COc2cncnc2 7a_100000754086_100000211182 [0,0,0,0,1,0|2,0,0]=3 3760 B15R2.2195 c1ccc(cc1)CSc2ccccc2 62a_100000211182_100000041952 [0,0,0,0,1,0|0,1,0]=2 3761 B15R2.2195 c1ccc(cc1)CSc2ccccc2 62a_100000719477_100015291786 [0,0,0,0,1,0|0,1,0]=2 3762 B15R2.2195 c1ccc(cc1)CSc2ccccn2 62a_100000211182_100011216584 [0,0,0,0,1,0|1,1,0]=3 3763 B15R2.2195 c1ccc(cc1)CSc2ccccn2 62a_100011216584_100015291786 [0,0,0,0,1,0|1,1,0]=3 3764 B15R2.2195 c1ccc(cc1)CSc2cccnc2 62a_100000210063_100015291786 [0,0,0,0,1,0|1,1,0]=3 3765 B15R2.2195 c1ccc(cc1)CSc2cccnc2 62a_100000211182_100000210063 [0,0,0,0,1,0|1,1,0]=3 3766 B15R2.2195 c1ccc(cc1)CSc2cccnn2 62a_100000211182_100016991348 [0,0,0,0,1,0|2,1,0]=4 3767 B15R2.2195 c1ccc(cc1)CSc2cccnn2 62a_100016991348_100015291786 [0,0,0,0,1,0|2,1,0]=4 3768 B15R2.2195 c1ccc(cc1)CSc2ccncc2 62a_100000211182_100000728582 [0,0,0,0,1,0|1,1,0]=3 3769 B15R2.2195 c1ccc(cc1)CSc2ccncc2 62a_100000728582_100015291786 [0,0,0,0,1,0|1,1,0]=3 3770 B15R2.2195 c1ccc(cc1)CSc2ccncn2 62a_100000211182_100000703185 [0,0,0,0,1,0|2,1,0]=4 3771 B15R2.2195 c1ccc(cc1)CSc2ccncn2 62a_100000703185_100015291786 [0,0,0,0,1,0|2,1,0]=4 3772 B15R2.2195 c1ccc(cc1)CSc2ccnnc2 62a_100000211182_100000732662 [0,0,0,0,1,0|2,1,0]=4 3773 B15R2.2195 c1ccc(cc1)CSc2ccnnc2 62a_100000732662_100015291786 [0,0,0,0,1,0|2,1,0]=4 3774 B15R2.2195 c1ccc(cc1)CSc2cnccn2 62a_100000211182_100000211759 [0,0,0,0,1,0|2,1,0]=4 3775 B15R2.2195 c1ccc(cc1)CSc2cnccn2 62a_100000211759_100015291786 [0,0,0,0,1,0|2,1,0]=4 3776 B15R2.2195 c1ccc(cc1)CSc2cncnc2 62a_100000211182_100011206942 [0,0,0,0,1,0|2,1,0]=4 3777 B15R2.2195 c1ccc(cc1)CSc2cncnc2 62a_100011206942_100015291786 [0,0,0,0,1,0|2,1,0]=4 3778 B15R2.2195 c1ccc(cc1)CSc2ncccn2 62a_100000211032_100015291786 [0,0,0,0,1,0|2,1,0]=4 3779 B15R2.2195 c1ccc(cc1)CSc2ncccn2 62a_100000211182_100000211032 [0,0,0,0,1,0|2,1,0]=4 3780 B15R2.2195 c1ccc(cc1)NCc2ccccn2 207a_100000106764_100000209966 [0,0,0,0,1,0|2,0,0]=3 3781 B15R2.2195 c1ccc(cc1)NCc2ccccn2 270302a_100000106764_100000209966 [0,0,0,0,1,0|2,0,0]=3 3782 B15R2.2195 c1ccc(cc1)NCc2ccccn2 34a_100000106764_100000721315 [0,0,0,0,1,0|2,0,0]=3 3783 B15R2.2195 c1ccc(cc1)NCc2cccnc2 207a_100000106764_100000209961 [0,0,0,0,1,0|2,0,0]=3 3784 B15R2.2195 c1ccc(cc1)NCc2cccnc2 270302a_100000106764_100000209961 [0,0,0,0,1,0|2,0,0]=3 3785 B15R2.2195 c1ccc(cc1)NCc2cccnc2 34a_100000106764_100000733263 [0,0,0,0,1,0|2,0,0]=3 3786 B15R2.2195 c1ccc(cc1)NCc2cccnn2 34a_100000106764_100016990269 [0,0,0,0,1,0|3,0,0]=4 3787 B15R2.2195 c1ccc(cc1)NCc2ccncc2 207a_100000106764_100000186114 [0,0,0,0,1,0|2,0,0]=3 3788 B15R2.2195 c1ccc(cc1)NCc2ccnnc2 270302a_100000106764_100011934578 [0,0,0,0,1,0|3,0,0]=4 3789 B15R2.2195 c1ccc(cc1)NCc2cnccn2 34a_100000106764_100016995436 [0,0,0,0,1,0|3,0,0]=4 3790 B15R2.2195 c1ccc(cc1)NCc2cncnc2 270302a_100000106764_100000749868 [0,0,0,0,1,0|3,0,0]=4 3791 B15R2.2195 c1ccc(cc1)NCc2cncnc2 34a_100000106764_100015196519 [0,0,0,0,1,0|3,0,0]=4 3792 B15R2.2195 c1ccc(cc1)NCc2ncccn2 34a_100000106764_100000703007 [0,0,0,0,1,0|3,0,0]=4 3793 B15R2.2195 c1ccc(cc1)OCc2ccccn2 34a_100000210340_100000721315 [0,0,0,0,1,0|1,0,0]=2 3794 B15R2.2195 c1ccc(cc1)OCc2ccccn2 7a_100000210340_100000721315 [0,0,0,0,1,0|1,0,0]=2 3795 B15R2.2195 c1ccc(cc1)OCc2cccnc2 34a_100000210340_100000733263 [0,0,0,0,1,0|1,0,0]=2 3796 B15R2.2195 c1ccc(cc1)OCc2cccnc2 7a_100000210340_100000741622 [0,0,0,0,1,0|1,0,0]=2 3797 B15R2.2195 c1ccc(cc1)OCc2cccnn2 34a_100000210340_100016990269 [0,0,0,0,1,0|2,0,0]=3 3798 B15R2.2195 c1ccc(cc1)OCc2cccnn2 7a_100000210340_100016990269 [0,0,0,0,1,0|2,0,0]=3 3799 B15R2.2195 c1ccc(cc1)OCc2ccncc2 7a_100000210340_100015193705 [0,0,0,0,1,0|1,0,0]=2 3800 B15R2.2195 c1ccc(cc1)OCc2cnccn2 34a_100000210340_100016995436 [0,0,0,0,1,0|2,0,0]=3 3801 B15R2.2195 c1ccc(cc1)OCc2cnccn2 7a_100000210340_100016995436 [0,0,0,0,1,0|2,0,0]=3 3802 B15R2.2195 c1ccc(cc1)OCc2cncnc2 34a_100000210340_100015196519 [0,0,0,0,1,0|2,0,0]=3 3803 B15R2.2195 c1ccc(cc1)OCc2cncnc2 7a_100000210340_100015196519 [0,0,0,0,1,0|2,0,0]=3 3804 B15R2.2195 c1ccc(cc1)OCc2ncccn2 34a_100000210340_100000703007 [0,0,0,0,1,0|2,0,0]=3 3805 B15R2.2195 c1ccc(cc1)OCc2ncccn2 7a_100000210340_100000703007 [0,0,0,0,1,0|2,0,0]=3 3806 B15R2.2195 c1ccc(cc1)SCc2ccccn2 62a_100000719477_100000721315 [0,0,0,0,1,0|1,1,0]=3 3807 B15R2.2195 c1ccc(cc1)SCc2ccccn2 62a_100000721315_100000041952 [0,0,0,0,1,0|1,1,0]=3 3808 B15R2.2195 c1ccc(cc1)SCc2cccnc2 62a_100000719477_100000741622 [0,0,0,0,1,0|1,1,0]=3 3809 B15R2.2195 c1ccc(cc1)SCc2cccnc2 62a_100000741622_100000041952 [0,0,0,0,1,0|1,1,0]=3 3810 B15R2.2195 c1ccc(cc1)SCc2cccnn2 62a_100000719477_100016990269 [0,0,0,0,1,0|2,1,0]=4 3811 B15R2.2195 c1ccc(cc1)SCc2cccnn2 62a_100016990269_100000041952 [0,0,0,0,1,0|2,1,0]=4 3812 B15R2.2195 c1ccc(cc1)SCc2ccncc2 62a_100000719477_100015193705 [0,0,0,0,1,0|1,1,0]=3 3813 B15R2.2195 c1ccc(cc1)SCc2ccncc2 62a_100015193705_100000041952 [0,0,0,0,1,0|1,1,0]=3 3814 B15R2.2195 c1ccc(cc1)SCc2cnccn2 62a_100000719477_100016995436 [0,0,0,0,1,0|2,1,0]=4 3815 B15R2.2195 c1ccc(cc1)SCc2cnccn2 62a_100016995436_100000041952 [0,0,0,0,1,0|2,1,0]=4 3816 B15R2.2195 c1ccc(cc1)SCc2cncnc2 62a_100000719477_100015196519 [0,0,0,0,1,0|2,1,0]=4 3817 B15R2.2195 c1ccc(cc1)SCc2cncnc2 62a_100015196519_100000041952 [0,0,0,0,1,0|2,1,0]=4 3818 B15R2.2195 c1ccc(cc1)SCc2ncccn2 62a_100000703007_100000041952 [0,0,0,0,1,0|2,1,0]=4 3819 B15R2.2195 c1ccc(cc1)SCc2ncccn2 62a_100000719477_100000703007 [0,0,0,0,1,0|2,1,0]=4 3820 B15R2.2195 c1ccc(nc1)COc2cccnc2 34a_100000210849_100000721315 [0,0,0,0,1,0|2,0,0]=3 3821 B15R2.2195 c1ccc(nc1)COc2cccnc2 7a_100000210849_100000721315 [0,0,0,0,1,0|2,0,0]=3 3822 B15R2.2195 c1ccc(nc1)COc2ccncc2 34a_100000212176_100000721315 [0,0,0,0,1,0|2,0,0]=3 3823 B15R2.2195 c1ccc(nc1)COc2ccnnc2 34a_100015204005_100000721315 [0,0,0,0,1,0|3,0,0]=4 3824 B15R2.2195 c1ccc(nc1)COc2cncnc2 7a_100000754086_100000721315 [0,0,0,0,1,0|3,0,0]=4 3825 B15R2.2195 c1ccc(nc1)CSc2ccccn2 62a_100000721315_100011216584 [0,0,0,0,1,0|2,1,0]=4 3826 B15R2.2195 c1ccc(nc1)CSc2ccccn2 62a_100011216584_100000721315 [0,0,0,0,1,0|2,1,0]=4 3827 B15R2.2195 c1ccc(nc1)CSc2cccnc2 62a_100000210063_100000721315 [0,0,0,0,1,0|2,1,0]=4 3828 B15R2.2195 c1ccc(nc1)CSc2cccnc2 62a_100000721315_100000210063 [0,0,0,0,1,0|2,1,0]=4 3829 B15R2.2195 c1ccc(nc1)CSc2ccncc2 62a_100000721315_100000728582 [0,0,0,0,1,0|2,1,0]=4 3830 B15R2.2195 c1ccc(nc1)CSc2ccncc2 62a_100000728582_100000721315 [0,0,0,0,1,0|2,1,0]=4 3831 B15R2.2195 c1ccc(nc1)SCc2cccnc2 62a_100000741622_100011216584 [0,0,0,0,1,0|2,1,0]=4 3832 B15R2.2195 c1ccc(nc1)SCc2cccnc2 62a_100011216584_100000741622 [0,0,0,0,1,0|2,1,0]=4 3833 B15R2.2195 c1ccc(nc1)SCc2ccncc2 62a_100011216584_100015193705 [0,0,0,0,1,0|2,1,0]=4 3834 B15R2.2195 c1ccc(nc1)SCc2ccncc2 62a_100015193705_100011216584 [0,0,0,0,1,0|2,1,0]=4 3835 B15R2.2195 c1cnc(nc1)COc2cccnc2 34a_100000210849_100000703007 [0,0,0,0,1,0|3,0,0]=4 3836 B15R2.2195 c1cnc(nc1)COc2cccnc2 7a_100000210849_100000703007 [0,0,0,0,1,0|3,0,0]=4 3837 B15R2.2195 c1cnc(nc1)COc2ccncc2 34a_100000212176_100000703007 [0,0,0,0,1,0|3,0,0]=4 3838 B15R2.2195 c1cncc(c1)COc2cccnc2 34a_100000210849_100000733263 [0,0,0,0,1,0|2,0,0]=3 3839 B15R2.2195 c1cncc(c1)COc2cccnc2 7a_100000210849_100000741622 [0,0,0,0,1,0|2,0,0]=3 3840 B15R2.2195 c1cncc(c1)COc2ccncc2 34a_100000212176_100000733263 [0,0,0,0,1,0|2,0,0]=3 3841 B15R2.2195 c1cncc(c1)COc2ccnnc2 34a_100015204005_100000733263 [0,0,0,0,1,0|3,0,0]=4 3842 B15R2.2195 c1cncc(c1)COc2cncnc2 7a_100000754086_100000741622 [0,0,0,0,1,0|3,0,0]=4 3843 B15R2.2195 c1cncc(c1)CSc2cccnc2 62a_100000210063_100000741622 [0,0,0,0,1,0|2,1,0]=4 3844 B15R2.2195 c1cncc(c1)CSc2cccnc2 62a_100000741622_100000210063 [0,0,0,0,1,0|2,1,0]=4 3845 B15R2.2195 c1cncc(c1)CSc2ccncc2 62a_100000728582_100000741622 [0,0,0,0,1,0|2,1,0]=4 3846 B15R2.2195 c1cncc(c1)CSc2ccncc2 62a_100000741622_100000728582 [0,0,0,0,1,0|2,1,0]=4 3847 B15R2.2195 c1cncc(c1)OCc2cccnn2 34a_100000210849_100016990269 [0,0,0,0,1,0|3,0,0]=4 3848 B15R2.2195 c1cncc(c1)OCc2cccnn2 7a_100000210849_100016990269 [0,0,0,0,1,0|3,0,0]=4 3849 B15R2.2195 c1cncc(c1)OCc2ccncc2 7a_100000210849_100015193705 [0,0,0,0,1,0|2,0,0]=3 3850 B15R2.2195 c1cncc(c1)OCc2cnccn2 34a_100000210849_100016995436 [0,0,0,0,1,0|3,0,0]=4 3851 B15R2.2195 c1cncc(c1)OCc2cnccn2 7a_100000210849_100016995436 [0,0,0,0,1,0|3,0,0]=4 3852 B15R2.2195 c1cncc(c1)OCc2cncnc2 34a_100000210849_100015196519 [0,0,0,0,1,0|3,0,0]=4 3853 B15R2.2195 c1cncc(c1)OCc2cncnc2 7a_100000210849_100015196519 [0,0,0,0,1,0|3,0,0]=4 3854 B15R2.2195 c1cncc(c1)SCc2ccncc2 62a_100000210063_100015193705 [0,0,0,0,1,0|2,1,0]=4 3855 B15R2.2195 c1cncc(c1)SCc2ccncc2 62a_100015193705_100000210063 [0,0,0,0,1,0|2,1,0]=4 3856 B15R2.2195 c1cnnc(c1)COc2ccncc2 34a_100000212176_100016990269 [0,0,0,0,1,0|3,0,0]=4 3857 B15R2.2196 C(=Cc1ccco1)Cc2ccccc2 271570a_200016263579_100009814098 [0,0,0,0,1,0|2,0,1]=4 3858 B15R2.2196 C(=Cc1cccs1)Cc2ccccc2 271570a_200016263579_100011215356 [0,0,0,0,1,0|2,0,1]=4 3859 B15R2.2196 C(=Cc1ccoc1)Cc2ccccc2 271570a_200016263579_100011215275 [0,0,0,0,1,0|2,0,1]=4 3860 B15R2.2196 C(=Cc1ccsc1)Cc2ccccc2 271570a_200016263579_100000738268 [0,0,0,0,1,0|2,0,1]=4 3861 B15R2.2196 C1=CCC(C1)COCc2ccccc2 34a_100000688395_100015291786 [0,0,0,0,1,0|0,0,3]=4 3862 B15R2.2196 c1cc(ccn1)CNCc2ccoc2 207a_100015206860_100000186114 [0,0,0,0,1,0|3,0,0]=4 3863 B15R2.2196 c1cc(ccn1)CNCc2ccoc2 2230a_100015206860_100015193705 [0,0,0,0,1,0|3,0,0]=4 3864 B15R2.2196 c1cc(ccn1)CNCc2ccsc2 207a_100000186416_100000186114 [0,0,0,0,1,0|3,0,0]=4 3865 B15R2.2196 c1cc(ccn1)CNCc2ccsc2 2230a_100000186416_100015193705 [0,0,0,0,1,0|3,0,0]=4 3866 B15R2.2196 c1cc(ccn1)CSCc2ccsc2 62a_100011261437_100015193705 [0,0,0,0,1,0|2,1,0]=4 3867 B15R2.2196 c1cc(ccn1)CSCc2ccsc2 62a_100015193705_100011233845 [0,0,0,0,1,0|2,1,0]=4 3868 B15R2.2196 c1ccc(cc1)CCOc2ccsc2 34a_100000106738_100000765856 [0,0,0,0,1,0|3,0,0]=4 3869 B15R2.2196 c1ccc(cc1)CCOc2ccsc2 7a_100000106738_100000765856 [0,0,0,0,1,0|3,0,0]=4 3870 B15R2.2196 c1ccc(cc1)CCSc2ccco2 62a_100000765856_100009814098 [0,0,0,0,1,0|3,0,0]=4 3871 B15R2.2196 c1ccc(cc1)CCSc2ccco2 62a_100009814098_100011218657 [0,0,0,0,1,0|3,0,0]=4 3872 B15R2.2196 c1ccc(cc1)CCSc2cccs2 62a_100000765856_100011215356 [0,0,0,0,1,0|3,0,0]=4 3873 B15R2.2196 c1ccc(cc1)CCSc2cccs2 62a_100011215356_100011218657 [0,0,0,0,1,0|3,0,0]=4 3874 B15R2.2196 c1ccc(cc1)CCSc2ccoc2 62a_100000765856_100011215275 [0,0,0,0,1,0|3,0,0]=4 3875 B15R2.2196 c1ccc(cc1)CCSc2ccoc2 62a_100011215275_100011218657 [0,0,0,0,1,0|3,0,0]=4 3876 B15R2.2196 c1ccc(cc1)CCSc2ccsc2 62a_100000738268_100011218657 [0,0,0,0,1,0|3,0,0]=4 3877 B15R2.2196 c1ccc(cc1)CCSc2ccsc2 62a_100000765856_100000738268 [0,0,0,0,1,0|3,0,0]=4 3878 B15R2.2196 c1ccc(cc1)CNCc2c[nH]cn2 207a_100000758547_100015611070 [0,0,0,0,1,0|3,0,0]=4 3879 B15R2.2196 c1ccc(cc1)CNCc2c[nH]cn2 2230a_100015324214_100000707719 [0,0,0,0,1,0|3,0,0]=4 3880 B15R2.2196 c1ccc(cc1)CNCc2c[nH]cn2 34a_100015324214_100000707719 [0,0,0,0,1,0|3,0,0]=4 3881 B15R2.2196 c1ccc(cc1)CNCc2cc[nH]n2 207a_100000739516_100015611070 [0,0,0,0,1,0|3,0,0]=4 3882 B15R2.2196 c1ccc(cc1)CNCc2cc[nH]n2 207a_100015324214_100000738523 [0,0,0,0,1,0|3,0,0]=4 3883 B15R2.2196 c1ccc(cc1)CNCc2cc[nH]n2 270004a_100015324214_100000738523 [0,0,0,0,1,0|3,0,0]=4 3884 B15R2.2196 c1ccc(cc1)CNCc2ccco2 207a_100000185738_100015611070 [0,0,0,0,1,0|2,0,0]=3 3885 B15R2.2196 c1ccc(cc1)CNCc2ccco2 207a_100015324214_100000186105 [0,0,0,0,1,0|2,0,0]=3 3886 B15R2.2196 c1ccc(cc1)CNCc2ccco2 2230a_100000185738_100015291786 [0,0,0,0,1,0|2,0,0]=3 3887 B15R2.2196 c1ccc(cc1)CNCc2ccco2 270004a_100000185738_100015611070 [0,0,0,0,1,0|2,0,0]=3 3888 B15R2.2196 c1ccc(cc1)CNCc2ccco2 270004a_100015324214_100000186105 [0,0,0,0,1,0|2,0,0]=3 3889 B15R2.2196 c1ccc(cc1)CNCc2ccco2 34a_100000185738_100015291786 [0,0,0,0,1,0|2,0,0]=3 3890 B15R2.2196 c1ccc(cc1)CNCc2cccs2 207a_100000211653_100015611070 [0,0,0,0,1,0|2,0,0]=3 3891 B15R2.2196 c1ccc(cc1)CNCc2cccs2 207a_100015324214_100000209959 [0,0,0,0,1,0|2,0,0]=3 3892 B15R2.2196 c1ccc(cc1)CNCc2cccs2 2230a_100000211653_100015291786 [0,0,0,0,1,0|2,0,0]=3 3893 B15R2.2196 c1ccc(cc1)CNCc2cccs2 270004a_100000211653_100015611070 [0,0,0,0,1,0|2,0,0]=3 3894 B15R2.2196 c1ccc(cc1)CNCc2cccs2 270004a_100015324214_100000209959 [0,0,0,0,1,0|2,0,0]=3 3895 B15R2.2196 c1ccc(cc1)CNCc2ccn[nH]2 2230a_100015324214_100000728653 [0,0,0,0,1,0|3,0,0]=4 3896 B15R2.2196 c1ccc(cc1)CNCc2ccn[nH]2 34a_100015324214_100000728653 [0,0,0,0,1,0|3,0,0]=4 3897 B15R2.2196 c1ccc(cc1)CNCc2ccoc2 207a_100015206860_100015611070 [0,0,0,0,1,0|2,0,0]=3 3898 B15R2.2196 c1ccc(cc1)CNCc2ccoc2 207a_100015324214_100011215517 [0,0,0,0,1,0|2,0,0]=3 3899 B15R2.2196 c1ccc(cc1)CNCc2ccoc2 2230a_100015206860_100015291786 [0,0,0,0,1,0|2,0,0]=3 3900 B15R2.2196 c1ccc(cc1)CNCc2ccoc2 270004a_100015206860_100015611070 [0,0,0,0,1,0|2,0,0]=3 3901 B15R2.2196 c1ccc(cc1)CNCc2ccoc2 270004a_100015324214_100011215517 [0,0,0,0,1,0|2,0,0]=3 3902 B15R2.2196 c1ccc(cc1)CNCc2ccoc2 34a_100015206860_100015291786 [0,0,0,0,1,0|2,0,0]=3 3903 B15R2.2196 c1ccc(cc1)CNCc2ccon2 207a_100000688301_100015611070 [0,0,0,0,1,0|3,0,0]=4 3904 B15R2.2196 c1ccc(cc1)CNCc2ccon2 2230a_100015324214_100000234950 [0,0,0,0,1,0|3,0,0]=4 3905 B15R2.2196 c1ccc(cc1)CNCc2ccon2 270004a_100000688301_100015611070 [0,0,0,0,1,0|3,0,0]=4 3906 B15R2.2196 c1ccc(cc1)CNCc2ccon2 34a_100015324214_100000234950 [0,0,0,0,1,0|3,0,0]=4 3907 B15R2.2196 c1ccc(cc1)CNCc2ccsc2 207a_100000186416_100015611070 [0,0,0,0,1,0|2,0,0]=3 3908 B15R2.2196 c1ccc(cc1)CNCc2ccsc2 207a_100015324214_100000188534 [0,0,0,0,1,0|2,0,0]=3 3909 B15R2.2196 c1ccc(cc1)CNCc2ccsc2 2230a_100000186416_100015291786 [0,0,0,0,1,0|2,0,0]=3 3910 B15R2.2196 c1ccc(cc1)CNCc2ccsc2 2230a_100015324214_100011261437 [0,0,0,0,1,0|2,0,0]=3 3911 B15R2.2196 c1ccc(cc1)CNCc2ccsc2 270004a_100000186416_100015611070 [0,0,0,0,1,0|2,0,0]=3 3912 B15R2.2196 c1ccc(cc1)CNCc2ccsc2 270004a_100015324214_100000188534 [0,0,0,0,1,0|2,0,0]=3 3913 B15R2.2196 c1ccc(cc1)CNCc2ccsc2 34a_100000186416_100015291786 [0,0,0,0,1,0|2,0,0]=3 3914 B15R2.2196 c1ccc(cc1)CNCc2ccsc2 34a_100015324214_100011261437 [0,0,0,0,1,0|2,0,0]=3 3915 B15R2.2196 c1ccc(cc1)CNCc2cn[nH]c2 207a_100000737208_100015611070 [0,0,0,0,1,0|3,0,0]=4 3916 B15R2.2196 c1ccc(cc1)CNCc2cn[nH]c2 207a_100015324214_100016992096 [0,0,0,0,1,0|3,0,0]=4 3917 B15R2.2196 c1ccc(cc1)CNCc2cn[nH]c2 270004a_100000737208_100015611070 [0,0,0,0,1,0|3,0,0]=4 3918 B15R2.2196 c1ccc(cc1)CNCc2cn[nH]c2 270004a_100015324214_100016992096 [0,0,0,0,1,0|3,0,0]=4 3919 B15R2.2196 c1ccc(cc1)CNCc2cnc[nH]2 207a_100015324214_100000742939 [0,0,0,0,1,0|3,0,0]=4 3920 B15R2.2196 c1ccc(cc1)CNCc2cnco2 207a_100020634212_100015611070 [0,0,0,0,1,0|3,0,0]=4 3921 B15R2.2196 c1ccc(cc1)CNCc2cnco2 270004a_100015324214_100000064291 [0,0,0,0,1,0|3,0,0]=4 3922 B15R2.2196 c1ccc(cc1)CNCc2cnco2 270004a_100020634212_100015611070 [0,0,0,0,1,0|3,0,0]=4 3923 B15R2.2196 c1ccc(cc1)CNCc2cncs2 207a_100015324214_100000749870 [0,0,0,0,1,0|3,0,0]=4 3924 B15R2.2196 c1ccc(cc1)CNCc2cncs2 207a_100016987365_100015611070 [0,0,0,0,1,0|3,0,0]=4 3925 B15R2.2196 c1ccc(cc1)CNCc2cncs2 2230a_100015324214_100015185245 [0,0,0,0,1,0|3,0,0]=4 3926 B15R2.2196 c1ccc(cc1)CNCc2cncs2 2230a_100016987365_100015291786 [0,0,0,0,1,0|3,0,0]=4 3927 B15R2.2196 c1ccc(cc1)CNCc2cncs2 270004a_100015324214_100000749870 [0,0,0,0,1,0|3,0,0]=4 3928 B15R2.2196 c1ccc(cc1)CNCc2cncs2 270004a_100016987365_100015611070 [0,0,0,0,1,0|3,0,0]=4 3929 B15R2.2196 c1ccc(cc1)CNCc2cncs2 34a_100015324214_100015185245 [0,0,0,0,1,0|3,0,0]=4 3930 B15R2.2196 c1ccc(cc1)CNCc2cocn2 207a_100015188801_100015611070 [0,0,0,0,1,0|3,0,0]=4 3931 B15R2.2196 c1ccc(cc1)CNCc2cocn2 270004a_100015188801_100015611070 [0,0,0,0,1,0|3,0,0]=4 3932 B15R2.2196 c1ccc(cc1)CNCc2cocn2 270004a_100015324214_100000050382 [0,0,0,0,1,0|3,0,0]=4 3933 B15R2.2196 c1ccc(cc1)CNCc2cscn2 207a_100015185402_100015611070 [0,0,0,0,1,0|3,0,0]=4 3934 B15R2.2196 c1ccc(cc1)CNCc2cscn2 207a_100015324214_100000743575 [0,0,0,0,1,0|3,0,0]=4 3935 B15R2.2196 c1ccc(cc1)CNCc2cscn2 2230a_100015185402_100015291786 [0,0,0,0,1,0|3,0,0]=4 3936 B15R2.2196 c1ccc(cc1)CNCc2cscn2 2230a_100015324214_100000205941 [0,0,0,0,1,0|3,0,0]=4 3937 B15R2.2196 c1ccc(cc1)CNCc2cscn2 270004a_100015324214_100000743575 [0,0,0,0,1,0|3,0,0]=4 3938 B15R2.2196 c1ccc(cc1)CNCc2cscn2 34a_100015324214_100000205941 [0,0,0,0,1,0|3,0,0]=4 3939 B15R2.2196 c1ccc(cc1)CNCc2ncc[nH]2 207a_100000754540_100015611070 [0,0,0,0,1,0|3,0,0]=4 3940 B15R2.2196 c1ccc(cc1)CNCc2ncc[nH]2 207a_100015324214_100000743867 [0,0,0,0,1,0|3,0,0]=4 3941 B15R2.2196 c1ccc(cc1)CNCc2ncc[nH]2 2230a_100015324214_100016991755 [0,0,0,0,1,0|3,0,0]=4 3942 B15R2.2196 c1ccc(cc1)CNCc2ncc[nH]2 270004a_100000754540_100015611070 [0,0,0,0,1,0|3,0,0]=4 3943 B15R2.2196 c1ccc(cc1)CNCc2ncc[nH]2 34a_100015324214_100016991755 [0,0,0,0,1,0|3,0,0]=4 3944 B15R2.2196 c1ccc(cc1)CNCc2ncco2 207a_100016994969_100015611070 [0,0,0,0,1,0|3,0,0]=4 3945 B15R2.2196 c1ccc(cc1)CNCc2ncco2 2230a_100015324214_103436540062 [0,0,0,0,1,0|3,0,0]=4 3946 B15R2.2196 c1ccc(cc1)CNCc2ncco2 2230a_100016994969_100015291786 [0,0,0,0,1,0|3,0,0]=4 3947 B15R2.2196 c1ccc(cc1)CNCc2ncco2 270004a_100015324214_100000064290 [0,0,0,0,1,0|3,0,0]=4 3948 B15R2.2196 c1ccc(cc1)CNCc2ncco2 34a_100015324214_103436540062 [0,0,0,0,1,0|3,0,0]=4 3949 B15R2.2196 c1ccc(cc1)CNCc2nccs2 207a_100000740555_100015611070 [0,0,0,0,1,0|3,0,0]=4 3950 B15R2.2196 c1ccc(cc1)CNCc2nccs2 207a_100015324214_100000750902 [0,0,0,0,1,0|3,0,0]=4 3951 B15R2.2196 c1ccc(cc1)CNCc2nccs2 2230a_100000740555_100015291786 [0,0,0,0,1,0|3,0,0]=4 3952 B15R2.2196 c1ccc(cc1)CNCc2nccs2 2230a_100015324214_100015184050 [0,0,0,0,1,0|3,0,0]=4 3953 B15R2.2196 c1ccc(cc1)CNCc2nccs2 270004a_100000740555_100015611070 [0,0,0,0,1,0|3,0,0]=4 3954 B15R2.2196 c1ccc(cc1)CNCc2nccs2 270004a_100015324214_100000750902 [0,0,0,0,1,0|3,0,0]=4 3955 B15R2.2196 c1ccc(cc1)CNCc2nccs2 34a_100015324214_100015184050 [0,0,0,0,1,0|3,0,0]=4 3956 B15R2.2196 c1ccc(cc1)COCc2c[nH]cn2 34a_100000210790_100000707719 [0,0,0,0,1,0|2,0,0]=3 3957 B15R2.2196 c1ccc(cc1)COCc2ccco2 34a_100000210059_100015291786 [0,0,0,0,1,0|1,0,0]=2 3958 B15R2.2196 c1ccc(cc1)COCc2cccs2 34a_100000211240_100015291786 [0,0,0,0,1,0|1,0,0]=2 3959 B15R2.2196 c1ccc(cc1)COCc2ccn[nH]2 34a_100000210790_100000728653 [0,0,0,0,1,0|2,0,0]=3 3960 B15R2.2196 c1ccc(cc1)COCc2ccn[nH]2 7a_100000210790_100000728653 [0,0,0,0,1,0|2,0,0]=3 3961 B15R2.2196 c1ccc(cc1)COCc2ccno2 34a_100000740478_100015291786 [0,0,0,0,1,0|2,0,0]=3 3962 B15R2.2196 c1ccc(cc1)COCc2ccoc2 34a_100011215357_100015291786 [0,0,0,0,1,0|1,0,0]=2 3963 B15R2.2196 c1ccc(cc1)COCc2ccon2 34a_100000210790_100000234950 [0,0,0,0,1,0|2,0,0]=3 3964 B15R2.2196 c1ccc(cc1)COCc2ccon2 7a_100000210790_100000234950 [0,0,0,0,1,0|2,0,0]=3 3965 B15R2.2196 c1ccc(cc1)COCc2ccsc2 34a_100000210790_100011261437 [0,0,0,0,1,0|1,0,0]=2 3966 B15R2.2196 c1ccc(cc1)COCc2ccsc2 34a_100011215551_100015291786 [0,0,0,0,1,0|1,0,0]=2 3967 B15R2.2196 c1ccc(cc1)COCc2ccsc2 7a_100000210790_100011261437 [0,0,0,0,1,0|1,0,0]=2 3968 B15R2.2196 c1ccc(cc1)COCc2cncs2 34a_100000210790_100015185245 [0,0,0,0,1,0|2,0,0]=3 3969 B15R2.2196 c1ccc(cc1)COCc2cncs2 7a_100000210790_100015185245 [0,0,0,0,1,0|2,0,0]=3 3970 B15R2.2196 c1ccc(cc1)COCc2cscn2 34a_100000210790_100000205941 [0,0,0,0,1,0|2,0,0]=3 3971 B15R2.2196 c1ccc(cc1)COCc2cscn2 7a_100000210790_100000205941 [0,0,0,0,1,0|2,0,0]=3 3972 B15R2.2196 c1ccc(cc1)COCc2ncc[nH]2 34a_100000210790_100016991755 [0,0,0,0,1,0|2,0,0]=3 3973 B15R2.2196 c1ccc(cc1)COCc2ncc[nH]2 7a_100000210790_100000753453 [0,0,0,0,1,0|2,0,0]=3 3974 B15R2.2196 c1ccc(cc1)COCc2ncco2 34a_100000062594_100015291786 [0,0,0,0,1,0|2,0,0]=3 3975 B15R2.2196 c1ccc(cc1)COCc2ncco2 34a_100000210790_103436540062 [0,0,0,0,1,0|2,0,0]=3 3976 B15R2.2196 c1ccc(cc1)COCc2ncco2 7a_100000210790_103436540062 [0,0,0,0,1,0|2,0,0]=3 3977 B15R2.2196 c1ccc(cc1)COCc2nccs2 34a_100000210790_100015184050 [0,0,0,0,1,0|2,0,0]=3 3978 B15R2.2196 c1ccc(cc1)COCc2nccs2 7a_100000210790_100015184050 [0,0,0,0,1,0|2,0,0]=3 3979 B15R2.2196 c1ccc(cc1)COCc2ncon2 34a_100000210790_100000233494 [0,0,0,0,1,0|3,0,0]=4 3980 B15R2.2196 c1ccc(cc1)COCn2cccn2 34a_100000731028_100015291786 [0,0,0,0,1,0|2,0,0]=3 3981 B15R2.2196 c1ccc(cc1)COCn2cncn2 34a_100000210790_200020645497 [0,0,0,0,1,0|3,0,0]=4 3982 B15R2.2196 c1ccc(cc1)COCn2cncn2 7a_100000210790_200020645497 [0,0,0,0,1,0|3,0,0]=4 3983 B15R2.2196 c1ccc(cc1)CSCc2c[nH]cn2 62a_100000211182_100000707719 [0,0,0,0,1,0|2,1,0]=4 3984 B15R2.2196 c1ccc(cc1)CSCc2c[nH]cn2 62a_100000707719_100015291786 [0,0,0,0,1,0|2,1,0]=4 3985 B15R2.2196 c1ccc(cc1)CSCc2ccn[nH]2 62a_100000211182_100000728653 [0,0,0,0,1,0|2,1,0]=4 3986 B15R2.2196 c1ccc(cc1)CSCc2ccn[nH]2 62a_100000728653_100015291786 [0,0,0,0,1,0|2,1,0]=4 3987 B15R2.2196 c1ccc(cc1)CSCc2ccon2 62a_100000211182_100000234950 [0,0,0,0,1,0|2,1,0]=4 3988 B15R2.2196 c1ccc(cc1)CSCc2ccon2 62a_100000234950_100015291786 [0,0,0,0,1,0|2,1,0]=4 3989 B15R2.2196 c1ccc(cc1)CSCc2ccsc2 62a_100000211182_100011233845 [0,0,0,0,1,0|1,1,0]=3 3990 B15R2.2196 c1ccc(cc1)CSCc2ccsc2 62a_100011261437_100015291786 [0,0,0,0,1,0|1,1,0]=3 3991 B15R2.2196 c1ccc(cc1)CSCc2cncs2 62a_100000211182_100015185245 [0,0,0,0,1,0|2,1,0]=4 3992 B15R2.2196 c1ccc(cc1)CSCc2cncs2 62a_100015185245_100015291786 [0,0,0,0,1,0|2,1,0]=4 3993 B15R2.2196 c1ccc(cc1)CSCc2cscn2 62a_100000205941_100015291786 [0,0,0,0,1,0|2,1,0]=4 3994 B15R2.2196 c1ccc(cc1)CSCc2cscn2 62a_100000211182_100000205941 [0,0,0,0,1,0|2,1,0]=4 3995 B15R2.2196 c1ccc(cc1)CSCc2ncc[nH]2 62a_100000211182_100016991755 [0,0,0,0,1,0|2,1,0]=4 3996 B15R2.2196 c1ccc(cc1)CSCc2ncc[nH]2 62a_100016991755_100015291786 [0,0,0,0,1,0|2,1,0]=4 3997 B15R2.2196 c1ccc(cc1)CSCc2ncco2 62a_100000211182_103436540062 [0,0,0,0,1,0|2,1,0]=4 3998 B15R2.2196 c1ccc(cc1)CSCc2ncco2 62a_103436540062_100015291786 [0,0,0,0,1,0|2,1,0]=4 3999 B15R2.2196 c1ccc(cc1)CSCc2nccs2 62a_100000211182_100015184050 [0,0,0,0,1,0|2,1,0]=4 4000 B15R2.2196 c1ccc(cc1)CSCc2nccs2 62a_100015184050_100015291786 [0,0,0,0,1,0|2,1,0]=4 4001 B15R2.2196 c1ccc(cc1)NCCc2cccs2 34a_100000106764_100000748579 [0,0,0,0,1,0|3,0,0]=4 4002 B15R2.2196 c1ccc(cc1)OCCc2cccs2 34a_100000210340_100000748579 [0,0,0,0,1,0|3,0,0]=4 4003 B15R2.2196 c1ccc(cc1)OCCc2cccs2 7a_100000210340_100000748579 [0,0,0,0,1,0|3,0,0]=4 4004 B15R2.2196 c1ccc(cc1)OCCn2cccc2 7a_100000210340_200000035178 [0,0,0,0,1,0|3,0,0]=4 4005 B15R2.2196 c1ccc(cc1)SCCc2cccs2 62a_100000719477_100000748579 [0,0,0,0,1,0|3,0,0]=4 4006 B15R2.2196 c1ccc(cc1)SCCc2cccs2 62a_100000748579_100000041952 [0,0,0,0,1,0|3,0,0]=4 4007 B15R2.2196 c1ccc(cc1)SCCn2cccc2 62a_100000719477_200000035178 [0,0,0,0,1,0|3,0,0]=4 4008 B15R2.2196 c1ccc(cc1)SCCn2cccc2 62a_200009811947_100000041952 [0,0,0,0,1,0|3,0,0]=4 4009 B15R2.2196 c1ccc(nc1)CNCc2ccco2 207a_100000185738_100000209966 [0,0,0,0,1,0|3,0,0]=4 4010 B15R2.2196 c1ccc(nc1)CNCc2ccco2 2230a_100000185738_100000721315 [0,0,0,0,1,0|3,0,0]=4 4011 B15R2.2196 c1ccc(nc1)CNCc2ccco2 270004a_100000185738_100000209966 [0,0,0,0,1,0|3,0,0]=4 4012 B15R2.2196 c1ccc(nc1)CNCc2ccco2 270004a_100000210449_100000186105 [0,0,0,0,1,0|3,0,0]=4 4013 B15R2.2196 c1ccc(nc1)CNCc2ccco2 34a_100000185738_100000721315 [0,0,0,0,1,0|3,0,0]=4 4014 B15R2.2196 c1ccc(nc1)CNCc2cccs2 207a_100000211653_100000209966 [0,0,0,0,1,0|3,0,0]=4 4015 B15R2.2196 c1ccc(nc1)CNCc2cccs2 2230a_100000211653_100000721315 [0,0,0,0,1,0|3,0,0]=4 4016 B15R2.2196 c1ccc(nc1)CNCc2cccs2 270004a_100000210449_100000209959 [0,0,0,0,1,0|3,0,0]=4 4017 B15R2.2196 c1ccc(nc1)CNCc2cccs2 270004a_100000211653_100000209966 [0,0,0,0,1,0|3,0,0]=4 4018 B15R2.2196 c1ccc(nc1)CNCc2ccoc2 207a_100015206860_100000209966 [0,0,0,0,1,0|3,0,0]=4 4019 B15R2.2196 c1ccc(nc1)CNCc2ccoc2 2230a_100015206860_100000721315 [0,0,0,0,1,0|3,0,0]=4 4020 B15R2.2196 c1ccc(nc1)CNCc2ccoc2 270004a_100000210449_100011215517 [0,0,0,0,1,0|3,0,0]=4 4021 B15R2.2196 c1ccc(nc1)CNCc2ccoc2 270004a_100015206860_100000209966 [0,0,0,0,1,0|3,0,0]=4 4022 B15R2.2196 c1ccc(nc1)CNCc2ccoc2 34a_100015206860_100000721315 [0,0,0,0,1,0|3,0,0]=4 4023 B15R2.2196 c1ccc(nc1)CNCc2ccsc2 207a_100000186416_100000209966 [0,0,0,0,1,0|3,0,0]=4 4024 B15R2.2196 c1ccc(nc1)CNCc2ccsc2 2230a_100000186416_100000721315 [0,0,0,0,1,0|3,0,0]=4 4025 B15R2.2196 c1ccc(nc1)CNCc2ccsc2 270004a_100000186416_100000209966 [0,0,0,0,1,0|3,0,0]=4 4026 B15R2.2196 c1ccc(nc1)CNCc2ccsc2 270004a_100000210449_100000188534 [0,0,0,0,1,0|3,0,0]=4 4027 B15R2.2196 c1ccc(nc1)CNCc2ccsc2 34a_100000186416_100000721315 [0,0,0,0,1,0|3,0,0]=4 4028 B15R2.2196 c1ccc(nc1)COCc2ccco2 34a_100000210059_100000721315 [0,0,0,0,1,0|2,0,0]=3 4029 B15R2.2196 c1ccc(nc1)COCc2cccs2 34a_100000211240_100000721315 [0,0,0,0,1,0|2,0,0]=3 4030 B15R2.2196 c1ccc(nc1)COCc2ccno2 34a_100000740478_100000721315 [0,0,0,0,1,0|3,0,0]=4 4031 B15R2.2196 c1ccc(nc1)COCc2ccoc2 34a_100011215357_100000721315 [0,0,0,0,1,0|2,0,0]=3 4032 B15R2.2196 c1ccc(nc1)COCc2ccsc2 34a_100011215551_100000721315 [0,0,0,0,1,0|2,0,0]=3 4033 B15R2.2196 c1ccc(nc1)COCc2ncco2 34a_100000062594_100000721315 [0,0,0,0,1,0|3,0,0]=4 4034 B15R2.2196 c1ccc(nc1)COCn2cccn2 34a_100000731028_100000721315 [0,0,0,0,1,0|3,0,0]=4 4035 B15R2.2196 c1ccc(nc1)CSCc2ccsc2 62a_100000721315_100011233845 [0,0,0,0,1,0|2,1,0]=4 4036 B15R2.2196 c1ccc(nc1)CSCc2ccsc2 62a_100011261437_100000721315 [0,0,0,0,1,0|2,1,0]=4 4037 B15R2.2196 c1cnc(cn1)COCc2ccoc2 34a_100011215357_100016995436 [0,0,0,0,1,0|3,0,0]=4 4038 B15R2.2196 c1cnc(cn1)COCc2ccsc2 34a_100011215551_100016995436 [0,0,0,0,1,0|3,0,0]=4 4039 B15R2.2196 c1cnc(nc1)COCc2ccco2 34a_100000210059_100000703007 [0,0,0,0,1,0|3,0,0]=4 4040 B15R2.2196 c1cnc(nc1)COCc2cccs2 34a_100000211240_100000703007 [0,0,0,0,1,0|3,0,0]=4 4041 B15R2.2196 c1cnc(nc1)COCc2ccoc2 34a_100011215357_100000703007 [0,0,0,0,1,0|3,0,0]=4 4042 B15R2.2196 c1cnc(nc1)COCc2ccsc2 34a_100011215551_100000703007 [0,0,0,0,1,0|3,0,0]=4 4043 B15R2.2196 c1cncc(c1)CNCc2ccco2 207a_100000185738_100000209961 [0,0,0,0,1,0|3,0,0]=4 4044 B15R2.2196 c1cncc(c1)CNCc2ccco2 207a_100000210453_100000186105 [0,0,0,0,1,0|3,0,0]=4 4045 B15R2.2196 c1cncc(c1)CNCc2ccco2 2230a_100000185738_100000741622 [0,0,0,0,1,0|3,0,0]=4 4046 B15R2.2196 c1cncc(c1)CNCc2ccco2 270004a_100000185738_100000209961 [0,0,0,0,1,0|3,0,0]=4 4047 B15R2.2196 c1cncc(c1)CNCc2ccco2 270004a_100000210453_100000186105 [0,0,0,0,1,0|3,0,0]=4 4048 B15R2.2196 c1cncc(c1)CNCc2ccco2 34a_100000185738_100000733263 [0,0,0,0,1,0|3,0,0]=4 4049 B15R2.2196 c1cncc(c1)CNCc2cccs2 207a_100000210453_100000209959 [0,0,0,0,1,0|3,0,0]=4 4050 B15R2.2196 c1cncc(c1)CNCc2cccs2 207a_100000211653_100000209961 [0,0,0,0,1,0|3,0,0]=4 4051 B15R2.2196 c1cncc(c1)CNCc2cccs2 2230a_100000211653_100000741622 [0,0,0,0,1,0|3,0,0]=4 4052 B15R2.2196 c1cncc(c1)CNCc2cccs2 270004a_100000210453_100000209959 [0,0,0,0,1,0|3,0,0]=4 4053 B15R2.2196 c1cncc(c1)CNCc2cccs2 270004a_100000211653_100000209961 [0,0,0,0,1,0|3,0,0]=4 4054 B15R2.2196 c1cncc(c1)CNCc2ccoc2 207a_100000210453_100011215517 [0,0,0,0,1,0|3,0,0]=4 4055 B15R2.2196 c1cncc(c1)CNCc2ccoc2 207a_100015206860_100000209961 [0,0,0,0,1,0|3,0,0]=4 4056 B15R2.2196 c1cncc(c1)CNCc2ccoc2 2230a_100015206860_100000741622 [0,0,0,0,1,0|3,0,0]=4 4057 B15R2.2196 c1cncc(c1)CNCc2ccoc2 270004a_100000210453_100011215517 [0,0,0,0,1,0|3,0,0]=4 4058 B15R2.2196 c1cncc(c1)CNCc2ccoc2 270004a_100015206860_100000209961 [0,0,0,0,1,0|3,0,0]=4 4059 B15R2.2196 c1cncc(c1)CNCc2ccoc2 34a_100015206860_100000733263 [0,0,0,0,1,0|3,0,0]=4 4060 B15R2.2196 c1cncc(c1)CNCc2ccsc2 207a_100000186416_100000209961 [0,0,0,0,1,0|3,0,0]=4 4061 B15R2.2196 c1cncc(c1)CNCc2ccsc2 207a_100000210453_100000188534 [0,0,0,0,1,0|3,0,0]=4 4062 B15R2.2196 c1cncc(c1)CNCc2ccsc2 2230a_100000186416_100000741622 [0,0,0,0,1,0|3,0,0]=4 4063 B15R2.2196 c1cncc(c1)CNCc2ccsc2 270004a_100000186416_100000209961 [0,0,0,0,1,0|3,0,0]=4 4064 B15R2.2196 c1cncc(c1)CNCc2ccsc2 270004a_100000210453_100000188534 [0,0,0,0,1,0|3,0,0]=4 4065 B15R2.2196 c1cncc(c1)CNCc2ccsc2 34a_100000186416_100000733263 [0,0,0,0,1,0|3,0,0]=4 4066 B15R2.2196 c1cncc(c1)COCc2ccco2 34a_100000210059_100000733263 [0,0,0,0,1,0|2,0,0]=3 4067 B15R2.2196 c1cncc(c1)COCc2cccs2 34a_100000211240_100000733263 [0,0,0,0,1,0|2,0,0]=3 4068 B15R2.2196 c1cncc(c1)COCc2ccno2 34a_100000740478_100000733263 [0,0,0,0,1,0|3,0,0]=4 4069 B15R2.2196 c1cncc(c1)COCc2ccoc2 34a_100011215357_100000733263 [0,0,0,0,1,0|2,0,0]=3 4070 B15R2.2196 c1cncc(c1)COCc2ccsc2 34a_100011215551_100000733263 [0,0,0,0,1,0|2,0,0]=3 4071 B15R2.2196 c1cncc(c1)COCc2ncco2 34a_100000062594_100000733263 [0,0,0,0,1,0|3,0,0]=4 4072 B15R2.2196 c1cncc(c1)COCn2cccn2 34a_100000731028_100000733263 [0,0,0,0,1,0|3,0,0]=4 4073 B15R2.2196 c1cncc(c1)CSCc2ccsc2 62a_100000741622_100011233845 [0,0,0,0,1,0|2,1,0]=4 4074 B15R2.2196 c1cncc(c1)CSCc2ccsc2 62a_100011261437_100000741622 [0,0,0,0,1,0|2,1,0]=4 4075 B15R2.2196 c1cnnc(c1)COCc2ccco2 34a_100000210059_100016990269 [0,0,0,0,1,0|3,0,0]=4 4076 B15R2.2196 c1cnnc(c1)COCc2cccs2 34a_100000211240_100016990269 [0,0,0,0,1,0|3,0,0]=4 4077 B15R2.2196 c1cnnc(c1)COCc2ccoc2 34a_100011215357_100016990269 [0,0,0,0,1,0|3,0,0]=4 4078 B15R2.2196 c1cnnc(c1)COCc2ccsc2 34a_100011215551_100016990269 [0,0,0,0,1,0|3,0,0]=4 4079 B15R2.2196 c1coc(c1)CNCc2ccncc2 207a_100000185738_100000186114 [0,0,0,0,1,0|3,0,0]=4 4080 B15R2.2196 c1coc(c1)CNCc2ccncc2 2230a_100000185738_100015193705 [0,0,0,0,1,0|3,0,0]=4 4081 B15R2.2196 c1coc(c1)COCc2cnccn2 34a_100000210059_100016995436 [0,0,0,0,1,0|3,0,0]=4 4082 B15R2.2196 c1coc(c1)COCc2cncnc2 34a_100000210059_100015196519 [0,0,0,0,1,0|3,0,0]=4 4083 B15R2.2196 c1csc(c1)CNCc2ccncc2 207a_100000211653_100000186114 [0,0,0,0,1,0|3,0,0]=4 4084 B15R2.2196 c1csc(c1)CNCc2ccncc2 2230a_100000211653_100015193705 [0,0,0,0,1,0|3,0,0]=4 4085 B15R2.2196 c1csc(c1)COCc2cnccn2 34a_100000211240_100016995436 [0,0,0,0,1,0|3,0,0]=4 4086 B15R2.2196 c1csc(c1)COCc2cncnc2 34a_100000211240_100015196519 [0,0,0,0,1,0|3,0,0]=4 4087 B15R2.2196 c1ncc(cn1)COCc2ccoc2 34a_100011215357_100015196519 [0,0,0,0,1,0|3,0,0]=4 4088 B15R2.2196 c1ncc(cn1)COCc2ccsc2 34a_100011215551_100015196519 [0,0,0,0,1,0|3,0,0]=4 4089 B17R2.2382 C(#Cc1ccccc1)CNc2ccccc2 34a_100000106764_100011352542 [0,0,0,0,0,1|1,0,1]=3 4090 B17R2.2382 C(#Cc1ccccc1)COc2ccccc2 34a_100000210340_100011352542 [0,0,0,0,0,1|1,0,1]=3 4091 B17R2.2382 C(#Cc1ccccc1)COc2ccccc2 7a_100000210340_100011352542 [0,0,0,0,0,1|1,0,1]=3 4092 B17R2.2382 C(#Cc1ccccc1)COc2cccnc2 34a_100000210849_100011352542 [0,0,0,0,0,1|2,0,1]=4 4093 B17R2.2382 C(#Cc1ccccc1)COc2cccnc2 7a_100000210849_100011352542 [0,0,0,0,0,1|2,0,1]=4 4094 B17R2.2382 C(#Cc1ccccc1)COc2ccncc2 34a_100000212176_100011352542 [0,0,0,0,0,1|2,0,1]=4 4095 B17R2.2382 C(#Cc1ccccc1)CSc2ccccc2 62a_100000719477_100011352542 [0,0,0,0,0,1|1,0,1]=3 4096 B17R2.2382 C(#Cc1ccccc1)CSc2ccccn2 62a_100011216584_100011352542 [0,0,0,0,0,1|2,0,1]=4 4097 B17R2.2382 C(#Cc1ccccc1)CSc2cccnc2 62a_100000210063_100011352542 [0,0,0,0,0,1|2,0,1]=4 4098 B17R2.2382 C(#Cc1ccccc1)CSc2ccncc2 62a_100000728582_100011352542 [0,0,0,0,0,1|2,0,1]=4 4099 B17R2.2382 C(=C/c1ccccc1)\CNc2ccccc2 34a_100000106764_100016265936 [0,0,0,0,0,1|1,0,1]=3 4100 B17R2.2382 C(=C/c1ccccc1)\COc2ccccc2 34a_100000210340_100016265936 [0,0,0,0,0,1|1,0,1]=3 4101 B17R2.2382 C(=C/c1ccccc1)\COc2ccccc2 7a_100000210340_100016265936 [0,0,0,0,0,1|1,0,1]=3 4102 B17R2.2382 C(=C/c1ccccc1)\COc2cccnc2 34a_100000210849_100016265936 [0,0,0,0,0,1|2,0,1]=4 4103 B17R2.2382 C(=C/c1ccccc1)\COc2cccnc2 7a_100000210849_100016265936 [0,0,0,0,0,1|2,0,1]=4 4104 B17R2.2382 C(=C/c1ccccc1)\COc2ccncc2 34a_100000212176_100016265936 [0,0,0,0,0,1|2,0,1]=4 4105 B17R2.2382 C(=C/c1ccccc1)\CSc2ccccc2 62a_100000719477_100016265936 [0,0,0,0,0,1|1,0,1]=3 4106 B17R2.2382 C(=C/c1ccccc1)\CSc2ccccc2 62a_100016265936_100000041952 [0,0,0,0,0,1|1,0,1]=3 4107 B17R2.2382 C(=C/c1ccccc1)\CSc2ccccn2 62a_100011216584_100016265936 [0,0,0,0,0,1|2,0,1]=4 4108 B17R2.2382 C(=C/c1ccccc1)\CSc2ccccn2 62a_100016265936_100011216584 [0,0,0,0,0,1|2,0,1]=4 4109 B17R2.2382 C(=C/c1ccccc1)\CSc2cccnc2 62a_100000210063_100016265936 [0,0,0,0,0,1|2,0,1]=4 4110 B17R2.2382 C(=C/c1ccccc1)\CSc2cccnc2 62a_100016265936_100000210063 [0,0,0,0,0,1|2,0,1]=4 4111 B17R2.2382 C(=C/c1ccccc1)\CSc2ccncc2 62a_100000728582_100016265936 [0,0,0,0,0,1|2,0,1]=4 4112 B17R2.2382 C(=C/c1ccccc1)\CSc2ccncc2 62a_100016265936_100000728582 [0,0,0,0,0,1|2,0,1]=4 4113 B17R2.2382 C(=NNCc1ccccc1)c2ccccc2 4a_100000007032_100015611070 [0,0,0,0,0,1|1,0,1]=3 4114 B17R2.2382 C(=NNCc1ccccc1)c2ccccn2 4a_100000007032_100000209966 [0,0,0,0,0,1|2,0,1]=4 4115 B17R2.2382 C(=NNCc1ccccc1)c2cccnc2 4a_100000007032_100000209961 [0,0,0,0,0,1|2,0,1]=4 4116 B17R2.2382 C(=NNCc1ccccc1)c2ccncc2 4a_100000007032_100000186114 [0,0,0,0,0,1|2,0,1]=4 4117 B17R2.2382 C(=NNCc1ccccn1)c2ccccc2 4a_100000736832_100015611070 [0,0,0,0,0,1|2,0,1]=4 4118 B17R2.2382 C(=NNCc1cccnc1)c2ccccc2 4a_100000738295_100015611070 [0,0,0,0,0,1|2,0,1]=4 4119 B17R2.2382 C(=NNCc1ccncc1)c2ccccc2 4a_100000736929_100015611070 [0,0,0,0,0,1|2,0,1]=4 4120 B17R2.2382 C(=NNc1ccccc1)Cc2ccccc2 4a_100015195140_100000209964 [0,0,0,0,0,1|2,0,0]=3 4121 B17R2.2382 C(=NNc1ccccn1)Cc2ccccc2 4a_100000183288_100000209964 [0,0,0,0,0,1|3,0,0]=4 4122 B17R2.2382 C(=NNc1cccnc1)Cc2ccccc2 4a_100000728903_100000209964 [0,0,0,0,0,1|3,0,0]=4 4123 B17R2.2382 C(=NNc1ccncc1)Cc2ccccc2 4a_100000698918_100000209964 [0,0,0,0,0,1|3,0,0]=4 4124 B17R2.2382 c1cc(ccn1)CCNCc2ccncc2 207a_100000742849_100000186114 [0,0,0,0,0,1|3,0,0]=4 4125 B17R2.2382 c1cc(ccn1)CCOCc2cnccn2 34a_100011216225_100016995436 [0,0,0,0,0,1|3,0,0]=4 4126 B17R2.2382 c1cc(ccn1)CCOCc2cncnc2 34a_100011216225_100015196519 [0,0,0,0,0,1|3,0,0]=4 4127 B17R2.2382 c1cc(ccn1)CCSCc2ccncc2 62a_100000723409_100015193705 [0,0,0,0,0,1|2,1,0]=4 4128 B17R2.2382 c1cc(ccn1)CCSCc2ccncc2 62a_100015193705_100000723409 [0,0,0,0,0,1|2,1,0]=4 4129 B17R2.2382 c1ccc(cc1)CCCNc2ccccc2 34a_100000106764_100000211621 [0,0,0,0,0,1|1,0,0]=2 4130 B17R2.2382 c1ccc(cc1)CCCNc2cccnn2 27a_100000211184_100016991348 [0,0,0,0,0,1|3,0,0]=4 4131 B17R2.2382 c1ccc(cc1)CCCNc2ccncn2 27a_100000211184_100000703185 [0,0,0,0,0,1|3,0,0]=4 4132 B17R2.2382 c1ccc(cc1)CCCNc2cnccn2 27a_100000211184_100000211759 [0,0,0,0,0,1|3,0,0]=4 4133 B17R2.2382 c1ccc(cc1)CCCNc2ncccn2 27a_100000211184_100000211032 [0,0,0,0,0,1|3,0,0]=4 4134 B17R2.2382 c1ccc(cc1)CCCOc2ccccc2 34a_100000210340_100000211621 [0,0,0,0,0,1|1,0,0]=2 4135 B17R2.2382 c1ccc(cc1)CCCOc2ccccc2 7a_100000210340_100000211621 [0,0,0,0,0,1|1,0,0]=2 4136 B17R2.2382 c1ccc(cc1)CCCOc2cccnc2 34a_100000210849_100000211621 [0,0,0,0,0,1|2,0,0]=3 4137 B17R2.2382 c1ccc(cc1)CCCOc2cccnc2 7a_100000210849_100000211621 [0,0,0,0,0,1|2,0,0]=3 4138 B17R2.2382 c1ccc(cc1)CCCOc2ccncc2 34a_100000212176_100000211621 [0,0,0,0,0,1|2,0,0]=3 4139 B17R2.2382 c1ccc(cc1)CCCOc2ccnnc2 34a_100015204005_100000211621 [0,0,0,0,0,1|3,0,0]=4 4140 B17R2.2382 c1ccc(cc1)CCCOc2cncnc2 7a_100000754086_100000211621 [0,0,0,0,0,1|3,0,0]=4 4141 B17R2.2382 c1ccc(cc1)CCCSc2ccccc2 62a_100000211621_100000041952 [0,0,0,0,0,1|1,0,0]=2 4142 B17R2.2382 c1ccc(cc1)CCCSc2ccccc2 62a_100000719477_100000211621 [0,0,0,0,0,1|1,0,0]=2 4143 B17R2.2382 c1ccc(cc1)CCCSc2ccccn2 62a_100000211621_100011216584 [0,0,0,0,0,1|2,0,0]=3 4144 B17R2.2382 c1ccc(cc1)CCCSc2ccccn2 62a_100011216584_100000211621 [0,0,0,0,0,1|2,0,0]=3 4145 B17R2.2382 c1ccc(cc1)CCCSc2cccnc2 62a_100000210063_100000211621 [0,0,0,0,0,1|2,0,0]=3 4146 B17R2.2382 c1ccc(cc1)CCCSc2cccnc2 62a_100000211621_100000210063 [0,0,0,0,0,1|2,0,0]=3 4147 B17R2.2382 c1ccc(cc1)CCCSc2cccnn2 62a_100000211621_100016991348 [0,0,0,0,0,1|3,0,0]=4 4148 B17R2.2382 c1ccc(cc1)CCCSc2cccnn2 62a_100016991348_100000211621 [0,0,0,0,0,1|3,0,0]=4 4149 B17R2.2382 c1ccc(cc1)CCCSc2ccncc2 62a_100000211621_100000728582 [0,0,0,0,0,1|2,0,0]=3 4150 B17R2.2382 c1ccc(cc1)CCCSc2ccncc2 62a_100000728582_100000211621 [0,0,0,0,0,1|2,0,0]=3 4151 B17R2.2382 c1ccc(cc1)CCCSc2ccncn2 62a_100000211621_100000703185 [0,0,0,0,0,1|3,0,0]=4 4152 B17R2.2382 c1ccc(cc1)CCCSc2ccncn2 62a_100000703185_100000211621 [0,0,0,0,0,1|3,0,0]=4 4153 B17R2.2382 c1ccc(cc1)CCCSc2ccnnc2 62a_100000211621_100000732662 [0,0,0,0,0,1|3,0,0]=4 4154 B17R2.2382 c1ccc(cc1)CCCSc2ccnnc2 62a_100000732662_100000211621 [0,0,0,0,0,1|3,0,0]=4 4155 B17R2.2382 c1ccc(cc1)CCCSc2cnccn2 62a_100000211621_100000211759 [0,0,0,0,0,1|3,0,0]=4 4156 B17R2.2382 c1ccc(cc1)CCCSc2cnccn2 62a_100000211759_100000211621 [0,0,0,0,0,1|3,0,0]=4 4157 B17R2.2382 c1ccc(cc1)CCCSc2cncnc2 62a_100000211621_100011206942 [0,0,0,0,0,1|3,0,0]=4 4158 B17R2.2382 c1ccc(cc1)CCCSc2cncnc2 62a_100011206942_100000211621 [0,0,0,0,0,1|3,0,0]=4 4159 B17R2.2382 c1ccc(cc1)CCCSc2ncccn2 62a_100000211032_100000211621 [0,0,0,0,0,1|3,0,0]=4 4160 B17R2.2382 c1ccc(cc1)CCCSc2ncccn2 62a_100000211621_100000211032 [0,0,0,0,0,1|3,0,0]=4 4161 B17R2.2382 c1ccc(cc1)CCNCc2ccccc2 207a_100000106460_100015611070 [0,0,0,0,0,1|1,0,0]=2 4162 B17R2.2382 c1ccc(cc1)CCNCc2ccccc2 2230a_100000106460_100015291786 [0,0,0,0,0,1|1,0,0]=2 4163 B17R2.2382 c1ccc(cc1)CCNCc2ccccc2 2230a_100015324214_100000765856 [0,0,0,0,0,1|1,0,0]=2 4164 B17R2.2382 c1ccc(cc1)CCNCc2ccccc2 270004a_100000106460_100015611070 [0,0,0,0,0,1|1,0,0]=2 4165 B17R2.2382 c1ccc(cc1)CCNCc2ccccc2 34a_100000106460_100015291786 [0,0,0,0,0,1|1,0,0]=2 4166 B17R2.2382 c1ccc(cc1)CCNCc2ccccc2 34a_100015324214_100000765856 [0,0,0,0,0,1|1,0,0]=2 4167 B17R2.2382 c1ccc(cc1)CCNCc2ccccn2 207a_100000106460_100000209966 [0,0,0,0,0,1|2,0,0]=3 4168 B17R2.2382 c1ccc(cc1)CCNCc2ccccn2 2230a_100000106460_100000721315 [0,0,0,0,0,1|2,0,0]=3 4169 B17R2.2382 c1ccc(cc1)CCNCc2ccccn2 270004a_100000106460_100000209966 [0,0,0,0,0,1|2,0,0]=3 4170 B17R2.2382 c1ccc(cc1)CCNCc2ccccn2 34a_100000106460_100000721315 [0,0,0,0,0,1|2,0,0]=3 4171 B17R2.2382 c1ccc(cc1)CCNCc2cccnc2 207a_100000106460_100000209961 [0,0,0,0,0,1|2,0,0]=3 4172 B17R2.2382 c1ccc(cc1)CCNCc2cccnc2 2230a_100000106460_100000741622 [0,0,0,0,0,1|2,0,0]=3 4173 B17R2.2382 c1ccc(cc1)CCNCc2cccnc2 270004a_100000106460_100000209961 [0,0,0,0,0,1|2,0,0]=3 4174 B17R2.2382 c1ccc(cc1)CCNCc2cccnc2 34a_100000106460_100000733263 [0,0,0,0,0,1|2,0,0]=3 4175 B17R2.2382 c1ccc(cc1)CCNCc2cccnn2 2230a_100000106460_100016990269 [0,0,0,0,0,1|3,0,0]=4 4176 B17R2.2382 c1ccc(cc1)CCNCc2cccnn2 2230a_100159270163_100000765856 [0,0,0,0,0,1|3,0,0]=4 4177 B17R2.2382 c1ccc(cc1)CCNCc2cccnn2 34a_100000106460_100016990269 [0,0,0,0,0,1|3,0,0]=4 4178 B17R2.2382 c1ccc(cc1)CCNCc2ccncc2 207a_100000106460_100000186114 [0,0,0,0,0,1|2,0,0]=3 4179 B17R2.2382 c1ccc(cc1)CCNCc2ccncc2 2230a_100000106460_100015193705 [0,0,0,0,0,1|2,0,0]=3 4180 B17R2.2382 c1ccc(cc1)CCNCc2ccnnc2 270004a_100000106460_100011934578 [0,0,0,0,0,1|3,0,0]=4 4181 B17R2.2382 c1ccc(cc1)CCNCc2cnccn2 2230a_100000106460_100016995436 [0,0,0,0,0,1|3,0,0]=4 4182 B17R2.2382 c1ccc(cc1)CCNCc2cnccn2 270004a_100000106460_100000749867 [0,0,0,0,0,1|3,0,0]=4 4183 B17R2.2382 c1ccc(cc1)CCNCc2cnccn2 34a_100000106460_100016995436 [0,0,0,0,0,1|3,0,0]=4 4184 B17R2.2382 c1ccc(cc1)CCNCc2cncnc2 2230a_100000106460_100015196519 [0,0,0,0,0,1|3,0,0]=4 4185 B17R2.2382 c1ccc(cc1)CCNCc2cncnc2 2230a_100011243677_100000765856 [0,0,0,0,0,1|3,0,0]=4 4186 B17R2.2382 c1ccc(cc1)CCNCc2cncnc2 270004a_100000106460_100000749868 [0,0,0,0,0,1|3,0,0]=4 4187 B17R2.2382 c1ccc(cc1)CCNCc2cncnc2 34a_100000106460_100015196519 [0,0,0,0,0,1|3,0,0]=4 4188 B17R2.2382 c1ccc(cc1)CCNCc2ncccn2 2230a_100000106460_100000703007 [0,0,0,0,0,1|3,0,0]=4 4189 B17R2.2382 c1ccc(cc1)CCNCc2ncccn2 270004a_100000106460_100011532527 [0,0,0,0,0,1|3,0,0]=4 4190 B17R2.2382 c1ccc(cc1)CCNCc2ncccn2 34a_100000106460_100000703007 [0,0,0,0,0,1|3,0,0]=4 4191 B17R2.2382 c1ccc(cc1)CCOCc2ccccc2 34a_100000210268_100015291786 [0,0,0,0,0,1|0,0,0]=1 4192 B17R2.2382 c1ccc(cc1)CCOCc2ccccc2 34a_100000210790_100000765856 [0,0,0,0,0,1|0,0,0]=1 4193 B17R2.2382 c1ccc(cc1)CCOCc2ccccc2 7a_100000210268_100000211182 [0,0,0,0,0,1|0,0,0]=1 4194 B17R2.2382 c1ccc(cc1)CCOCc2ccccc2 7a_100000210790_100000765856 [0,0,0,0,0,1|0,0,0]=1 4195 B17R2.2382 c1ccc(cc1)CCOCc2ccccn2 34a_100000210268_100000721315 [0,0,0,0,0,1|1,0,0]=2 4196 B17R2.2382 c1ccc(cc1)CCOCc2ccccn2 7a_100000210268_100000721315 [0,0,0,0,0,1|1,0,0]=2 4197 B17R2.2382 c1ccc(cc1)CCOCc2cccnc2 34a_100000210268_100000733263 [0,0,0,0,0,1|1,0,0]=2 4198 B17R2.2382 c1ccc(cc1)CCOCc2cccnc2 7a_100000210268_100000741622 [0,0,0,0,0,1|1,0,0]=2 4199 B17R2.2382 c1ccc(cc1)CCOCc2cccnn2 34a_100000210268_100016990269 [0,0,0,0,0,1|2,0,0]=3 4200 B17R2.2382 c1ccc(cc1)CCOCc2cccnn2 7a_100000210268_100016990269 [0,0,0,0,0,1|2,0,0]=3 4201 B17R2.2382 c1ccc(cc1)CCOCc2ccncc2 7a_100000210268_100015193705 [0,0,0,0,0,1|1,0,0]=2 4202 B17R2.2382 c1ccc(cc1)CCOCc2cnccn2 34a_100000210268_100016995436 [0,0,0,0,0,1|2,0,0]=3 4203 B17R2.2382 c1ccc(cc1)CCOCc2cnccn2 7a_100000210268_100016995436 [0,0,0,0,0,1|2,0,0]=3 4204 B17R2.2382 c1ccc(cc1)CCOCc2cncnc2 34a_100000210268_100015196519 [0,0,0,0,0,1|2,0,0]=3 4205 B17R2.2382 c1ccc(cc1)CCOCc2cncnc2 7a_100000210268_100015196519 [0,0,0,0,0,1|2,0,0]=3 4206 B17R2.2382 c1ccc(cc1)CCOCc2ncccn2 34a_100000210268_100000703007 [0,0,0,0,0,1|2,0,0]=3 4207 B17R2.2382 c1ccc(cc1)CCOCc2ncccn2 7a_100000210268_100000703007 [0,0,0,0,0,1|2,0,0]=3 4208 B17R2.2382 c1ccc(cc1)CCSCc2ccccc2 62a_100000211182_100011218657 [0,0,0,0,0,1|0,1,0]=2 4209 B17R2.2382 c1ccc(cc1)CCSCc2ccccc2 62a_100000765856_100015291786 [0,0,0,0,0,1|0,1,0]=2 4210 B17R2.2382 c1ccc(cc1)CCSCc2ccccn2 62a_100000721315_100011218657 [0,0,0,0,0,1|1,1,0]=3 4211 B17R2.2382 c1ccc(cc1)CCSCc2ccccn2 62a_100000765856_100000721315 [0,0,0,0,0,1|1,1,0]=3 4212 B17R2.2382 c1ccc(cc1)CCSCc2cccnc2 62a_100000741622_100011218657 [0,0,0,0,0,1|1,1,0]=3 4213 B17R2.2382 c1ccc(cc1)CCSCc2cccnc2 62a_100000765856_100000741622 [0,0,0,0,0,1|1,1,0]=3 4214 B17R2.2382 c1ccc(cc1)CCSCc2cccnn2 62a_100000765856_100016990269 [0,0,0,0,0,1|2,1,0]=4 4215 B17R2.2382 c1ccc(cc1)CCSCc2cccnn2 62a_100016990269_100011218657 [0,0,0,0,0,1|2,1,0]=4 4216 B17R2.2382 c1ccc(cc1)CCSCc2ccncc2 62a_100000765856_100015193705 [0,0,0,0,0,1|1,1,0]=3 4217 B17R2.2382 c1ccc(cc1)CCSCc2ccncc2 62a_100015193705_100011218657 [0,0,0,0,0,1|1,1,0]=3 4218 B17R2.2382 c1ccc(cc1)CCSCc2cnccn2 62a_100000765856_100016995436 [0,0,0,0,0,1|2,1,0]=4 4219 B17R2.2382 c1ccc(cc1)CCSCc2cnccn2 62a_100016995436_100011218657 [0,0,0,0,0,1|2,1,0]=4 4220 B17R2.2382 c1ccc(cc1)CCSCc2cncnc2 62a_100000765856_100015196519 [0,0,0,0,0,1|2,1,0]=4 4221 B17R2.2382 c1ccc(cc1)CCSCc2cncnc2 62a_100015196519_100011218657 [0,0,0,0,0,1|2,1,0]=4 4222 B17R2.2382 c1ccc(cc1)CCSCc2ncccn2 62a_100000703007_100011218657 [0,0,0,0,0,1|2,1,0]=4 4223 B17R2.2382 c1ccc(cc1)CCSCc2ncccn2 62a_100000765856_100000703007 [0,0,0,0,0,1|2,1,0]=4 4224 B17R2.2382 c1ccc(cc1)CNCCc2ccccn2 207a_100000211156_100015611070 [0,0,0,0,0,1|2,0,0]=3 4225 B17R2.2382 c1ccc(cc1)CNCCc2ccccn2 2230a_100015324214_100015183660 [0,0,0,0,0,1|2,0,0]=3 4226 B17R2.2382 c1ccc(cc1)CNCCc2ccccn2 270004a_100000211156_100015611070 [0,0,0,0,0,1|2,0,0]=3 4227 B17R2.2382 c1ccc(cc1)CNCCc2cccnc2 207a_100000736294_100015611070 [0,0,0,0,0,1|2,0,0]=3 4228 B17R2.2382 c1ccc(cc1)CNCCc2cccnc2 2230a_100000736294_100015291786 [0,0,0,0,0,1|2,0,0]=3 4229 B17R2.2382 c1ccc(cc1)CNCCc2cccnc2 2230a_100015324214_200011713674 [0,0,0,0,0,1|2,0,0]=3 4230 B17R2.2382 c1ccc(cc1)CNCCc2cccnc2 270004a_100000736294_100015611070 [0,0,0,0,0,1|2,0,0]=3 4231 B17R2.2382 c1ccc(cc1)CNCCc2ccncc2 207a_100000742849_100015611070 [0,0,0,0,0,1|2,0,0]=3 4232 B17R2.2382 c1ccc(cc1)CNCCc2ccncc2 2230a_100015324214_100000723409 [0,0,0,0,0,1|2,0,0]=3 4233 B17R2.2382 c1ccc(cc1)CNCCc2ccncc2 270004a_100000742849_100015611070 [0,0,0,0,0,1|2,0,0]=3 4234 B17R2.2382 c1ccc(cc1)CNCCc2cnccn2 207a_100000723456_100015611070 [0,0,0,0,0,1|3,0,0]=4 4235 B17R2.2382 c1ccc(cc1)CNCCc2cnccn2 270004a_100000723456_100015611070 [0,0,0,0,0,1|3,0,0]=4 4236 B17R2.2382 c1ccc(cc1)CNCSc2ccccc2 2230a_100015324214_100011218342 [0,0,0,0,0,1|1,0,0]=2 4237 B17R2.2382 c1ccc(cc1)COCCc2ccccn2 34a_100000210271_100015291786 [0,0,0,0,0,1|1,0,0]=2 4238 B17R2.2382 c1ccc(cc1)COCCc2ccccn2 7a_100000210790_100015183660 [0,0,0,0,0,1|1,0,0]=2 4239 B17R2.2382 c1ccc(cc1)COCCc2cccnc2 34a_100011217484_100015291786 [0,0,0,0,0,1|1,0,0]=2 4240 B17R2.2382 c1ccc(cc1)COCCc2cccnc2 7a_100000210790_200011713674 [0,0,0,0,0,1|1,0,0]=2 4241 B17R2.2382 c1ccc(cc1)COCCc2ccncc2 34a_100011216225_100015291786 [0,0,0,0,0,1|1,0,0]=2 4242 B17R2.2382 c1ccc(cc1)COCCc2ccncc2 7a_100000210790_100000723409 [0,0,0,0,0,1|1,0,0]=2 4243 B17R2.2382 c1ccc(cc1)COCCc2cnccn2 34a_100011349526_100015291786 [0,0,0,0,0,1|2,0,0]=3 4244 B17R2.2382 c1ccc(cc1)COCCc2cncnc2 34a_100011709255_100015291786 [0,0,0,0,0,1|2,0,0]=3 4245 B17R2.2382 c1ccc(cc1)COCNc2ccccc2 34a_100000106764_100000763385 [0,0,0,0,0,1|0,0,0]=1 4246 B17R2.2382 c1ccc(cc1)COCOc2ccccc2 34a_100000210340_100000763385 [0,0,0,0,0,1|0,0,0]=1 4247 B17R2.2382 c1ccc(cc1)COCOc2cccnc2 34a_100000210849_100000763385 [0,0,0,0,0,1|1,0,0]=2 4248 B17R2.2382 c1ccc(cc1)COCOc2ccncc2 34a_100000212176_100000763385 [0,0,0,0,0,1|1,0,0]=2 4249 B17R2.2382 c1ccc(cc1)COCOc2ccnnc2 34a_100015204005_100000763385 [0,0,0,0,0,1|2,0,0]=3 4250 B17R2.2382 c1ccc(cc1)COCSc2ccccc2 62a_100000719477_100000763385 [0,0,0,0,0,1|0,0,0]=1 4251 B17R2.2382 c1ccc(cc1)COCSc2ccccc2 62a_100000763385_100000041952 [0,0,0,0,0,1|0,0,0]=1 4252 B17R2.2382 c1ccc(cc1)COCSc2ccccn2 62a_100000763385_100011216584 [0,0,0,0,0,1|1,0,0]=2 4253 B17R2.2382 c1ccc(cc1)COCSc2ccccn2 62a_100011216584_100000763385 [0,0,0,0,0,1|1,0,0]=2 4254 B17R2.2382 c1ccc(cc1)COCSc2cccnc2 62a_100000210063_100000763385 [0,0,0,0,0,1|1,0,0]=2 4255 B17R2.2382 c1ccc(cc1)COCSc2cccnc2 62a_100000763385_100000210063 [0,0,0,0,0,1|1,0,0]=2 4256 B17R2.2382 c1ccc(cc1)COCSc2cccnn2 62a_100000763385_100016991348 [0,0,0,0,0,1|2,0,0]=3 4257 B17R2.2382 c1ccc(cc1)COCSc2cccnn2 62a_100016991348_100000763385 [0,0,0,0,0,1|2,0,0]=3 4258 B17R2.2382 c1ccc(cc1)COCSc2ccncc2 62a_100000728582_100000763385 [0,0,0,0,0,1|1,0,0]=2 4259 B17R2.2382 c1ccc(cc1)COCSc2ccncc2 62a_100000763385_100000728582 [0,0,0,0,0,1|1,0,0]=2 4260 B17R2.2382 c1ccc(cc1)COCSc2ccncn2 62a_100000703185_100000763385 [0,0,0,0,0,1|2,0,0]=3 4261 B17R2.2382 c1ccc(cc1)COCSc2ccncn2 62a_100000763385_100000703185 [0,0,0,0,0,1|2,0,0]=3 4262 B17R2.2382 c1ccc(cc1)COCSc2ccnnc2 62a_100000732662_100000763385 [0,0,0,0,0,1|2,0,0]=3 4263 B17R2.2382 c1ccc(cc1)COCSc2ccnnc2 62a_100000763385_100000732662 [0,0,0,0,0,1|2,0,0]=3 4264 B17R2.2382 c1ccc(cc1)COCSc2cnccn2 62a_100000211759_100000763385 [0,0,0,0,0,1|2,0,0]=3 4265 B17R2.2382 c1ccc(cc1)COCSc2cnccn2 62a_100000763385_100000211759 [0,0,0,0,0,1|2,0,0]=3 4266 B17R2.2382 c1ccc(cc1)COCSc2cncnc2 62a_100000763385_100011206942 [0,0,0,0,0,1|2,0,0]=3 4267 B17R2.2382 c1ccc(cc1)COCSc2cncnc2 62a_100011206942_100000763385 [0,0,0,0,0,1|2,0,0]=3 4268 B17R2.2382 c1ccc(cc1)COCSc2cnnnc2 62a_100000763385_100009846058 [0,0,0,0,0,1|3,0,0]=4 4269 B17R2.2382 c1ccc(cc1)COCSc2cnnnc2 62a_100009846058_100000763385 [0,0,0,0,0,1|3,0,0]=4 4270 B17R2.2382 c1ccc(cc1)COCSc2ncccn2 62a_100000211032_100000763385 [0,0,0,0,0,1|2,0,0]=3 4271 B17R2.2382 c1ccc(cc1)COCSc2ncccn2 62a_100000763385_100000211032 [0,0,0,0,0,1|2,0,0]=3 4272 B17R2.2382 c1ccc(cc1)CSCCc2ccccn2 62a_100000211182_100015183660 [0,0,0,0,0,1|1,1,0]=3 4273 B17R2.2382 c1ccc(cc1)CSCCc2ccccn2 62a_100015183660_100015291786 [0,0,0,0,0,1|1,1,0]=3 4274 B17R2.2382 c1ccc(cc1)CSCCc2cccnc2 62a_100000211182_200011713674 [0,0,0,0,0,1|1,1,0]=3 4275 B17R2.2382 c1ccc(cc1)CSCCc2cccnc2 62a_200011713674_100015291786 [0,0,0,0,0,1|1,1,0]=3 4276 B17R2.2382 c1ccc(cc1)CSCCc2ccncc2 62a_100000211182_100000723409 [0,0,0,0,0,1|1,1,0]=3 4277 B17R2.2382 c1ccc(cc1)CSCCc2ccncc2 62a_100000723409_100015291786 [0,0,0,0,0,1|1,1,0]=3 4278 B17R2.2382 c1ccc(cc1)CSCNc2ccccc2 34a_100000106764_200011217039 [0,0,0,0,0,1|0,1,0]=2 4279 B17R2.2382 c1ccc(cc1)CSCOc2ccccc2 34a_100000210340_200011217039 [0,0,0,0,0,1|0,1,0]=2 4280 B17R2.2382 c1ccc(cc1)CSCOc2cccnc2 34a_100000210849_200011217039 [0,0,0,0,0,1|1,1,0]=3 4281 B17R2.2382 c1ccc(cc1)CSCOc2ccncc2 34a_100000212176_200011217039 [0,0,0,0,0,1|1,1,0]=3 4282 B17R2.2382 c1ccc(cc1)CSCOc2ccnnc2 34a_100015204005_200011217039 [0,0,0,0,0,1|2,1,0]=4 4283 B17R2.2382 c1ccc(cc1)CSCSc2ccccc2 62a_100000211182_100011218342 [0,0,0,0,0,1|0,1,0]=2 4284 B17R2.2382 c1ccc(cc1)CSCSc2ccccc2 62a_100000719477_200011217039 [0,0,0,0,0,1|0,1,0]=2 4285 B17R2.2382 c1ccc(cc1)CSCSc2ccccc2 62a_100011218342_100015291786 [0,0,0,0,0,1|0,1,0]=2 4286 B17R2.2382 c1ccc(cc1)CSCSc2ccccc2 62a_200011217039_100000041952 [0,0,0,0,0,1|0,1,0]=2 4287 B17R2.2382 c1ccc(cc1)CSCSc2ccccn2 62a_100011216584_200011217039 [0,0,0,0,0,1|1,1,0]=3 4288 B17R2.2382 c1ccc(cc1)CSCSc2ccccn2 62a_200011217039_100011216584 [0,0,0,0,0,1|1,1,0]=3 4289 B17R2.2382 c1ccc(cc1)CSCSc2cccnc2 62a_100000210063_200011217039 [0,0,0,0,0,1|1,1,0]=3 4290 B17R2.2382 c1ccc(cc1)CSCSc2cccnc2 62a_200011217039_100000210063 [0,0,0,0,0,1|1,1,0]=3 4291 B17R2.2382 c1ccc(cc1)CSCSc2cccnn2 62a_100016991348_200011217039 [0,0,0,0,0,1|2,1,0]=4 4292 B17R2.2382 c1ccc(cc1)CSCSc2cccnn2 62a_200011217039_100016991348 [0,0,0,0,0,1|2,1,0]=4 4293 B17R2.2382 c1ccc(cc1)CSCSc2ccncc2 62a_100000728582_200011217039 [0,0,0,0,0,1|1,1,0]=3 4294 B17R2.2382 c1ccc(cc1)CSCSc2ccncc2 62a_200011217039_100000728582 [0,0,0,0,0,1|1,1,0]=3 4295 B17R2.2382 c1ccc(cc1)CSCSc2ccncn2 62a_100000703185_200011217039 [0,0,0,0,0,1|2,1,0]=4 4296 B17R2.2382 c1ccc(cc1)CSCSc2ccncn2 62a_200011217039_100000703185 [0,0,0,0,0,1|2,1,0]=4 4297 B17R2.2382 c1ccc(cc1)CSCSc2ccnnc2 62a_100000732662_200011217039 [0,0,0,0,0,1|2,1,0]=4 4298 B17R2.2382 c1ccc(cc1)CSCSc2ccnnc2 62a_200011217039_100000732662 [0,0,0,0,0,1|2,1,0]=4 4299 B17R2.2382 c1ccc(cc1)CSCSc2cnccn2 62a_100000211759_200011217039 [0,0,0,0,0,1|2,1,0]=4 4300 B17R2.2382 c1ccc(cc1)CSCSc2cnccn2 62a_200011217039_100000211759 [0,0,0,0,0,1|2,1,0]=4 4301 B17R2.2382 c1ccc(cc1)CSCSc2cncnc2 62a_100011206942_200011217039 [0,0,0,0,0,1|2,1,0]=4 4302 B17R2.2382 c1ccc(cc1)CSCSc2cncnc2 62a_200011217039_100011206942 [0,0,0,0,0,1|2,1,0]=4 4303 B17R2.2382 c1ccc(cc1)CSCSc2ncccn2 62a_100000211032_200011217039 [0,0,0,0,0,1|2,1,0]=4 4304 B17R2.2382 c1ccc(cc1)CSCSc2ncccn2 62a_200011217039_100000211032 [0,0,0,0,0,1|2,1,0]=4 4305 B17R2.2382 c1ccc(cc1)NCCOc2ccccc2 34a_100000106764_100000184471 [0,0,0,0,0,1|2,0,0]=3 4306 B17R2.2382 c1ccc(cc1)NCCSc2ccccc2 34a_100000106764_100000246102 [0,0,0,0,0,1|2,0,0]=3 4307 B17R2.2382 c1ccc(cc1)OCCOc2ccccc2 34a_100000210340_100000184471 [0,0,0,0,0,1|2,0,0]=3 4308 B17R2.2382 c1ccc(cc1)OCCOc2ccccc2 7a_100000210340_100000184471 [0,0,0,0,0,1|2,0,0]=3 4309 B17R2.2382 c1ccc(cc1)OCCOc2cccnc2 34a_100000210849_100000184471 [0,0,0,0,0,1|3,0,0]=4 4310 B17R2.2382 c1ccc(cc1)OCCOc2cccnc2 7a_100000210849_100000184471 [0,0,0,0,0,1|3,0,0]=4 4311 B17R2.2382 c1ccc(cc1)OCCOc2ccncc2 34a_100000212176_100000184471 [0,0,0,0,0,1|3,0,0]=4 4312 B17R2.2382 c1ccc(cc1)OCCSc2ccccc2 34a_100000210340_100000246102 [0,0,0,0,0,1|2,0,0]=3 4313 B17R2.2382 c1ccc(cc1)OCCSc2ccccc2 62a_100000184471_100000041952 [0,0,0,0,0,1|2,0,0]=3 4314 B17R2.2382 c1ccc(cc1)OCCSc2ccccc2 62a_100000719477_100000184471 [0,0,0,0,0,1|2,0,0]=3 4315 B17R2.2382 c1ccc(cc1)OCCSc2ccccc2 7a_100000210340_100000246102 [0,0,0,0,0,1|2,0,0]=3 4316 B17R2.2382 c1ccc(cc1)OCCSc2ccccn2 62a_100000184471_100011216584 [0,0,0,0,0,1|3,0,0]=4 4317 B17R2.2382 c1ccc(cc1)OCCSc2ccccn2 62a_100011216584_100000184471 [0,0,0,0,0,1|3,0,0]=4 4318 B17R2.2382 c1ccc(cc1)OCCSc2cccnc2 62a_100000184471_100000210063 [0,0,0,0,0,1|3,0,0]=4 4319 B17R2.2382 c1ccc(cc1)OCCSc2cccnc2 62a_100000210063_100000184471 [0,0,0,0,0,1|3,0,0]=4 4320 B17R2.2382 c1ccc(cc1)OCCSc2ccncc2 62a_100000184471_100000728582 [0,0,0,0,0,1|3,0,0]=4 4321 B17R2.2382 c1ccc(cc1)OCCSc2ccncc2 62a_100000728582_100000184471 [0,0,0,0,0,1|3,0,0]=4 4322 B17R2.2382 c1ccc(cc1)SCCOc2cccnc2 34a_100000210849_100000246102 [0,0,0,0,0,1|3,0,0]=4 4323 B17R2.2382 c1ccc(cc1)SCCOc2cccnc2 7a_100000210849_100000246102 [0,0,0,0,0,1|3,0,0]=4 4324 B17R2.2382 c1ccc(cc1)SCCOc2ccncc2 34a_100000212176_100000246102 [0,0,0,0,0,1|3,0,0]=4 4325 B17R2.2382 c1ccc(cc1)SCCSc2ccccc2 62a_100000246102_100000041952 [0,0,0,0,0,1|2,0,0]=3 4326 B17R2.2382 c1ccc(cc1)SCCSc2ccccc2 62a_100000719477_100000246102 [0,0,0,0,0,1|2,0,0]=3 4327 B17R2.2382 c1ccc(cc1)SCCSc2ccccn2 62a_100000246102_100011216584 [0,0,0,0,0,1|3,0,0]=4 4328 B17R2.2382 c1ccc(cc1)SCCSc2ccccn2 62a_100011216584_100000246102 [0,0,0,0,0,1|3,0,0]=4 4329 B17R2.2382 c1ccc(cc1)SCCSc2cccnc2 62a_100000210063_100000246102 [0,0,0,0,0,1|3,0,0]=4 4330 B17R2.2382 c1ccc(cc1)SCCSc2cccnc2 62a_100000246102_100000210063 [0,0,0,0,0,1|3,0,0]=4 4331 B17R2.2382 c1ccc(cc1)SCCSc2ccncc2 62a_100000246102_100000728582 [0,0,0,0,0,1|3,0,0]=4 4332 B17R2.2382 c1ccc(cc1)SCCSc2ccncc2 62a_100000728582_100000246102 [0,0,0,0,0,1|3,0,0]=4 4333 B17R2.2382 c1ccc(cc1)SCNCc2cccnn2 2230a_100159270163_100011218342 [0,0,0,0,0,1|3,0,0]=4 4334 B17R2.2382 c1ccc(cc1)SCNCc2cncnc2 2230a_100011243677_100011218342 [0,0,0,0,0,1|3,0,0]=4 4335 B17R2.2382 c1ccc(cc1)SCSCc2ccccn2 62a_100000721315_100011218342 [0,0,0,0,0,1|1,1,0]=3 4336 B17R2.2382 c1ccc(cc1)SCSCc2ccccn2 62a_100011218342_100000721315 [0,0,0,0,0,1|1,1,0]=3 4337 B17R2.2382 c1ccc(cc1)SCSCc2cccnc2 62a_100000741622_100011218342 [0,0,0,0,0,1|1,1,0]=3 4338 B17R2.2382 c1ccc(cc1)SCSCc2cccnc2 62a_100011218342_100000741622 [0,0,0,0,0,1|1,1,0]=3 4339 B17R2.2382 c1ccc(cc1)SCSCc2cccnn2 62a_100011218342_100016990269 [0,0,0,0,0,1|2,1,0]=4 4340 B17R2.2382 c1ccc(cc1)SCSCc2cccnn2 62a_100016990269_100011218342 [0,0,0,0,0,1|2,1,0]=4 4341 B17R2.2382 c1ccc(cc1)SCSCc2ccncc2 62a_100011218342_100015193705 [0,0,0,0,0,1|1,1,0]=3 4342 B17R2.2382 c1ccc(cc1)SCSCc2ccncc2 62a_100015193705_100011218342 [0,0,0,0,0,1|1,1,0]=3 4343 B17R2.2382 c1ccc(cc1)SCSCc2cnccn2 62a_100011218342_100016995436 [0,0,0,0,0,1|2,1,0]=4 4344 B17R2.2382 c1ccc(cc1)SCSCc2cnccn2 62a_100016995436_100011218342 [0,0,0,0,0,1|2,1,0]=4 4345 B17R2.2382 c1ccc(cc1)SCSCc2cncnc2 62a_100011218342_100015196519 [0,0,0,0,0,1|2,1,0]=4 4346 B17R2.2382 c1ccc(cc1)SCSCc2cncnc2 62a_100015196519_100011218342 [0,0,0,0,0,1|2,1,0]=4 4347 B17R2.2382 c1ccc(cc1)SCSCc2ncccn2 62a_100000703007_100011218342 [0,0,0,0,0,1|2,1,0]=4 4348 B17R2.2382 c1ccc(cc1)SCSCc2ncccn2 62a_100011218342_100000703007 [0,0,0,0,0,1|2,1,0]=4 4349 B17R2.2382 c1ccc(nc1)CCNCc2ccccn2 207a_100000211156_100000209966 [0,0,0,0,0,1|3,0,0]=4 4350 B17R2.2382 c1ccc(nc1)CCNCc2ccccn2 270004a_100000211156_100000209966 [0,0,0,0,0,1|3,0,0]=4 4351 B17R2.2382 c1ccc(nc1)CCNCc2cccnc2 207a_100000211156_100000209961 [0,0,0,0,0,1|3,0,0]=4 4352 B17R2.2382 c1ccc(nc1)CCNCc2cccnc2 270004a_100000211156_100000209961 [0,0,0,0,0,1|3,0,0]=4 4353 B17R2.2382 c1ccc(nc1)CCNCc2ccncc2 207a_100000211156_100000186114 [0,0,0,0,0,1|3,0,0]=4 4354 B17R2.2382 c1ccc(nc1)CCOCc2ccccn2 34a_100000210271_100000721315 [0,0,0,0,0,1|2,0,0]=3 4355 B17R2.2382 c1ccc(nc1)CCOCc2cccnc2 34a_100000210271_100000733263 [0,0,0,0,0,1|2,0,0]=3 4356 B17R2.2382 c1ccc(nc1)CCOCc2cccnn2 34a_100000210271_100016990269 [0,0,0,0,0,1|3,0,0]=4 4357 B17R2.2382 c1ccc(nc1)CCOCc2cnccn2 34a_100000210271_100016995436 [0,0,0,0,0,1|3,0,0]=4 4358 B17R2.2382 c1ccc(nc1)CCOCc2cncnc2 34a_100000210271_100015196519 [0,0,0,0,0,1|3,0,0]=4 4359 B17R2.2382 c1ccc(nc1)CCOCc2ncccn2 34a_100000210271_100000703007 [0,0,0,0,0,1|3,0,0]=4 4360 B17R2.2382 c1ccc(nc1)CCSCc2ccccn2 62a_100000721315_100015183660 [0,0,0,0,0,1|2,1,0]=4 4361 B17R2.2382 c1ccc(nc1)CCSCc2ccccn2 62a_100015183660_100000721315 [0,0,0,0,0,1|2,1,0]=4 4362 B17R2.2382 c1ccc(nc1)CCSCc2cccnc2 62a_100000741622_100015183660 [0,0,0,0,0,1|2,1,0]=4 4363 B17R2.2382 c1ccc(nc1)CCSCc2cccnc2 62a_100015183660_100000741622 [0,0,0,0,0,1|2,1,0]=4 4364 B17R2.2382 c1ccc(nc1)CCSCc2ccncc2 62a_100015183660_100015193705 [0,0,0,0,0,1|2,1,0]=4 4365 B17R2.2382 c1ccc(nc1)CCSCc2ccncc2 62a_100015193705_100015183660 [0,0,0,0,0,1|2,1,0]=4 4366 B17R2.2382 c1ccc(nc1)CNCCc2cccnc2 207a_100000736294_100000209966 [0,0,0,0,0,1|3,0,0]=4 4367 B17R2.2382 c1ccc(nc1)CNCCc2cccnc2 2230a_100000736294_100000721315 [0,0,0,0,0,1|3,0,0]=4 4368 B17R2.2382 c1ccc(nc1)CNCCc2cccnc2 270004a_100000736294_100000209966 [0,0,0,0,0,1|3,0,0]=4 4369 B17R2.2382 c1ccc(nc1)CNCCc2ccncc2 207a_100000742849_100000209966 [0,0,0,0,0,1|3,0,0]=4 4370 B17R2.2382 c1ccc(nc1)CNCCc2ccncc2 270004a_100000742849_100000209966 [0,0,0,0,0,1|3,0,0]=4 4371 B17R2.2382 c1ccc(nc1)COCCc2cccnc2 34a_100011217484_100000721315 [0,0,0,0,0,1|2,0,0]=3 4372 B17R2.2382 c1ccc(nc1)COCCc2ccncc2 34a_100011216225_100000721315 [0,0,0,0,0,1|2,0,0]=3 4373 B17R2.2382 c1ccc(nc1)COCCc2cnccn2 34a_100011349526_100000721315 [0,0,0,0,0,1|3,0,0]=4 4374 B17R2.2382 c1ccc(nc1)COCCc2cncnc2 34a_100011709255_100000721315 [0,0,0,0,0,1|3,0,0]=4 4375 B17R2.2382 c1ccc(nc1)CSCCc2cccnc2 62a_100000721315_200011713674 [0,0,0,0,0,1|2,1,0]=4 4376 B17R2.2382 c1ccc(nc1)CSCCc2cccnc2 62a_200011713674_100000721315 [0,0,0,0,0,1|2,1,0]=4 4377 B17R2.2382 c1ccc(nc1)CSCCc2ccncc2 62a_100000721315_100000723409 [0,0,0,0,0,1|2,1,0]=4 4378 B17R2.2382 c1ccc(nc1)CSCCc2ccncc2 62a_100000723409_100000721315 [0,0,0,0,0,1|2,1,0]=4 4379 B17R2.2382 c1cnc(nc1)COCCc2cccnc2 34a_100011217484_100000703007 [0,0,0,0,0,1|3,0,0]=4 4380 B17R2.2382 c1cnc(nc1)COCCc2ccncc2 34a_100011216225_100000703007 [0,0,0,0,0,1|3,0,0]=4 4381 B17R2.2382 c1cncc(c1)CCNCc2cccnc2 207a_100000736294_100000209961 [0,0,0,0,0,1|3,0,0]=4 4382 B17R2.2382 c1cncc(c1)CCNCc2cccnc2 2230a_100000736294_100000741622 [0,0,0,0,0,1|3,0,0]=4 4383 B17R2.2382 c1cncc(c1)CCNCc2cccnc2 270004a_100000736294_100000209961 [0,0,0,0,0,1|3,0,0]=4 4384 B17R2.2382 c1cncc(c1)CCNCc2ccncc2 207a_100000736294_100000186114 [0,0,0,0,0,1|3,0,0]=4 4385 B17R2.2382 c1cncc(c1)CCNCc2ccncc2 2230a_100000736294_100015193705 [0,0,0,0,0,1|3,0,0]=4 4386 B17R2.2382 c1cncc(c1)CCOCc2cccnc2 34a_100011217484_100000733263 [0,0,0,0,0,1|2,0,0]=3 4387 B17R2.2382 c1cncc(c1)CCOCc2cccnn2 34a_100011217484_100016990269 [0,0,0,0,0,1|3,0,0]=4 4388 B17R2.2382 c1cncc(c1)CCOCc2cnccn2 34a_100011217484_100016995436 [0,0,0,0,0,1|3,0,0]=4 4389 B17R2.2382 c1cncc(c1)CCOCc2cncnc2 34a_100011217484_100015196519 [0,0,0,0,0,1|3,0,0]=4 4390 B17R2.2382 c1cncc(c1)CCSCc2cccnc2 62a_100000741622_200011713674 [0,0,0,0,0,1|2,1,0]=4 4391 B17R2.2382 c1cncc(c1)CCSCc2cccnc2 62a_200011713674_100000741622 [0,0,0,0,0,1|2,1,0]=4 4392 B17R2.2382 c1cncc(c1)CCSCc2ccncc2 62a_100015193705_200011713674 [0,0,0,0,0,1|2,1,0]=4 4393 B17R2.2382 c1cncc(c1)CCSCc2ccncc2 62a_200011713674_100015193705 [0,0,0,0,0,1|2,1,0]=4 4394 B17R2.2382 c1cncc(c1)CNCCc2ccncc2 207a_100000742849_100000209961 [0,0,0,0,0,1|3,0,0]=4 4395 B17R2.2382 c1cncc(c1)CNCCc2ccncc2 270004a_100000742849_100000209961 [0,0,0,0,0,1|3,0,0]=4 4396 B17R2.2382 c1cncc(c1)COCCc2ccncc2 34a_100011216225_100000733263 [0,0,0,0,0,1|2,0,0]=3 4397 B17R2.2382 c1cncc(c1)COCCc2cnccn2 34a_100011349526_100000733263 [0,0,0,0,0,1|3,0,0]=4 4398 B17R2.2382 c1cncc(c1)COCCc2cncnc2 34a_100011709255_100000733263 [0,0,0,0,0,1|3,0,0]=4 4399 B17R2.2382 c1cncc(c1)CSCCc2ccncc2 62a_100000723409_100000741622 [0,0,0,0,0,1|2,1,0]=4 4400 B17R2.2382 c1cncc(c1)CSCCc2ccncc2 62a_100000741622_100000723409 [0,0,0,0,0,1|2,1,0]=4 4401 B17R2.2382 c1cnnc(c1)COCCc2ccncc2 34a_100011216225_100016990269 [0,0,0,0,0,1|3,0,0]=4 4402 B14R1.123 C/C=C/C=C/COCc1ccccc1 34a_100016283227_100015291786 [1,0,1,0,0,0|0,0,1]=3 4403 B14R1.123 C/C=C/C=C/COCc1ccccn1 34a_100016283227_100000721315 [1,0,1,0,0,0|1,0,1]=4 4404 B14R1.123 C/C=C/C=C/COCc1cccnc1 34a_100016283227_100000733263 [1,0,1,0,0,0|1,0,1]=4 4405 B14R1.520 C=CCC(=O)COCc1ccccc1 1458a_100000230186_100000210623 [1,0,1,0,0,0|1,0,1]=4 4406 B14R1.520 C=COC(=O)COCc1ccccc1 34a_100000210790_100000036128 [1,0,1,0,0,0|2,0,0]=4 4407 B16R1.643 C/C=C/C=C/COCOCc1ccccc1 34a_100016283227_100000763385 [0,1,1,0,0,0|0,0,2]=4 4408 B16R1.643 C=CCCC/C=C/COCc1ccccc1 34a_200016268473_100015291786 [0,1,1,0,0,0|0,0,2]=4 4409 B16R1.643 C=CCCC/C=C/COCc1ccccc1 7a_200016268473_100000211182 [0,1,1,0,0,0|0,0,2]=4 4410 B16R1.643 CCC/C=C/C=C/COCc1ccccc1 34a_100016294078_100015291786 [0,1,1,0,0,0|0,0,2]=4 4411 B16R1.1465 C=CC=CC(=O)CCCCc1ccccc1 1458a_100016291481_100000701786 [0,1,1,0,0,0|1,0,1]=4 4412 B16R1.1465 C=CC=CC(=O)CCOCc1ccccc1 1458a_100016291481_100000234347 [0,1,1,0,0,0|0,0,1]=3 4413 B16R1.1465 C=CC=CC(=O)CCSCc1ccccc1 1458a_100016291481_200011297719 [0,1,1,0,0,0|0,1,1]=4 4414 B16R1.1465 C=CC=CC(=O)NCCCc1ccccc1 1626a_100000211184_100016291481 [0,1,1,0,0,0|2,0,0]=4 4415 B16R1.1694 C/C=C/C=CC(=O)CCCc1ccccc1 1458a_100000185730_100000211621 [0,1,1,0,0,0|1,0,1]=4 4416 B16R1.1694 C/C=C/C=CC(=O)CSCc1ccccc1 1458a_100000185730_200011217039 [0,1,1,0,0,0|0,1,1]=4 4417 B16R1.8 C=CC=CC(=O)CCCc1ccc(cc1)Br 1458a_100016291481_100011713682 [0,1,1,0,0,0|2,0,0]=4 4418 B16R1.8 C=CC=CC(=O)CCCc1ccc(cc1)Cl 1458a_100016291481_100000759440 [0,1,1,0,0,0|2,0,0]=4 4419 B16R1.8 C=CC=CC(=O)CCCc1ccc(cc1)F 1458a_100016291481_200011713563 [0,1,1,0,0,0|2,0,0]=4 4420 B16R1.119 C=CC=CC(=O)CCCc1cccc(c1)Br 1458a_100016291481_100011713683 [0,1,1,0,0,0|2,0,0]=4 4421 B16R1.119 C=CC=CC(=O)CCCc1cccc(c1)F 1458a_100016291481_200000698031 [0,1,1,0,0,0|2,0,0]=4 4422 B16R1.700 C=CC=CC(=O)CC[C@@H](O)c1ccccc1 1458a_100016291481_100000729684 [0,1,1,0,0,0|2,0,0]=4 4423 B16R1.700 C=CC=CC(=O)COC(=O)c1ccccc1 1458a_100016291481_100000073877 [0,1,1,0,0,0|1,0,1]=4 4424 B16R1.1497 C=CC=CC(=O)CC(=O)Cc1ccccc1 1458a_100016291481_100000233483 [0,1,1,0,0,0|2,0,0]=4 4425 B16R1.4473 C=CC=CC(=O)CCCc1ccccc1Br 1458a_100016291481_200011713681 [0,1,1,0,0,0|2,0,0]=4 4426 B16R1.4640 C=CCN(CC=C)COCc1ccccc1 2230a_100000210471_100000763385 [0,1,1,0,0,0|1,0,1]=4 4427 B16R2.71 Brc1ccccc1C#Cc2ccccc2 271570a_100000069678_100000695589 [0,1,0,0,1,0|0,0,2]=4 4428 B16R2.71 Brc1ccccc1C=Cc2ccccc2 271570a_100102527694_100000695589 [0,1,0,0,1,0|0,0,2]=4 4429 B16R2.71 Brc1ccccc1CNc2ccccc2 207a_100000106764_100000211189 [0,1,0,0,1,0|1,0,0]=3 4430 B16R2.71 Brc1ccccc1CNc2ccccc2 270302a_100000106764_100000211189 [0,1,0,0,1,0|1,0,0]=3 4431 B16R2.71 Brc1ccccc1CNc2ccccc2 34a_100000106764_100000184730 [0,1,0,0,1,0|1,0,0]=3 4432 B16R2.71 Brc1ccccc1COc2ccccc2 34a_100000210340_100000184730 [0,1,0,0,1,0|0,0,0]=2 4433 B16R2.71 Brc1ccccc1COc2ccccc2 7a_100000210340_100000184730 [0,1,0,0,1,0|0,0,0]=2 4434 B16R2.71 Brc1ccccc1COc2cccnc2 34a_100000210849_100000184730 [0,1,0,0,1,0|1,0,0]=3 4435 B16R2.71 Brc1ccccc1COc2cccnc2 7a_100000210849_100000184730 [0,1,0,0,1,0|1,0,0]=3 4436 B16R2.71 Brc1ccccc1COc2ccncc2 34a_100000212176_100000184730 [0,1,0,0,1,0|1,0,0]=3 4437 B16R2.71 Brc1ccccc1COc2ccnnc2 34a_100015204005_100000184730 [0,1,0,0,1,0|2,0,0]=4 4438 B16R2.71 Brc1ccccc1COc2cncnc2 7a_100000754086_100000184730 [0,1,0,0,1,0|2,0,0]=4 4439 B16R2.71 Brc1ccccc1CSc2ccccc2 62a_100000184730_100000041952 [0,1,0,0,1,0|0,1,0]=3 4440 B16R2.71 Brc1ccccc1CSc2ccccc2 62a_100000719477_100000184730 [0,1,0,0,1,0|0,1,0]=3 4441 B16R2.71 Brc1ccccc1CSc2ccccn2 62a_100000184730_100011216584 [0,1,0,0,1,0|1,1,0]=4 4442 B16R2.71 Brc1ccccc1CSc2ccccn2 62a_100011216584_100000184730 [0,1,0,0,1,0|1,1,0]=4 4443 B16R2.71 Brc1ccccc1CSc2cccnc2 62a_100000184730_100000210063 [0,1,0,0,1,0|1,1,0]=4 4444 B16R2.71 Brc1ccccc1CSc2cccnc2 62a_100000210063_100000184730 [0,1,0,0,1,0|1,1,0]=4 4445 B16R2.71 Brc1ccccc1CSc2ccncc2 62a_100000184730_100000728582 [0,1,0,0,1,0|1,1,0]=4 4446 B16R2.71 Brc1ccccc1CSc2ccncc2 62a_100000728582_100000184730 [0,1,0,0,1,0|1,1,0]=4 4447 B16R2.71 Brc1ccccc1NCc2ccccc2 207a_100000210017_100015611070 [0,1,0,0,1,0|1,0,0]=3 4448 B16R2.71 Brc1ccccc1NCc2ccccc2 34a_100000210017_100015291786 [0,1,0,0,1,0|1,0,0]=3 4449 B16R2.71 Brc1ccccc1NCc2ccccn2 207a_100000210017_100000209966 [0,1,0,0,1,0|2,0,0]=4 4450 B16R2.71 Brc1ccccc1NCc2ccccn2 34a_100000210017_100000721315 [0,1,0,0,1,0|2,0,0]=4 4451 B16R2.71 Brc1ccccc1NCc2cccnc2 207a_100000210017_100000209961 [0,1,0,0,1,0|2,0,0]=4 4452 B16R2.71 Brc1ccccc1NCc2cccnc2 34a_100000210017_100000733263 [0,1,0,0,1,0|2,0,0]=4 4453 B16R2.71 Brc1ccccc1NCc2ccncc2 207a_100000210017_100000186114 [0,1,0,0,1,0|2,0,0]=4 4454 B16R2.71 Brc1ccccc1OCc2ccccc2 34a_100000181306_100015291786 [0,1,0,0,1,0|0,0,0]=2 4455 B16R2.71 Brc1ccccc1OCc2ccccc2 7a_100000181306_100000211182 [0,1,0,0,1,0|0,0,0]=2 4456 B16R2.71 Brc1ccccc1OCc2ccccn2 34a_100000181306_100000721315 [0,1,0,0,1,0|1,0,0]=3 4457 B16R2.71 Brc1ccccc1OCc2ccccn2 7a_100000181306_100000721315 [0,1,0,0,1,0|1,0,0]=3 4458 B16R2.71 Brc1ccccc1OCc2cccnc2 34a_100000181306_100000733263 [0,1,0,0,1,0|1,0,0]=3 4459 B16R2.71 Brc1ccccc1OCc2cccnc2 7a_100000181306_100000741622 [0,1,0,0,1,0|1,0,0]=3 4460 B16R2.71 Brc1ccccc1OCc2cccnn2 34a_100000181306_100016990269 [0,1,0,0,1,0|2,0,0]=4 4461 B16R2.71 Brc1ccccc1OCc2cccnn2 7a_100000181306_100016990269 [0,1,0,0,1,0|2,0,0]=4 4462 B16R2.71 Brc1ccccc1OCc2ccncc2 7a_100000181306_100015193705 [0,1,0,0,1,0|1,0,0]=3 4463 B16R2.71 Brc1ccccc1OCc2cnccn2 34a_100000181306_100016995436 [0,1,0,0,1,0|2,0,0]=4 4464 B16R2.71 Brc1ccccc1OCc2cnccn2 7a_100000181306_100016995436 [0,1,0,0,1,0|2,0,0]=4 4465 B16R2.71 Brc1ccccc1OCc2cncnc2 34a_100000181306_100015196519 [0,1,0,0,1,0|2,0,0]=4 4466 B16R2.71 Brc1ccccc1OCc2cncnc2 7a_100000181306_100015196519 [0,1,0,0,1,0|2,0,0]=4 4467 B16R2.71 Brc1ccccc1OCc2ncccn2 34a_100000181306_100000703007 [0,1,0,0,1,0|2,0,0]=4 4468 B16R2.71 Brc1ccccc1OCc2ncccn2 7a_100000181306_100000703007 [0,1,0,0,1,0|2,0,0]=4 4469 B16R2.71 Brc1ccccc1SCc2ccccc2 62a_100000211182_100000695589 [0,1,0,0,1,0|0,1,0]=3 4470 B16R2.71 Brc1ccccc1SCc2ccccc2 62a_100000695589_100015291786 [0,1,0,0,1,0|0,1,0]=3 4471 B16R2.71 Brc1ccccc1SCc2ccccn2 62a_100000695589_100000721315 [0,1,0,0,1,0|1,1,0]=4 4472 B16R2.71 Brc1ccccc1SCc2ccccn2 62a_100000721315_100000695589 [0,1,0,0,1,0|1,1,0]=4 4473 B16R2.71 Brc1ccccc1SCc2cccnc2 62a_100000695589_100000741622 [0,1,0,0,1,0|1,1,0]=4 4474 B16R2.71 Brc1ccccc1SCc2cccnc2 62a_100000741622_100000695589 [0,1,0,0,1,0|1,1,0]=4 4475 B16R2.71 Brc1ccccc1SCc2ccncc2 62a_100000695589_100015193705 [0,1,0,0,1,0|1,1,0]=4 4476 B16R2.71 Brc1ccccc1SCc2ccncc2 62a_100015193705_100000695589 [0,1,0,0,1,0|1,1,0]=4 4477 B16R2.71 Brc1cccnc1CNc2ccccc2 207a_100000106764_100011934733 [0,1,0,0,1,0|2,0,0]=4 4478 B16R2.71 Brc1cccnc1CNc2ccccc2 34a_100000106764_100025702911 [0,1,0,0,1,0|2,0,0]=4 4479 B16R2.71 Brc1cccnc1COc2ccccc2 34a_100000210340_100025702911 [0,1,0,0,1,0|1,0,0]=3 4480 B16R2.71 Brc1cccnc1COc2ccccc2 7a_100000210340_100025702911 [0,1,0,0,1,0|1,0,0]=3 4481 B16R2.71 Brc1cccnc1COc2cccnc2 34a_100000210849_100025702911 [0,1,0,0,1,0|2,0,0]=4 4482 B16R2.71 Brc1cccnc1COc2cccnc2 7a_100000210849_100025702911 [0,1,0,0,1,0|2,0,0]=4 4483 B16R2.71 Brc1cccnc1COc2ccncc2 34a_100000212176_100025702911 [0,1,0,0,1,0|2,0,0]=4 4484 B16R2.71 Brc1cccnc1CSc2ccccc2 62a_100000719477_100025702911 [0,1,0,0,1,0|1,1,0]=4 4485 B16R2.71 Brc1cccnc1CSc2ccccc2 62a_100025702911_100000041952 [0,1,0,0,1,0|1,1,0]=4 4486 B16R2.71 Brc1cccnc1NCc2ccccc2 27a_100015324214_100000696092 [0,1,0,0,1,0|2,0,0]=4 4487 B16R2.71 Brc1cccnc1SCc2ccccc2 62a_100000211182_100000696092 [0,1,0,0,1,0|1,1,0]=4 4488 B16R2.71 Brc1cccnc1SCc2ccccc2 62a_100000696092_100015291786 [0,1,0,0,1,0|1,1,0]=4 4489 B16R2.71 Brc1ccncc1SCc2ccccc2 62a_100000211182_100010138639 [0,1,0,0,1,0|1,1,0]=4 4490 B16R2.71 Brc1ccncc1SCc2ccccc2 62a_100010138639_100015291786 [0,1,0,0,1,0|1,1,0]=4 4491 B16R2.71 Brc1cnccc1NCc2ccccc2 27a_100015324214_100000726257 [0,1,0,0,1,0|2,0,0]=4 4492 B16R2.71 Brc1cnccc1OCc2ccccc2 34a_100011996408_100015291786 [0,1,0,0,1,0|1,0,0]=3 4493 B16R2.71 Brc1cnccc1OCc2ccccn2 34a_100011996408_100000721315 [0,1,0,0,1,0|2,0,0]=4 4494 B16R2.71 Brc1cnccc1OCc2cccnc2 34a_100011996408_100000733263 [0,1,0,0,1,0|2,0,0]=4 4495 B16R2.71 Brc1cnccc1SCc2ccccc2 62a_100000211182_100000726257 [0,1,0,0,1,0|1,1,0]=4 4496 B16R2.71 Brc1cnccc1SCc2ccccc2 62a_100000726257_100015291786 [0,1,0,0,1,0|1,1,0]=4 4497 B16R2.71 Brc1ncccc1CNc2ccccc2 34a_100000106764_100010140945 [0,1,0,0,1,0|2,0,0]=4 4498 B16R2.71 Brc1ncccc1COc2ccccc2 34a_100000210340_100010140945 [0,1,0,0,1,0|1,0,0]=3 4499 B16R2.71 Brc1ncccc1COc2ccccc2 7a_100000210340_100010140945 [0,1,0,0,1,0|1,0,0]=3 4500 B16R2.71 Brc1ncccc1COc2cccnc2 34a_100000210849_100010140945 [0,1,0,0,1,0|2,0,0]=4 4501 B16R2.71 Brc1ncccc1COc2cccnc2 7a_100000210849_100010140945 [0,1,0,0,1,0|2,0,0]=4 4502 B16R2.71 Brc1ncccc1COc2ccncc2 34a_100000212176_100010140945 [0,1,0,0,1,0|2,0,0]=4 4503 B16R2.71 Brc1ncccc1CSc2ccccc2 62a_100000719477_100010140945 [0,1,0,0,1,0|1,1,0]=4 4504 B16R2.71 Brc1ncccc1CSc2ccccc2 62a_100010140945_100000041952 [0,1,0,0,1,0|1,1,0]=4 4505 B16R2.71 Brc1ncccc1OCc2ccccc2 34a_100000744436_100015291786 [0,1,0,0,1,0|1,0,0]=3 4506 B16R2.71 Brc1ncccc1OCc2ccccc2 7a_100000744436_100000211182 [0,1,0,0,1,0|1,0,0]=3 4507 B16R2.71 Brc1ncccc1OCc2ccccn2 34a_100000744436_100000721315 [0,1,0,0,1,0|2,0,0]=4 4508 B16R2.71 Brc1ncccc1OCc2ccccn2 7a_100000744436_100000721315 [0,1,0,0,1,0|2,0,0]=4 4509 B16R2.71 Brc1ncccc1OCc2cccnc2 34a_100000744436_100000733263 [0,1,0,0,1,0|2,0,0]=4 4510 B16R2.71 Brc1ncccc1OCc2cccnc2 7a_100000744436_100000741622 [0,1,0,0,1,0|2,0,0]=4 4511 B16R2.71 Brc1ncccc1OCc2ccncc2 7a_100000744436_100015193705 [0,1,0,0,1,0|2,0,0]=4 4512 B16R2.71 Brc1ncccc1SCc2ccccc2 62a_100000211182_100010202626 [0,1,0,0,1,0|1,1,0]=4 4513 B16R2.71 Brc1ncccc1SCc2ccccc2 62a_100010202626_100015291786 [0,1,0,0,1,0|1,1,0]=4 4514 B16R2.71 C[n+]1ccccc1SCc2ccccc2 62a_100000211182_100000212160 [0,1,0,0,1,0|1,1,0]=4 4515 B16R2.71 Cc1ccccc1C#Cc2ccccc2 271570a_100000069678_100000210755 [0,1,0,0,1,0|0,0,2]=4 4516 B16R2.71 Cc1ccccc1C=Cc2ccccc2 271570a_100102527694_100000210755 [0,1,0,0,1,0|0,0,2]=4 4517 B16R2.71 Cc1ccccc1CNc2ccccc2 207a_100000106764_100000211143 [0,1,0,0,1,0|1,0,0]=3 4518 B16R2.71 Cc1ccccc1CNc2ccccc2 270302a_100000106764_100000211143 [0,1,0,0,1,0|1,0,0]=3 4519 B16R2.71 Cc1ccccc1CNc2ccccc2 34a_100000106764_100000211839 [0,1,0,0,1,0|1,0,0]=3 4520 B16R2.71 Cc1ccccc1COc2ccccc2 34a_100000210340_100000211839 [0,1,0,0,1,0|0,0,0]=2 4521 B16R2.71 Cc1ccccc1COc2ccccc2 7a_100000210340_100000211839 [0,1,0,0,1,0|0,0,0]=2 4522 B16R2.71 Cc1ccccc1COc2cccnc2 34a_100000210849_100000211839 [0,1,0,0,1,0|1,0,0]=3 4523 B16R2.71 Cc1ccccc1COc2cccnc2 7a_100000210849_100000211839 [0,1,0,0,1,0|1,0,0]=3 4524 B16R2.71 Cc1ccccc1COc2ccncc2 34a_100000212176_100000211839 [0,1,0,0,1,0|1,0,0]=3 4525 B16R2.71 Cc1ccccc1COc2ccnnc2 34a_100015204005_100000211839 [0,1,0,0,1,0|2,0,0]=4 4526 B16R2.71 Cc1ccccc1COc2cncnc2 7a_100000754086_100000211839 [0,1,0,0,1,0|2,0,0]=4 4527 B16R2.71 Cc1ccccc1CSc2ccccc2 62a_100000211839_100000041952 [0,1,0,0,1,0|0,1,0]=3 4528 B16R2.71 Cc1ccccc1CSc2ccccc2 62a_100000719477_100000211839 [0,1,0,0,1,0|0,1,0]=3 4529 B16R2.71 Cc1ccccc1CSc2ccccn2 62a_100000211839_100011216584 [0,1,0,0,1,0|1,1,0]=4 4530 B16R2.71 Cc1ccccc1CSc2ccccn2 62a_100011216584_100000211839 [0,1,0,0,1,0|1,1,0]=4 4531 B16R2.71 Cc1ccccc1CSc2cccnc2 62a_100000210063_100000211839 [0,1,0,0,1,0|1,1,0]=4 4532 B16R2.71 Cc1ccccc1CSc2cccnc2 62a_100000211839_100000210063 [0,1,0,0,1,0|1,1,0]=4 4533 B16R2.71 Cc1ccccc1CSc2ccncc2 62a_100000211839_100000728582 [0,1,0,0,1,0|1,1,0]=4 4534 B16R2.71 Cc1ccccc1CSc2ccncc2 62a_100000728582_100000211839 [0,1,0,0,1,0|1,1,0]=4 4535 B16R2.71 Cc1ccccc1NCc2ccccc2 207a_100015192222_100015611070 [0,1,0,0,1,0|1,0,0]=3 4536 B16R2.71 Cc1ccccc1NCc2ccccc2 270302a_100015192222_100015611070 [0,1,0,0,1,0|1,0,0]=3 4537 B16R2.71 Cc1ccccc1NCc2ccccc2 34a_100015192222_100015291786 [0,1,0,0,1,0|1,0,0]=3 4538 B16R2.71 Cc1ccccc1NCc2ccccn2 207a_100015192222_100000209966 [0,1,0,0,1,0|2,0,0]=4 4539 B16R2.71 Cc1ccccc1NCc2ccccn2 270302a_100015192222_100000209966 [0,1,0,0,1,0|2,0,0]=4 4540 B16R2.71 Cc1ccccc1NCc2ccccn2 34a_100015192222_100000721315 [0,1,0,0,1,0|2,0,0]=4 4541 B16R2.71 Cc1ccccc1NCc2cccnc2 207a_100015192222_100000209961 [0,1,0,0,1,0|2,0,0]=4 4542 B16R2.71 Cc1ccccc1NCc2cccnc2 270302a_100015192222_100000209961 [0,1,0,0,1,0|2,0,0]=4 4543 B16R2.71 Cc1ccccc1NCc2cccnc2 34a_100015192222_100000733263 [0,1,0,0,1,0|2,0,0]=4 4544 B16R2.71 Cc1ccccc1NCc2ccncc2 207a_100015192222_100000186114 [0,1,0,0,1,0|2,0,0]=4 4545 B16R2.71 Cc1ccccc1OCc2ccccc2 34a_100000210338_100015291786 [0,1,0,0,1,0|0,0,0]=2 4546 B16R2.71 Cc1ccccc1OCc2ccccc2 7a_100000210338_100000211182 [0,1,0,0,1,0|0,0,0]=2 4547 B16R2.71 Cc1ccccc1OCc2ccccn2 34a_100000210338_100000721315 [0,1,0,0,1,0|1,0,0]=3 4548 B16R2.71 Cc1ccccc1OCc2ccccn2 7a_100000210338_100000721315 [0,1,0,0,1,0|1,0,0]=3 4549 B16R2.71 Cc1ccccc1OCc2cccnc2 34a_100000210338_100000733263 [0,1,0,0,1,0|1,0,0]=3 4550 B16R2.71 Cc1ccccc1OCc2cccnc2 7a_100000210338_100000741622 [0,1,0,0,1,0|1,0,0]=3 4551 B16R2.71 Cc1ccccc1OCc2cccnn2 34a_100000210338_100016990269 [0,1,0,0,1,0|2,0,0]=4 4552 B16R2.71 Cc1ccccc1OCc2cccnn2 7a_100000210338_100016990269 [0,1,0,0,1,0|2,0,0]=4 4553 B16R2.71 Cc1ccccc1OCc2ccncc2 7a_100000210338_100015193705 [0,1,0,0,1,0|1,0,0]=3 4554 B16R2.71 Cc1ccccc1OCc2cnccn2 34a_100000210338_100016995436 [0,1,0,0,1,0|2,0,0]=4 4555 B16R2.71 Cc1ccccc1OCc2cnccn2 7a_100000210338_100016995436 [0,1,0,0,1,0|2,0,0]=4 4556 B16R2.71 Cc1ccccc1OCc2cncnc2 34a_100000210338_100015196519 [0,1,0,0,1,0|2,0,0]=4 4557 B16R2.71 Cc1ccccc1OCc2cncnc2 7a_100000210338_100015196519 [0,1,0,0,1,0|2,0,0]=4 4558 B16R2.71 Cc1ccccc1OCc2ncccn2 34a_100000210338_100000703007 [0,1,0,0,1,0|2,0,0]=4 4559 B16R2.71 Cc1ccccc1OCc2ncccn2 7a_100000210338_100000703007 [0,1,0,0,1,0|2,0,0]=4 4560 B16R2.71 Cc1ccccc1SCc2ccccc2 62a_100000210755_100015291786 [0,1,0,0,1,0|0,1,0]=3 4561 B16R2.71 Cc1ccccc1SCc2ccccc2 62a_100000211182_100000210755 [0,1,0,0,1,0|0,1,0]=3 4562 B16R2.71 Cc1ccccc1SCc2ccccn2 62a_100000210755_100000721315 [0,1,0,0,1,0|1,1,0]=4 4563 B16R2.71 Cc1ccccc1SCc2ccccn2 62a_100000721315_100000210755 [0,1,0,0,1,0|1,1,0]=4 4564 B16R2.71 Cc1ccccc1SCc2cccnc2 62a_100000210755_100000741622 [0,1,0,0,1,0|1,1,0]=4 4565 B16R2.71 Cc1ccccc1SCc2cccnc2 62a_100000741622_100000210755 [0,1,0,0,1,0|1,1,0]=4 4566 B16R2.71 Cc1ccccc1SCc2ccncc2 62a_100000210755_100015193705 [0,1,0,0,1,0|1,1,0]=4 4567 B16R2.71 Cc1ccccc1SCc2ccncc2 62a_100015193705_100000210755 [0,1,0,0,1,0|1,1,0]=4 4568 B16R2.71 Cc1cccnc1CNc2ccccc2 207a_100000106764_100000698913 [0,1,0,0,1,0|2,0,0]=4 4569 B16R2.71 Cc1cccnc1CNc2ccccc2 34a_100000106764_100000696600 [0,1,0,0,1,0|2,0,0]=4 4570 B16R2.71 Cc1cccnc1COc2ccccc2 34a_100000210340_100000696600 [0,1,0,0,1,0|1,0,0]=3 4571 B16R2.71 Cc1cccnc1COc2ccccc2 7a_100000210340_100000696600 [0,1,0,0,1,0|1,0,0]=3 4572 B16R2.71 Cc1cccnc1COc2cccnc2 34a_100000210849_100000696600 [0,1,0,0,1,0|2,0,0]=4 4573 B16R2.71 Cc1cccnc1COc2cccnc2 7a_100000210849_100000696600 [0,1,0,0,1,0|2,0,0]=4 4574 B16R2.71 Cc1cccnc1COc2ccncc2 34a_100000212176_100000696600 [0,1,0,0,1,0|2,0,0]=4 4575 B16R2.71 Cc1cccnc1CSc2ccccc2 62a_100000696600_100000041952 [0,1,0,0,1,0|1,1,0]=4 4576 B16R2.71 Cc1cccnc1CSc2ccccc2 62a_100000719477_100000696600 [0,1,0,0,1,0|1,1,0]=4 4577 B16R2.71 Cc1cccnc1SCc2ccccc2 62a_100000211182_100000751373 [0,1,0,0,1,0|1,1,0]=4 4578 B16R2.71 Cc1cccnc1SCc2ccccc2 62a_100000751373_100015291786 [0,1,0,0,1,0|1,1,0]=4 4579 B16R2.71 Cc1ccncc1CNc2ccccc2 207a_100000106764_100000685662 [0,1,0,0,1,0|2,0,0]=4 4580 B16R2.71 Cc1ccncc1CNc2ccccc2 34a_100000106764_100000690890 [0,1,0,0,1,0|2,0,0]=4 4581 B16R2.71 Cc1ccncc1COc2ccccc2 34a_100000210340_100000690890 [0,1,0,0,1,0|1,0,0]=3 4582 B16R2.71 Cc1ccncc1COc2ccccc2 7a_100000210340_100000690890 [0,1,0,0,1,0|1,0,0]=3 4583 B16R2.71 Cc1ccncc1COc2cccnc2 34a_100000210849_100000690890 [0,1,0,0,1,0|2,0,0]=4 4584 B16R2.71 Cc1ccncc1COc2cccnc2 7a_100000210849_100000690890 [0,1,0,0,1,0|2,0,0]=4 4585 B16R2.71 Cc1ccncc1COc2ccncc2 34a_100000212176_100000690890 [0,1,0,0,1,0|2,0,0]=4 4586 B16R2.71 Cc1ccncc1CSc2ccccc2 62a_100000690890_100000041952 [0,1,0,0,1,0|1,1,0]=4 4587 B16R2.71 Cc1ccncc1CSc2ccccc2 62a_100000719477_100000690890 [0,1,0,0,1,0|1,1,0]=4 4588 B16R2.71 Cc1ccncc1OCc2ccccc2 34a_100011997053_100015291786 [0,1,0,0,1,0|1,0,0]=3 4589 B16R2.71 Cc1ccncc1OCc2ccccc2 7a_100011997053_100000211182 [0,1,0,0,1,0|1,0,0]=3 4590 B16R2.71 Cc1ccncc1OCc2ccccn2 34a_100011997053_100000721315 [0,1,0,0,1,0|2,0,0]=4 4591 B16R2.71 Cc1ccncc1OCc2ccccn2 7a_100011997053_100000721315 [0,1,0,0,1,0|2,0,0]=4 4592 B16R2.71 Cc1ccncc1OCc2cccnc2 34a_100011997053_100000733263 [0,1,0,0,1,0|2,0,0]=4 4593 B16R2.71 Cc1ccncc1OCc2cccnc2 7a_100011997053_100000741622 [0,1,0,0,1,0|2,0,0]=4 4594 B16R2.71 Cc1ccncc1OCc2ccncc2 7a_100011997053_100015193705 [0,1,0,0,1,0|2,0,0]=4 4595 B16R2.71 Cc1ccncc1SCc2ccccc2 62a_100000211182_100000761580 [0,1,0,0,1,0|1,1,0]=4 4596 B16R2.71 Cc1ccncc1SCc2ccccc2 62a_100000761580_100015291786 [0,1,0,0,1,0|1,1,0]=4 4597 B16R2.71 Cc1cnccc1CNc2ccccc2 34a_100000106764_100020672809 [0,1,0,0,1,0|2,0,0]=4 4598 B16R2.71 Cc1cnccc1COc2ccccc2 34a_100000210340_100020672809 [0,1,0,0,1,0|1,0,0]=3 4599 B16R2.71 Cc1cnccc1COc2ccccc2 7a_100000210340_100020672808 [0,1,0,0,1,0|1,0,0]=3 4600 B16R2.71 Cc1cnccc1COc2cccnc2 34a_100000210849_100020672809 [0,1,0,0,1,0|2,0,0]=4 4601 B16R2.71 Cc1cnccc1COc2cccnc2 7a_100000210849_100020672808 [0,1,0,0,1,0|2,0,0]=4 4602 B16R2.71 Cc1cnccc1COc2ccncc2 34a_100000212176_100020672809 [0,1,0,0,1,0|2,0,0]=4 4603 B16R2.71 Cc1cnccc1CSc2ccccc2 62a_100000719477_100020672808 [0,1,0,0,1,0|1,1,0]=4 4604 B16R2.71 Cc1cnccc1CSc2ccccc2 62a_100020672808_100000041952 [0,1,0,0,1,0|1,1,0]=4 4605 B16R2.71 Cc1cnccc1NCc2ccccc2 27a_100015324214_100000765111 [0,1,0,0,1,0|2,0,0]=4 4606 B16R2.71 Cc1cnccc1OCc2ccccc2 34a_100000694293_100015291786 [0,1,0,0,1,0|1,0,0]=3 4607 B16R2.71 Cc1cnccc1OCc2ccccn2 34a_100000694293_100000721315 [0,1,0,0,1,0|2,0,0]=4 4608 B16R2.71 Cc1cnccc1OCc2cccnc2 34a_100000694293_100000733263 [0,1,0,0,1,0|2,0,0]=4 4609 B16R2.71 Cc1cnccc1SCc2ccccc2 62a_100000211182_100000765111 [0,1,0,0,1,0|1,1,0]=4 4610 B16R2.71 Cc1cnccc1SCc2ccccc2 62a_100000765111_100015291786 [0,1,0,0,1,0|1,1,0]=4 4611 B16R2.71 Cc1ncccc1CNc2ccccc2 207a_100000106764_100000751968 [0,1,0,0,1,0|2,0,0]=4 4612 B16R2.71 Cc1ncccc1CNc2ccccc2 34a_100000106764_100000732876 [0,1,0,0,1,0|2,0,0]=4 4613 B16R2.71 Cc1ncccc1COc2ccccc2 34a_100000210340_100000732876 [0,1,0,0,1,0|1,0,0]=3 4614 B16R2.71 Cc1ncccc1COc2ccccc2 7a_100000210340_100000732876 [0,1,0,0,1,0|1,0,0]=3 4615 B16R2.71 Cc1ncccc1COc2cccnc2 34a_100000210849_100000732876 [0,1,0,0,1,0|2,0,0]=4 4616 B16R2.71 Cc1ncccc1COc2cccnc2 7a_100000210849_100000732876 [0,1,0,0,1,0|2,0,0]=4 4617 B16R2.71 Cc1ncccc1COc2ccncc2 34a_100000212176_100000732876 [0,1,0,0,1,0|2,0,0]=4 4618 B16R2.71 Cc1ncccc1CSc2ccccc2 62a_100000719477_100000732876 [0,1,0,0,1,0|1,1,0]=4 4619 B16R2.71 Cc1ncccc1CSc2ccccc2 62a_100000732876_100000041952 [0,1,0,0,1,0|1,1,0]=4 4620 B16R2.71 Cc1ncccc1OCc2ccccc2 34a_100000745507_100015291786 [0,1,0,0,1,0|1,0,0]=3 4621 B16R2.71 Cc1ncccc1OCc2ccccc2 7a_100000745507_100000211182 [0,1,0,0,1,0|1,0,0]=3 4622 B16R2.71 Cc1ncccc1OCc2ccccn2 34a_100000745507_100000721315 [0,1,0,0,1,0|2,0,0]=4 4623 B16R2.71 Cc1ncccc1OCc2ccccn2 7a_100000745507_100000721315 [0,1,0,0,1,0|2,0,0]=4 4624 B16R2.71 Cc1ncccc1OCc2cccnc2 34a_100000745507_100000733263 [0,1,0,0,1,0|2,0,0]=4 4625 B16R2.71 Cc1ncccc1OCc2cccnc2 7a_100000745507_100000741622 [0,1,0,0,1,0|2,0,0]=4 4626 B16R2.71 Cc1ncccc1OCc2ccncc2 7a_100000745507_100015193705 [0,1,0,0,1,0|2,0,0]=4 4627 B16R2.71 Cc1ncccc1SCc2ccccc2 62a_100000211182_100000751574 [0,1,0,0,1,0|1,1,0]=4 4628 B16R2.71 Cc1ncccc1SCc2ccccc2 62a_100000751574_100015291786 [0,1,0,0,1,0|1,1,0]=4 4629 B16R2.71 Cc1nccnc1OCc2ccccc2 34a_100000766352_100015291786 [0,1,0,0,1,0|2,0,0]=4 4630 B16R2.71 Clc1ccccc1C#Cc2ccccc2 271570a_100000069678_100000764095 [0,1,0,0,1,0|0,0,2]=4 4631 B16R2.71 Clc1ccccc1C=Cc2ccccc2 271570a_100102527694_100000764095 [0,1,0,0,1,0|0,0,2]=4 4632 B16R2.71 Clc1ccccc1CNc2ccccc2 207a_100000106764_100000210073 [0,1,0,0,1,0|1,0,0]=3 4633 B16R2.71 Clc1ccccc1CNc2ccccc2 270302a_100000106764_100000210073 [0,1,0,0,1,0|1,0,0]=3 4634 B16R2.71 Clc1ccccc1CNc2ccccc2 34a_100000106764_100000187162 [0,1,0,0,1,0|1,0,0]=3 4635 B16R2.71 Clc1ccccc1COc2ccccc2 34a_100000210340_100000187162 [0,1,0,0,1,0|0,0,0]=2 4636 B16R2.71 Clc1ccccc1COc2ccccc2 7a_100000210340_100000187162 [0,1,0,0,1,0|0,0,0]=2 4637 B16R2.71 Clc1ccccc1COc2cccnc2 34a_100000210849_100000187162 [0,1,0,0,1,0|1,0,0]=3 4638 B16R2.71 Clc1ccccc1COc2cccnc2 7a_100000210849_100000187162 [0,1,0,0,1,0|1,0,0]=3 4639 B16R2.71 Clc1ccccc1COc2ccncc2 34a_100000212176_100000187162 [0,1,0,0,1,0|1,0,0]=3 4640 B16R2.71 Clc1ccccc1COc2ccnnc2 34a_100015204005_100000187162 [0,1,0,0,1,0|2,0,0]=4 4641 B16R2.71 Clc1ccccc1COc2cncnc2 7a_100000754086_100000187162 [0,1,0,0,1,0|2,0,0]=4 4642 B16R2.71 Clc1ccccc1CSc2ccccc2 62a_100000187162_100000041952 [0,1,0,0,1,0|0,1,0]=3 4643 B16R2.71 Clc1ccccc1CSc2ccccc2 62a_100000719477_100000187162 [0,1,0,0,1,0|0,1,0]=3 4644 B16R2.71 Clc1ccccc1CSc2ccccn2 62a_100000187162_100011216584 [0,1,0,0,1,0|1,1,0]=4 4645 B16R2.71 Clc1ccccc1CSc2ccccn2 62a_100011216584_100000187162 [0,1,0,0,1,0|1,1,0]=4 4646 B16R2.71 Clc1ccccc1CSc2cccnc2 62a_100000187162_100000210063 [0,1,0,0,1,0|1,1,0]=4 4647 B16R2.71 Clc1ccccc1CSc2cccnc2 62a_100000210063_100000187162 [0,1,0,0,1,0|1,1,0]=4 4648 B16R2.71 Clc1ccccc1CSc2ccncc2 62a_100000187162_100000728582 [0,1,0,0,1,0|1,1,0]=4 4649 B16R2.71 Clc1ccccc1CSc2ccncc2 62a_100000728582_100000187162 [0,1,0,0,1,0|1,1,0]=4 4650 B16R2.71 Clc1ccccc1NCc2ccccc2 207a_100000185783_100015611070 [0,1,0,0,1,0|1,0,0]=3 4651 B16R2.71 Clc1ccccc1NCc2ccccc2 34a_100000185783_100015291786 [0,1,0,0,1,0|1,0,0]=3 4652 B16R2.71 Clc1ccccc1NCc2ccccn2 207a_100000185783_100000209966 [0,1,0,0,1,0|2,0,0]=4 4653 B16R2.71 Clc1ccccc1NCc2ccccn2 34a_100000185783_100000721315 [0,1,0,0,1,0|2,0,0]=4 4654 B16R2.71 Clc1ccccc1NCc2cccnc2 207a_100000185783_100000209961 [0,1,0,0,1,0|2,0,0]=4 4655 B16R2.71 Clc1ccccc1NCc2cccnc2 34a_100000185783_100000733263 [0,1,0,0,1,0|2,0,0]=4 4656 B16R2.71 Clc1ccccc1NCc2ccncc2 207a_100000185783_100000186114 [0,1,0,0,1,0|2,0,0]=4 4657 B16R2.71 Clc1ccccc1OCc2ccccc2 34a_100000210172_100015291786 [0,1,0,0,1,0|0,0,0]=2 4658 B16R2.71 Clc1ccccc1OCc2ccccc2 7a_100000210172_100000211182 [0,1,0,0,1,0|0,0,0]=2 4659 B16R2.71 Clc1ccccc1OCc2ccccn2 34a_100000210172_100000721315 [0,1,0,0,1,0|1,0,0]=3 4660 B16R2.71 Clc1ccccc1OCc2ccccn2 7a_100000210172_100000721315 [0,1,0,0,1,0|1,0,0]=3 4661 B16R2.71 Clc1ccccc1OCc2cccnc2 34a_100000210172_100000733263 [0,1,0,0,1,0|1,0,0]=3 4662 B16R2.71 Clc1ccccc1OCc2cccnc2 7a_100000210172_100000741622 [0,1,0,0,1,0|1,0,0]=3 4663 B16R2.71 Clc1ccccc1OCc2cccnn2 34a_100000210172_100016990269 [0,1,0,0,1,0|2,0,0]=4 4664 B16R2.71 Clc1ccccc1OCc2cccnn2 7a_100000210172_100016990269 [0,1,0,0,1,0|2,0,0]=4 4665 B16R2.71 Clc1ccccc1OCc2ccncc2 7a_100000210172_100015193705 [0,1,0,0,1,0|1,0,0]=3 4666 B16R2.71 Clc1ccccc1OCc2cnccn2 34a_100000210172_100016995436 [0,1,0,0,1,0|2,0,0]=4 4667 B16R2.71 Clc1ccccc1OCc2cnccn2 7a_100000210172_100016995436 [0,1,0,0,1,0|2,0,0]=4 4668 B16R2.71 Clc1ccccc1OCc2cncnc2 34a_100000210172_100015196519 [0,1,0,0,1,0|2,0,0]=4 4669 B16R2.71 Clc1ccccc1OCc2cncnc2 7a_100000210172_100015196519 [0,1,0,0,1,0|2,0,0]=4 4670 B16R2.71 Clc1ccccc1OCc2ncccn2 34a_100000210172_100000703007 [0,1,0,0,1,0|2,0,0]=4 4671 B16R2.71 Clc1ccccc1OCc2ncccn2 7a_100000210172_100000703007 [0,1,0,0,1,0|2,0,0]=4 4672 B16R2.71 Clc1ccccc1SCc2ccccc2 62a_100000211182_100000764095 [0,1,0,0,1,0|0,1,0]=3 4673 B16R2.71 Clc1ccccc1SCc2ccccc2 62a_100000764095_100015291786 [0,1,0,0,1,0|0,1,0]=3 4674 B16R2.71 Clc1ccccc1SCc2ccccn2 62a_100000721315_100000764095 [0,1,0,0,1,0|1,1,0]=4 4675 B16R2.71 Clc1ccccc1SCc2ccccn2 62a_100000764095_100000721315 [0,1,0,0,1,0|1,1,0]=4 4676 B16R2.71 Clc1ccccc1SCc2cccnc2 62a_100000741622_100000764095 [0,1,0,0,1,0|1,1,0]=4 4677 B16R2.71 Clc1ccccc1SCc2cccnc2 62a_100000764095_100000741622 [0,1,0,0,1,0|1,1,0]=4 4678 B16R2.71 Clc1ccccc1SCc2ccncc2 62a_100000764095_100015193705 [0,1,0,0,1,0|1,1,0]=4 4679 B16R2.71 Clc1ccccc1SCc2ccncc2 62a_100015193705_100000764095 [0,1,0,0,1,0|1,1,0]=4 4680 B16R2.71 Clc1cccnc1CNc2ccccc2 207a_100000106764_100012001307 [0,1,0,0,1,0|2,0,0]=4 4681 B16R2.71 Clc1cccnc1COc2ccccc2 7a_100000210340_100000099807 [0,1,0,0,1,0|1,0,0]=3 4682 B16R2.71 Clc1cccnc1COc2cccnc2 7a_100000210849_100000099807 [0,1,0,0,1,0|2,0,0]=4 4683 B16R2.71 Clc1cccnc1CSc2ccccc2 62a_100000099807_100000041952 [0,1,0,0,1,0|1,1,0]=4 4684 B16R2.71 Clc1cccnc1CSc2ccccc2 62a_100000719477_100000099807 [0,1,0,0,1,0|1,1,0]=4 4685 B16R2.71 Clc1cccnc1OCc2ccccc2 34a_100011290957_100015291786 [0,1,0,0,1,0|1,0,0]=3 4686 B16R2.71 Clc1cccnc1OCc2ccccn2 34a_100011290957_100000721315 [0,1,0,0,1,0|2,0,0]=4 4687 B16R2.71 Clc1cccnc1OCc2cccnc2 34a_100011290957_100000733263 [0,1,0,0,1,0|2,0,0]=4 4688 B16R2.71 Clc1cccnc1SCc2ccccc2 62a_100000211182_100011356963 [0,1,0,0,1,0|1,1,0]=4 4689 B16R2.71 Clc1cccnc1SCc2ccccc2 62a_100011356963_100015291786 [0,1,0,0,1,0|1,1,0]=4 4690 B16R2.71 Clc1ccncc1OCc2ccccc2 34a_100011996695_100015291786 [0,1,0,0,1,0|1,0,0]=3 4691 B16R2.71 Clc1ccncc1OCc2ccccn2 34a_100011996695_100000721315 [0,1,0,0,1,0|2,0,0]=4 4692 B16R2.71 Clc1ccncc1OCc2cccnc2 34a_100011996695_100000733263 [0,1,0,0,1,0|2,0,0]=4 4693 B16R2.71 Clc1ccncc1SCc2ccccc2 62a_100000211182_100009995489 [0,1,0,0,1,0|1,1,0]=4 4694 B16R2.71 Clc1ccncc1SCc2ccccc2 62a_100009995489_100015291786 [0,1,0,0,1,0|1,1,0]=4 4695 B16R2.71 Clc1cnccc1CNc2ccccc2 207a_100000106764_100011934409 [0,1,0,0,1,0|2,0,0]=4 4696 B16R2.71 Clc1cnccc1COc2ccccc2 7a_100000210340_100000763264 [0,1,0,0,1,0|1,0,0]=3 4697 B16R2.71 Clc1cnccc1COc2cccnc2 7a_100000210849_100000763264 [0,1,0,0,1,0|2,0,0]=4 4698 B16R2.71 Clc1cnccc1CSc2ccccc2 62a_100000719477_100000763264 [0,1,0,0,1,0|1,1,0]=4 4699 B16R2.71 Clc1cnccc1CSc2ccccc2 62a_100000763264_100000041952 [0,1,0,0,1,0|1,1,0]=4 4700 B16R2.71 Clc1cnccc1OCc2ccccc2 34a_100011997054_100015291786 [0,1,0,0,1,0|1,0,0]=3 4701 B16R2.71 Clc1cnccc1OCc2ccccn2 34a_100011997054_100000721315 [0,1,0,0,1,0|2,0,0]=4 4702 B16R2.71 Clc1cnccc1OCc2cccnc2 34a_100011997054_100000733263 [0,1,0,0,1,0|2,0,0]=4 4703 B16R2.71 Clc1cnccc1SCc2ccccc2 62a_100000211182_100000708259 [0,1,0,0,1,0|1,1,0]=4 4704 B16R2.71 Clc1cnccc1SCc2ccccc2 62a_100000708259_100015291786 [0,1,0,0,1,0|1,1,0]=4 4705 B16R2.71 Clc1ncccc1CNc2ccccc2 34a_100000106764_100000045678 [0,1,0,0,1,0|2,0,0]=4 4706 B16R2.71 Clc1ncccc1COc2ccccc2 34a_100000210340_100000045678 [0,1,0,0,1,0|1,0,0]=3 4707 B16R2.71 Clc1ncccc1COc2ccccc2 7a_100000210340_100000045678 [0,1,0,0,1,0|1,0,0]=3 4708 B16R2.71 Clc1ncccc1COc2cccnc2 34a_100000210849_100000045678 [0,1,0,0,1,0|2,0,0]=4 4709 B16R2.71 Clc1ncccc1COc2cccnc2 7a_100000210849_100000045678 [0,1,0,0,1,0|2,0,0]=4 4710 B16R2.71 Clc1ncccc1COc2ccncc2 34a_100000212176_100000045678 [0,1,0,0,1,0|2,0,0]=4 4711 B16R2.71 Clc1ncccc1CSc2ccccc2 62a_100000045678_100000041952 [0,1,0,0,1,0|1,1,0]=4 4712 B16R2.71 Clc1ncccc1CSc2ccccc2 62a_100000719477_100000045678 [0,1,0,0,1,0|1,1,0]=4 4713 B16R2.71 Clc1ncccc1OCc2ccccc2 34a_100000757616_100015291786 [0,1,0,0,1,0|1,0,0]=3 4714 B16R2.71 Clc1ncccc1OCc2ccccc2 7a_100000757616_100000211182 [0,1,0,0,1,0|1,0,0]=3 4715 B16R2.71 Clc1ncccc1OCc2ccccn2 34a_100000757616_100000721315 [0,1,0,0,1,0|2,0,0]=4 4716 B16R2.71 Clc1ncccc1OCc2ccccn2 7a_100000757616_100000721315 [0,1,0,0,1,0|2,0,0]=4 4717 B16R2.71 Clc1ncccc1OCc2cccnc2 34a_100000757616_100000733263 [0,1,0,0,1,0|2,0,0]=4 4718 B16R2.71 Clc1ncccc1OCc2cccnc2 7a_100000757616_100000741622 [0,1,0,0,1,0|2,0,0]=4 4719 B16R2.71 Clc1ncccc1OCc2ccncc2 7a_100000757616_100015193705 [0,1,0,0,1,0|2,0,0]=4 4720 B16R2.71 Clc1ncccc1SCc2ccccc2 62a_100000036424_100015291786 [0,1,0,0,1,0|1,1,0]=4 4721 B16R2.71 Clc1ncccc1SCc2ccccc2 62a_100000211182_100000036424 [0,1,0,0,1,0|1,1,0]=4 4722 B16R2.71 Fc1ccccc1C#Cc2ccccc2 271570a_100000069678_100011215700 [0,1,0,0,1,0|0,0,2]=4 4723 B16R2.71 Fc1ccccc1C=Cc2ccccc2 271570a_100102527694_100011215700 [0,1,0,0,1,0|0,0,2]=4 4724 B16R2.71 Fc1ccccc1C=Cc2ccccc2 271570a_200102527919_100000210277 [0,1,0,0,1,0|0,0,2]=4 4725 B16R2.71 Fc1ccccc1CNc2ccccc2 207a_100000106764_100000210811 [0,1,0,0,1,0|1,0,0]=3 4726 B16R2.71 Fc1ccccc1CNc2ccccc2 270302a_100000106764_100000210811 [0,1,0,0,1,0|1,0,0]=3 4727 B16R2.71 Fc1ccccc1CNc2ccccc2 34a_100000106764_100000211605 [0,1,0,0,1,0|1,0,0]=3 4728 B16R2.71 Fc1ccccc1COc2ccccc2 34a_100000210340_100000211605 [0,1,0,0,1,0|0,0,0]=2 4729 B16R2.71 Fc1ccccc1COc2ccccc2 7a_100000210340_100000211605 [0,1,0,0,1,0|0,0,0]=2 4730 B16R2.71 Fc1ccccc1COc2cccnc2 34a_100000210849_100000211605 [0,1,0,0,1,0|1,0,0]=3 4731 B16R2.71 Fc1ccccc1COc2cccnc2 7a_100000210849_100000211605 [0,1,0,0,1,0|1,0,0]=3 4732 B16R2.71 Fc1ccccc1COc2ccncc2 34a_100000212176_100000211605 [0,1,0,0,1,0|1,0,0]=3 4733 B16R2.71 Fc1ccccc1COc2ccnnc2 34a_100015204005_100000211605 [0,1,0,0,1,0|2,0,0]=4 4734 B16R2.71 Fc1ccccc1COc2cncnc2 7a_100000754086_100000211605 [0,1,0,0,1,0|2,0,0]=4 4735 B16R2.71 Fc1ccccc1CSc2ccccc2 62a_100000211605_100000041952 [0,1,0,0,1,0|0,1,0]=3 4736 B16R2.71 Fc1ccccc1CSc2ccccc2 62a_100000719477_100000211605 [0,1,0,0,1,0|0,1,0]=3 4737 B16R2.71 Fc1ccccc1CSc2ccccn2 62a_100000211605_100011216584 [0,1,0,0,1,0|1,1,0]=4 4738 B16R2.71 Fc1ccccc1CSc2ccccn2 62a_100011216584_100000211605 [0,1,0,0,1,0|1,1,0]=4 4739 B16R2.71 Fc1ccccc1CSc2cccnc2 62a_100000210063_100000211605 [0,1,0,0,1,0|1,1,0]=4 4740 B16R2.71 Fc1ccccc1CSc2cccnc2 62a_100000211605_100000210063 [0,1,0,0,1,0|1,1,0]=4 4741 B16R2.71 Fc1ccccc1CSc2ccncc2 62a_100000211605_100000728582 [0,1,0,0,1,0|1,1,0]=4 4742 B16R2.71 Fc1ccccc1CSc2ccncc2 62a_100000728582_100000211605 [0,1,0,0,1,0|1,1,0]=4 4743 B16R2.71 Fc1ccccc1NCc2ccccc2 207a_100000210422_100015611070 [0,1,0,0,1,0|1,0,0]=3 4744 B16R2.71 Fc1ccccc1NCc2ccccc2 34a_100000210422_100015291786 [0,1,0,0,1,0|1,0,0]=3 4745 B16R2.71 Fc1ccccc1NCc2ccccn2 207a_100000210422_100000209966 [0,1,0,0,1,0|2,0,0]=4 4746 B16R2.71 Fc1ccccc1NCc2ccccn2 34a_100000210422_100000721315 [0,1,0,0,1,0|2,0,0]=4 4747 B16R2.71 Fc1ccccc1NCc2cccnc2 207a_100000210422_100000209961 [0,1,0,0,1,0|2,0,0]=4 4748 B16R2.71 Fc1ccccc1NCc2cccnc2 34a_100000210422_100000733263 [0,1,0,0,1,0|2,0,0]=4 4749 B16R2.71 Fc1ccccc1NCc2ccncc2 207a_100000210422_100000186114 [0,1,0,0,1,0|2,0,0]=4 4750 B16R2.71 Fc1ccccc1OCc2ccccc2 34a_100000210171_100015291786 [0,1,0,0,1,0|0,0,0]=2 4751 B16R2.71 Fc1ccccc1OCc2ccccc2 7a_100000210171_100000211182 [0,1,0,0,1,0|0,0,0]=2 4752 B16R2.71 Fc1ccccc1OCc2ccccn2 34a_100000210171_100000721315 [0,1,0,0,1,0|1,0,0]=3 4753 B16R2.71 Fc1ccccc1OCc2ccccn2 7a_100000210171_100000721315 [0,1,0,0,1,0|1,0,0]=3 4754 B16R2.71 Fc1ccccc1OCc2cccnc2 34a_100000210171_100000733263 [0,1,0,0,1,0|1,0,0]=3 4755 B16R2.71 Fc1ccccc1OCc2cccnc2 7a_100000210171_100000741622 [0,1,0,0,1,0|1,0,0]=3 4756 B16R2.71 Fc1ccccc1OCc2cccnn2 34a_100000210171_100016990269 [0,1,0,0,1,0|2,0,0]=4 4757 B16R2.71 Fc1ccccc1OCc2cccnn2 7a_100000210171_100016990269 [0,1,0,0,1,0|2,0,0]=4 4758 B16R2.71 Fc1ccccc1OCc2ccncc2 7a_100000210171_100015193705 [0,1,0,0,1,0|1,0,0]=3 4759 B16R2.71 Fc1ccccc1OCc2cnccn2 34a_100000210171_100016995436 [0,1,0,0,1,0|2,0,0]=4 4760 B16R2.71 Fc1ccccc1OCc2cnccn2 7a_100000210171_100016995436 [0,1,0,0,1,0|2,0,0]=4 4761 B16R2.71 Fc1ccccc1OCc2cncnc2 34a_100000210171_100015196519 [0,1,0,0,1,0|2,0,0]=4 4762 B16R2.71 Fc1ccccc1OCc2cncnc2 7a_100000210171_100015196519 [0,1,0,0,1,0|2,0,0]=4 4763 B16R2.71 Fc1ccccc1OCc2ncccn2 34a_100000210171_100000703007 [0,1,0,0,1,0|2,0,0]=4 4764 B16R2.71 Fc1ccccc1OCc2ncccn2 7a_100000210171_100000703007 [0,1,0,0,1,0|2,0,0]=4 4765 B16R2.71 Fc1ccccc1SCc2ccccc2 62a_100000211182_100011215700 [0,1,0,0,1,0|0,1,0]=3 4766 B16R2.71 Fc1ccccc1SCc2ccccc2 62a_100011215700_100015291786 [0,1,0,0,1,0|0,1,0]=3 4767 B16R2.71 Fc1ccccc1SCc2ccccn2 62a_100000721315_100011215700 [0,1,0,0,1,0|1,1,0]=4 4768 B16R2.71 Fc1ccccc1SCc2ccccn2 62a_100011215700_100000721315 [0,1,0,0,1,0|1,1,0]=4 4769 B16R2.71 Fc1ccccc1SCc2cccnc2 62a_100000741622_100011215700 [0,1,0,0,1,0|1,1,0]=4 4770 B16R2.71 Fc1ccccc1SCc2cccnc2 62a_100011215700_100000741622 [0,1,0,0,1,0|1,1,0]=4 4771 B16R2.71 Fc1ccccc1SCc2ccncc2 62a_100011215700_100015193705 [0,1,0,0,1,0|1,1,0]=4 4772 B16R2.71 Fc1ccccc1SCc2ccncc2 62a_100015193705_100011215700 [0,1,0,0,1,0|1,1,0]=4 4773 B16R2.71 Fc1cccnc1CNc2ccccc2 207a_100000106764_100011934734 [0,1,0,0,1,0|2,0,0]=4 4774 B16R2.71 Fc1cccnc1CNc2ccccc2 34a_100000106764_100000104219 [0,1,0,0,1,0|2,0,0]=4 4775 B16R2.71 Fc1cccnc1COc2ccccc2 34a_100000210340_100000104219 [0,1,0,0,1,0|1,0,0]=3 4776 B16R2.71 Fc1cccnc1COc2ccccc2 7a_100000210340_100000104219 [0,1,0,0,1,0|1,0,0]=3 4777 B16R2.71 Fc1cccnc1COc2cccnc2 34a_100000210849_100000104219 [0,1,0,0,1,0|2,0,0]=4 4778 B16R2.71 Fc1cccnc1COc2cccnc2 7a_100000210849_100000104219 [0,1,0,0,1,0|2,0,0]=4 4779 B16R2.71 Fc1cccnc1COc2ccncc2 34a_100000212176_100000104219 [0,1,0,0,1,0|2,0,0]=4 4780 B16R2.71 Fc1cccnc1CSc2ccccc2 62a_100000104219_100000041952 [0,1,0,0,1,0|1,1,0]=4 4781 B16R2.71 Fc1cccnc1CSc2ccccc2 62a_100000719477_100000104219 [0,1,0,0,1,0|1,1,0]=4 4782 B16R2.71 Fc1cccnc1OCc2ccccc2 34a_100011219419_100015291786 [0,1,0,0,1,0|1,0,0]=3 4783 B16R2.71 Fc1cccnc1OCc2ccccn2 34a_100011219419_100000721315 [0,1,0,0,1,0|2,0,0]=4 4784 B16R2.71 Fc1cccnc1OCc2cccnc2 34a_100011219419_100000733263 [0,1,0,0,1,0|2,0,0]=4 4785 B16R2.71 Fc1cccnc1SCc2ccccc2 62a_100000211182_100000685392 [0,1,0,0,1,0|1,1,0]=4 4786 B16R2.71 Fc1cccnc1SCc2ccccc2 62a_100000685392_100015291786 [0,1,0,0,1,0|1,1,0]=4 4787 B16R2.71 Fc1ccncc1SCc2ccccc2 62a_100000211182_100009820683 [0,1,0,0,1,0|1,1,0]=4 4788 B16R2.71 Fc1ccncc1SCc2ccccc2 62a_100009820683_100015291786 [0,1,0,0,1,0|1,1,0]=4 4789 B16R2.71 Fc1cnccc1NCc2ccccc2 27a_100015324214_100000035921 [0,1,0,0,1,0|2,0,0]=4 4790 B16R2.71 Fc1cnccc1OCc2ccccc2 34a_200000081243_100015291786 [0,1,0,0,1,0|1,0,0]=3 4791 B16R2.71 Fc1cnccc1OCc2ccccn2 34a_200000081243_100000721315 [0,1,0,0,1,0|2,0,0]=4 4792 B16R2.71 Fc1cnccc1OCc2cccnc2 34a_200000081243_100000733263 [0,1,0,0,1,0|2,0,0]=4 4793 B16R2.71 Fc1cnccc1SCc2ccccc2 62a_100000047030_100015291786 [0,1,0,0,1,0|1,1,0]=4 4794 B16R2.71 Fc1cnccc1SCc2ccccc2 62a_100000211182_100000047030 [0,1,0,0,1,0|1,1,0]=4 4795 B16R2.71 Fc1ncccc1CNc2ccccc2 34a_100000106764_100000099810 [0,1,0,0,1,0|2,0,0]=4 4796 B16R2.71 Fc1ncccc1COc2ccccc2 34a_100000210340_100000099810 [0,1,0,0,1,0|1,0,0]=3 4797 B16R2.71 Fc1ncccc1COc2ccccc2 7a_100000210340_100000099810 [0,1,0,0,1,0|1,0,0]=3 4798 B16R2.71 Fc1ncccc1COc2cccnc2 34a_100000210849_100000099810 [0,1,0,0,1,0|2,0,0]=4 4799 B16R2.71 Fc1ncccc1COc2cccnc2 7a_100000210849_100000099810 [0,1,0,0,1,0|2,0,0]=4 4800 B16R2.71 Fc1ncccc1COc2ccncc2 34a_100000212176_100000099810 [0,1,0,0,1,0|2,0,0]=4 4801 B16R2.71 Fc1ncccc1CSc2ccccc2 62a_100000099810_100000041952 [0,1,0,0,1,0|1,1,0]=4 4802 B16R2.71 Fc1ncccc1CSc2ccccc2 62a_100000719477_100000099810 [0,1,0,0,1,0|1,1,0]=4 4803 B16R2.71 Fc1ncccc1OCc2ccccc2 34a_100000061740_100015291786 [0,1,0,0,1,0|1,0,0]=3 4804 B16R2.71 Fc1ncccc1OCc2ccccc2 7a_100000061740_100000211182 [0,1,0,0,1,0|1,0,0]=3 4805 B16R2.71 Fc1ncccc1OCc2ccccn2 34a_100000061740_100000721315 [0,1,0,0,1,0|2,0,0]=4 4806 B16R2.71 Fc1ncccc1OCc2ccccn2 7a_100000061740_100000721315 [0,1,0,0,1,0|2,0,0]=4 4807 B16R2.71 Fc1ncccc1OCc2cccnc2 34a_100000061740_100000733263 [0,1,0,0,1,0|2,0,0]=4 4808 B16R2.71 Fc1ncccc1OCc2cccnc2 7a_100000061740_100000741622 [0,1,0,0,1,0|2,0,0]=4 4809 B16R2.71 Fc1ncccc1OCc2ccncc2 7a_100000061740_100015193705 [0,1,0,0,1,0|2,0,0]=4 4810 B16R2.71 Fc1ncccc1SCc2ccccc2 62a_100000211182_100009816115 [0,1,0,0,1,0|1,1,0]=4 4811 B16R2.71 Fc1ncccc1SCc2ccccc2 62a_100009816115_100015291786 [0,1,0,0,1,0|1,1,0]=4 4812 B16R2.71 Ic1ccccc1CNc2ccccc2 207a_100000106764_100000010305 [0,1,0,0,1,0|1,0,0]=3 4813 B16R2.71 Ic1ccccc1CNc2ccccc2 34a_100000106764_100011215278 [0,1,0,0,1,0|1,0,0]=3 4814 B16R2.71 Ic1ccccc1COc2ccccc2 34a_100000210340_100011215278 [0,1,0,0,1,0|0,0,0]=2 4815 B16R2.71 Ic1ccccc1COc2ccccc2 7a_100000210340_100011215278 [0,1,0,0,1,0|0,0,0]=2 4816 B16R2.71 Ic1ccccc1COc2cccnc2 34a_100000210849_100011215278 [0,1,0,0,1,0|1,0,0]=3 4817 B16R2.71 Ic1ccccc1COc2cccnc2 7a_100000210849_100011215278 [0,1,0,0,1,0|1,0,0]=3 4818 B16R2.71 Ic1ccccc1COc2ccncc2 34a_100000212176_100011215278 [0,1,0,0,1,0|1,0,0]=3 4819 B16R2.71 Ic1ccccc1COc2ccnnc2 34a_100015204005_100011215278 [0,1,0,0,1,0|2,0,0]=4 4820 B16R2.71 Ic1ccccc1COc2cncnc2 7a_100000754086_100011215278 [0,1,0,0,1,0|2,0,0]=4 4821 B16R2.71 Ic1ccccc1CSc2ccccc2 62a_100000719477_100011216222 [0,1,0,0,1,0|0,1,0]=3 4822 B16R2.71 Ic1ccccc1CSc2ccccc2 62a_100011216222_100000041952 [0,1,0,0,1,0|0,1,0]=3 4823 B16R2.71 Ic1ccccc1CSc2ccccn2 62a_100011216222_100011216584 [0,1,0,0,1,0|1,1,0]=4 4824 B16R2.71 Ic1ccccc1CSc2ccccn2 62a_100011216584_100011216222 [0,1,0,0,1,0|1,1,0]=4 4825 B16R2.71 Ic1ccccc1CSc2cccnc2 62a_100000210063_100011216222 [0,1,0,0,1,0|1,1,0]=4 4826 B16R2.71 Ic1ccccc1CSc2cccnc2 62a_100011216222_100000210063 [0,1,0,0,1,0|1,1,0]=4 4827 B16R2.71 Ic1ccccc1CSc2ccncc2 62a_100000728582_100011216222 [0,1,0,0,1,0|1,1,0]=4 4828 B16R2.71 Ic1ccccc1CSc2ccncc2 62a_100011216222_100000728582 [0,1,0,0,1,0|1,1,0]=4 4829 B16R2.71 Ic1ccccc1NCc2ccccc2 207a_100000210053_100015611070 [0,1,0,0,1,0|1,0,0]=3 4830 B16R2.71 Ic1ccccc1NCc2ccccc2 34a_100000210053_100015291786 [0,1,0,0,1,0|1,0,0]=3 4831 B16R2.71 Ic1ccccc1NCc2ccccn2 207a_100000210053_100000209966 [0,1,0,0,1,0|2,0,0]=4 4832 B16R2.71 Ic1ccccc1NCc2ccccn2 34a_100000210053_100000721315 [0,1,0,0,1,0|2,0,0]=4 4833 B16R2.71 Ic1ccccc1NCc2cccnc2 207a_100000210053_100000209961 [0,1,0,0,1,0|2,0,0]=4 4834 B16R2.71 Ic1ccccc1NCc2cccnc2 34a_100000210053_100000733263 [0,1,0,0,1,0|2,0,0]=4 4835 B16R2.71 Ic1ccccc1NCc2ccncc2 207a_100000210053_100000186114 [0,1,0,0,1,0|2,0,0]=4 4836 B16R2.71 Ic1ccccc1OCc2ccccc2 34a_100000739446_100015291786 [0,1,0,0,1,0|0,0,0]=2 4837 B16R2.71 Ic1ccccc1OCc2ccccc2 7a_100000739446_100000211182 [0,1,0,0,1,0|0,0,0]=2 4838 B16R2.71 Ic1ccccc1OCc2ccccn2 34a_100000739446_100000721315 [0,1,0,0,1,0|1,0,0]=3 4839 B16R2.71 Ic1ccccc1OCc2ccccn2 7a_100000739446_100000721315 [0,1,0,0,1,0|1,0,0]=3 4840 B16R2.71 Ic1ccccc1OCc2cccnc2 34a_100000739446_100000733263 [0,1,0,0,1,0|1,0,0]=3 4841 B16R2.71 Ic1ccccc1OCc2cccnc2 7a_100000739446_100000741622 [0,1,0,0,1,0|1,0,0]=3 4842 B16R2.71 Ic1ccccc1OCc2cccnn2 34a_100000739446_100016990269 [0,1,0,0,1,0|2,0,0]=4 4843 B16R2.71 Ic1ccccc1OCc2cccnn2 7a_100000739446_100016990269 [0,1,0,0,1,0|2,0,0]=4 4844 B16R2.71 Ic1ccccc1OCc2ccncc2 7a_100000739446_100015193705 [0,1,0,0,1,0|1,0,0]=3 4845 B16R2.71 Ic1ccccc1OCc2cnccn2 34a_100000739446_100016995436 [0,1,0,0,1,0|2,0,0]=4 4846 B16R2.71 Ic1ccccc1OCc2cnccn2 7a_100000739446_100016995436 [0,1,0,0,1,0|2,0,0]=4 4847 B16R2.71 Ic1ccccc1OCc2cncnc2 34a_100000739446_100015196519 [0,1,0,0,1,0|2,0,0]=4 4848 B16R2.71 Ic1ccccc1OCc2cncnc2 7a_100000739446_100015196519 [0,1,0,0,1,0|2,0,0]=4 4849 B16R2.71 Ic1ccccc1OCc2ncccn2 34a_100000739446_100000703007 [0,1,0,0,1,0|2,0,0]=4 4850 B16R2.71 Ic1ccccc1OCc2ncccn2 7a_100000739446_100000703007 [0,1,0,0,1,0|2,0,0]=4 4851 B16R2.71 Ic1ccncc1OCc2ccccc2 34a_100000050107_100015291786 [0,1,0,0,1,0|1,0,0]=3 4852 B16R2.71 Ic1ccncc1OCc2ccccn2 34a_100000050107_100000721315 [0,1,0,0,1,0|2,0,0]=4 4853 B16R2.71 Ic1ccncc1OCc2cccnc2 34a_100000050107_100000733263 [0,1,0,0,1,0|2,0,0]=4 4854 B16R2.71 Ic1ncccc1OCc2ccccc2 34a_100000034122_100015291786 [0,1,0,0,1,0|1,0,0]=3 4855 B16R2.71 Ic1ncccc1OCc2ccccc2 7a_100000034122_100000211182 [0,1,0,0,1,0|1,0,0]=3 4856 B16R2.71 Ic1ncccc1OCc2ccccn2 34a_100000034122_100000721315 [0,1,0,0,1,0|2,0,0]=4 4857 B16R2.71 Ic1ncccc1OCc2ccccn2 7a_100000034122_100000721315 [0,1,0,0,1,0|2,0,0]=4 4858 B16R2.71 Ic1ncccc1OCc2cccnc2 34a_100000034122_100000733263 [0,1,0,0,1,0|2,0,0]=4 4859 B16R2.71 Ic1ncccc1OCc2cccnc2 7a_100000034122_100000741622 [0,1,0,0,1,0|2,0,0]=4 4860 B16R2.71 Ic1ncccc1OCc2ccncc2 7a_100000034122_100015193705 [0,1,0,0,1,0|2,0,0]=4 4861 B16R2.71 Nc1ccccc1C#Cc2ccccc2 271570a_100000069678_100000210017 [0,1,0,0,1,0|0,0,2]=4 4862 B16R2.71 Nc1ccccc1C=Cc2ccccc2 271570a_100102527694_100000210017 [0,1,0,0,1,0|0,0,2]=4 4863 B16R2.71 Nc1ccccc1OCc2ccccc2 34a_100000185747_100015291786 [0,1,0,0,1,0|0,0,0]=2 4864 B16R2.71 Nc1ccccc1OCc2ccccc2 7a_100000185747_100000211182 [0,1,0,0,1,0|0,0,0]=2 4865 B16R2.71 Nc1ccccc1OCc2ccccn2 34a_100000185747_100000721315 [0,1,0,0,1,0|1,0,0]=3 4866 B16R2.71 Nc1ccccc1OCc2ccccn2 7a_100000185747_100000721315 [0,1,0,0,1,0|1,0,0]=3 4867 B16R2.71 Nc1ccccc1OCc2cccnc2 34a_100000185747_100000733263 [0,1,0,0,1,0|1,0,0]=3 4868 B16R2.71 Nc1ccccc1OCc2cccnc2 7a_100000185747_100000741622 [0,1,0,0,1,0|1,0,0]=3 4869 B16R2.71 Nc1ccccc1OCc2cccnn2 34a_100000185747_100016990269 [0,1,0,0,1,0|2,0,0]=4 4870 B16R2.71 Nc1ccccc1OCc2cccnn2 7a_100000185747_100016990269 [0,1,0,0,1,0|2,0,0]=4 4871 B16R2.71 Nc1ccccc1OCc2ccncc2 7a_100000185747_100015193705 [0,1,0,0,1,0|1,0,0]=3 4872 B16R2.71 Nc1ccccc1OCc2cnccn2 34a_100000185747_100016995436 [0,1,0,0,1,0|2,0,0]=4 4873 B16R2.71 Nc1ccccc1OCc2cnccn2 7a_100000185747_100016995436 [0,1,0,0,1,0|2,0,0]=4 4874 B16R2.71 Nc1ccccc1OCc2cncnc2 34a_100000185747_100015196519 [0,1,0,0,1,0|2,0,0]=4 4875 B16R2.71 Nc1ccccc1OCc2cncnc2 7a_100000185747_100015196519 [0,1,0,0,1,0|2,0,0]=4 4876 B16R2.71 Nc1ccccc1OCc2ncccn2 34a_100000185747_100000703007 [0,1,0,0,1,0|2,0,0]=4 4877 B16R2.71 Nc1ccccc1OCc2ncccn2 7a_100000185747_100000703007 [0,1,0,0,1,0|2,0,0]=4 4878 B16R2.71 Nc1ccccc1SCc2ccccc2 62a_100000210017_100015291786 [0,1,0,0,1,0|0,1,0]=3 4879 B16R2.71 Nc1ccccc1SCc2ccccc2 62a_100000211182_100000210017 [0,1,0,0,1,0|0,1,0]=3 4880 B16R2.71 Nc1ccccc1SCc2ccccn2 62a_100000210017_100000721315 [0,1,0,0,1,0|1,1,0]=4 4881 B16R2.71 Nc1ccccc1SCc2ccccn2 62a_100000721315_100000210017 [0,1,0,0,1,0|1,1,0]=4 4882 B16R2.71 Nc1ccccc1SCc2cccnc2 62a_100000210017_100000741622 [0,1,0,0,1,0|1,1,0]=4 4883 B16R2.71 Nc1ccccc1SCc2cccnc2 62a_100000741622_100000210017 [0,1,0,0,1,0|1,1,0]=4 4884 B16R2.71 Nc1ccccc1SCc2ccncc2 62a_100000210017_100015193705 [0,1,0,0,1,0|1,1,0]=4 4885 B16R2.71 Nc1ccccc1SCc2ccncc2 62a_100015193705_100000210017 [0,1,0,0,1,0|1,1,0]=4 4886 B16R2.71 Nc1cccnc1OCc2ccccc2 34a_100000746358_100015291786 [0,1,0,0,1,0|1,0,0]=3 4887 B16R2.71 Nc1cccnc1OCc2ccccn2 34a_100000746358_100000721315 [0,1,0,0,1,0|2,0,0]=4 4888 B16R2.71 Nc1cccnc1OCc2cccnc2 34a_100000746358_100000733263 [0,1,0,0,1,0|2,0,0]=4 4889 B16R2.71 Nc1cccnc1SCc2ccccc2 62a_100000211182_100000688686 [0,1,0,0,1,0|1,1,0]=4 4890 B16R2.71 Nc1cccnc1SCc2ccccc2 62a_100000688686_100015291786 [0,1,0,0,1,0|1,1,0]=4 4891 B16R2.71 Nc1ccncc1OCc2ccccc2 34a_100000753702_100015291786 [0,1,0,0,1,0|1,0,0]=3 4892 B16R2.71 Nc1ccncc1OCc2ccccn2 34a_100000753702_100000721315 [0,1,0,0,1,0|2,0,0]=4 4893 B16R2.71 Nc1ccncc1OCc2cccnc2 34a_100000753702_100000733263 [0,1,0,0,1,0|2,0,0]=4 4894 B16R2.71 Nc1ccncc1SCc2ccccc2 62a_100000047001_100015291786 [0,1,0,0,1,0|1,1,0]=4 4895 B16R2.71 Nc1ccncc1SCc2ccccc2 62a_100000211182_100000047001 [0,1,0,0,1,0|1,1,0]=4 4896 B16R2.71 Nc1cnccc1SCc2ccccc2 62a_100000211182_100000756074 [0,1,0,0,1,0|1,1,0]=4 4897 B16R2.71 Nc1cnccc1SCc2ccccc2 62a_100000756074_100015291786 [0,1,0,0,1,0|1,1,0]=4 4898 B16R2.71 Nc1ncccc1OCc2ccccc2 34a_100000211975_100015291786 [0,1,0,0,1,0|1,0,0]=3 4899 B16R2.71 Nc1ncccc1OCc2ccccc2 7a_100000211975_100000211182 [0,1,0,0,1,0|1,0,0]=3 4900 B16R2.71 Nc1ncccc1OCc2ccccn2 34a_100000211975_100000721315 [0,1,0,0,1,0|2,0,0]=4 4901 B16R2.71 Nc1ncccc1OCc2ccccn2 7a_100000211975_100000721315 [0,1,0,0,1,0|2,0,0]=4 4902 B16R2.71 Nc1ncccc1OCc2cccnc2 34a_100000211975_100000733263 [0,1,0,0,1,0|2,0,0]=4 4903 B16R2.71 Nc1ncccc1OCc2cccnc2 7a_100000211975_100000741622 [0,1,0,0,1,0|2,0,0]=4 4904 B16R2.71 Nc1ncccc1OCc2ccncc2 7a_100000211975_100015193705 [0,1,0,0,1,0|2,0,0]=4 4905 B16R2.71 Nc1ncccc1SCc2ccccc2 62a_100000045569_100015291786 [0,1,0,0,1,0|1,1,0]=4 4906 B16R2.71 Nc1ncccc1SCc2ccccc2 62a_100000211182_100000045569 [0,1,0,0,1,0|1,1,0]=4 4907 B16R2.71 Nc1ncncc1OCc2ccccc2 7a_100000112926_100000211182 [0,1,0,0,1,0|2,0,0]=4 4908 B16R2.71 O=c1cc[nH]cc1SCc2ccccc2 62a_100000211182_100009998708 [0,1,0,0,1,0|1,1,0]=4 4909 B16R2.71 O=c1cc[nH]cc1SCc2ccccc2 62a_100009998708_100015291786 [0,1,0,0,1,0|1,1,0]=4 4910 B16R2.71 O=c1ccocc1OCc2ccccc2 34a_100000060831_100015291786 [0,1,0,0,1,0|1,0,0]=3 4911 B16R2.71 O=c1ccocc1OCc2ccccn2 34a_100000060831_100000721315 [0,1,0,0,1,0|2,0,0]=4 4912 B16R2.71 O=c1ccocc1OCc2cccnc2 34a_100000060831_100000733263 [0,1,0,0,1,0|2,0,0]=4 4913 B16R2.71 O=c1occcc1OCc2ccccc2 34a_100000077404_100015291786 [0,1,0,0,1,0|1,0,0]=3 4914 B16R2.71 O=c1occcc1OCc2ccccc2 7a_100000077404_100000211182 [0,1,0,0,1,0|1,0,0]=3 4915 B16R2.71 O=c1occcc1OCc2ccccn2 34a_100000077404_100000721315 [0,1,0,0,1,0|2,0,0]=4 4916 B16R2.71 O=c1occcc1OCc2ccccn2 7a_100000077404_100000721315 [0,1,0,0,1,0|2,0,0]=4 4917 B16R2.71 O=c1occcc1OCc2cccnc2 34a_100000077404_100000733263 [0,1,0,0,1,0|2,0,0]=4 4918 B16R2.71 O=c1occcc1OCc2cccnc2 7a_100000077404_100000741622 [0,1,0,0,1,0|2,0,0]=4 4919 B16R2.71 O=c1occcc1OCc2ccncc2 7a_100000077404_100015193705 [0,1,0,0,1,0|2,0,0]=4 4920 B16R2.71 Oc1ccccc1C#Cc2ccccc2 271570a_100000069678_100000739446 [0,1,0,0,1,0|0,0,2]=4 4921 B16R2.71 Oc1ccccc1C#Cc2ccccc2 271570a_203496583355_100010200916 [0,1,0,0,1,0|0,0,2]=4 4922 B16R2.71 Oc1ccccc1C=Cc2ccccc2 271570a_100102527694_100000739446 [0,1,0,0,1,0|0,0,2]=4 4923 B16R2.71 Oc1ccccc1CNc2ccccc2 270302a_100000106764_100000185834 [0,1,0,0,1,0|1,0,0]=3 4924 B16R2.71 Oc1ccccc1NCc2ccccc2 34a_100000185747_100015291786 [0,1,0,0,1,0|1,0,0]=3 4925 B16R2.71 Oc1ccccc1NCc2ccccn2 34a_100000185747_100000721315 [0,1,0,0,1,0|2,0,0]=4 4926 B16R2.71 Oc1ccccc1NCc2cccnc2 34a_100000185747_100000733263 [0,1,0,0,1,0|2,0,0]=4 4927 B16R2.71 Oc1ccccc1OCc2ccccc2 271570a_203496583355_100000151716 [0,1,0,0,1,0|0,0,0]=2 4928 B16R2.71 Oc1ccccc1SCc2ccccc2 62a_100000211182_100000739446 [0,1,0,0,1,0|0,1,0]=3 4929 B16R2.71 Oc1ccccc1SCc2ccccc2 62a_100000739446_100015291786 [0,1,0,0,1,0|0,1,0]=3 4930 B16R2.71 Oc1ccccc1SCc2ccccn2 62a_100000721315_100000739446 [0,1,0,0,1,0|1,1,0]=4 4931 B16R2.71 Oc1ccccc1SCc2ccccn2 62a_100000739446_100000721315 [0,1,0,0,1,0|1,1,0]=4 4932 B16R2.71 Oc1ccccc1SCc2cccnc2 62a_100000739446_100000741622 [0,1,0,0,1,0|1,1,0]=4 4933 B16R2.71 Oc1ccccc1SCc2cccnc2 62a_100000741622_100000739446 [0,1,0,0,1,0|1,1,0]=4 4934 B16R2.71 Oc1ccccc1SCc2ccncc2 62a_100000739446_100015193705 [0,1,0,0,1,0|1,1,0]=4 4935 B16R2.71 Oc1ccccc1SCc2ccncc2 62a_100015193705_100000739446 [0,1,0,0,1,0|1,1,0]=4 4936 B16R2.71 Oc1cccnc1CNc2ccccc2 34a_100000106764_200020655725 [0,1,0,0,1,0|2,0,0]=4 4937 B16R2.71 Oc1cccnc1COc2ccccc2 34a_100000210340_200020655725 [0,1,0,0,1,0|1,0,0]=3 4938 B16R2.71 Oc1cccnc1COc2ccccc2 7a_100000210340_200020655725 [0,1,0,0,1,0|1,0,0]=3 4939 B16R2.71 Oc1cccnc1COc2cccnc2 34a_100000210849_200020655725 [0,1,0,0,1,0|2,0,0]=4 4940 B16R2.71 Oc1cccnc1COc2cccnc2 7a_100000210849_200020655725 [0,1,0,0,1,0|2,0,0]=4 4941 B16R2.71 Oc1cccnc1COc2ccncc2 34a_100000212176_200020655725 [0,1,0,0,1,0|2,0,0]=4 4942 B16R2.71 Oc1cccnc1CSc2ccccc2 62a_100000719477_200020655725 [0,1,0,0,1,0|1,1,0]=4 4943 B16R2.71 Oc1cccnc1CSc2ccccc2 62a_200020655725_100000041952 [0,1,0,0,1,0|1,1,0]=4 4944 B16R2.71 Oc1cccnc1OCc2ccccc2 271570a_203496583355_200011465151 [0,1,0,0,1,0|1,0,0]=3 4945 B16R2.71 Oc1cccnc1SCc2ccccc2 62a_100000034122_100015291786 [0,1,0,0,1,0|1,1,0]=4 4946 B16R2.71 Oc1cccnc1SCc2ccccc2 62a_100000211182_100000034122 [0,1,0,0,1,0|1,1,0]=4 4947 B16R2.71 Oc1cnccc1SCc2ccccc2 62a_100000211182_100009817591 [0,1,0,0,1,0|1,1,0]=4 4948 B16R2.71 Oc1cnccc1SCc2ccccc2 62a_100009817591_100015291786 [0,1,0,0,1,0|1,1,0]=4 4949 B16R2.71 Oc1ncccc1CNc2ccccc2 207a_100000106764_100011998315 [0,1,0,0,1,0|2,0,0]=4 4950 B16R2.71 Oc1ncccc1CNc2ccccc2 270302a_100000106764_100011998315 [0,1,0,0,1,0|2,0,0]=4 4951 B16R2.71 Oc1ncccc1OCc2ccccc2 271570a_203496583355_100011501402 [0,1,0,0,1,0|1,0,0]=3 4952 B16R2.71 Oc1ncccc1SCc2ccccc2 62a_100000211182_100000760158 [0,1,0,0,1,0|1,1,0]=4 4953 B16R2.71 Oc1ncccc1SCc2ccccc2 62a_100000760158_100015291786 [0,1,0,0,1,0|1,1,0]=4 4954 B16R2.71 Oc1ncncc1OCc2ccccc2 271570a_203496583355_100010760880 [0,1,0,0,1,0|2,0,0]=4 4955 B16R2.71 S=c1cc[nH]cc1SCc2ccccc2 62a_100000211182_200012280681 [0,1,0,0,1,0|1,1,0]=4 4956 B16R2.71 S=c1cc[nH]cc1SCc2ccccc2 62a_200012280681_100015291786 [0,1,0,0,1,0|1,1,0]=4 4957 B16R2.71 [O-][n+]1ccccc1OCc2ccccc2 7a_100000211761_100000211182 [0,1,0,0,1,0|1,0,0]=3 4958 B16R2.71 [O-][n+]1ccccc1OCc2ccccn2 7a_100000211761_100000721315 [0,1,0,0,1,0|2,0,0]=4 4959 B16R2.71 [O-][n+]1ccccc1OCc2cccnc2 7a_100000211761_100000741622 [0,1,0,0,1,0|2,0,0]=4 4960 B16R2.71 [O-][n+]1ccccc1OCc2ccncc2 7a_100000211761_100015193705 [0,1,0,0,1,0|2,0,0]=4 4961 B16R2.71 [O-][n+]1ccccc1SCc2ccccc2 62a_100000211182_200000042595 [0,1,0,0,1,0|1,1,0]=4 4962 B16R2.88 CC(Cc1ccccc1)c2ccccc2 271570a_100000062452_100000210277 [0,1,0,0,1,0|0,0,0]=2 4963 B16R2.88 CC(Cc1ccccn1)c2ccccc2 271570a_100000062452_100011216584 [0,1,0,0,1,0|1,0,0]=3 4964 B16R2.88 CC(Cc1cccnc1)c2ccccc2 271570a_100000062452_100000752921 [0,1,0,0,1,0|1,0,0]=3 4965 B16R2.88 CC(Cc1cccnn1)c2ccccc2 271570a_100000062452_100016991348 [0,1,0,0,1,0|2,0,0]=4 4966 B16R2.88 CC(Cc1ccncc1)c2ccccc2 271570a_100000062452_100000035832 [0,1,0,0,1,0|1,0,0]=3 4967 B16R2.88 CC(Cc1ccncn1)c2ccccc2 271570a_100000062452_100000703185 [0,1,0,0,1,0|2,0,0]=4 4968 B16R2.88 CC(Cc1ccnnc1)c2ccccc2 271570a_100000062452_100000732662 [0,1,0,0,1,0|2,0,0]=4 4969 B16R2.88 CC(Cc1cnccn1)c2ccccc2 271570a_100000062452_100000758340 [0,1,0,0,1,0|2,0,0]=4 4970 B16R2.88 CC(Cc1cncnc1)c2ccccc2 271570a_100000062452_100011206942 [0,1,0,0,1,0|2,0,0]=4 4971 B16R2.88 CC(Cc1ncccn1)c2ccccc2 271570a_100000062452_100000211032 [0,1,0,0,1,0|2,0,0]=4 4972 B16R2.88 CC(Nc1ccccc1)c2ccccc2 34a_100000106764_100000211855 [0,1,0,0,1,0|1,0,0]=3 4973 B16R2.88 CC(Oc1ccccc1)c2ccccc2 34a_100000210340_100000211855 [0,1,0,0,1,0|0,0,0]=2 4974 B16R2.88 CC(Oc1ccccc1)c2ccccc2 7a_100000210340_100000230085 [0,1,0,0,1,0|0,0,0]=2 4975 B16R2.88 CC(Oc1ccccc1)c2cnccn2 7a_100000210340_200000703233 [0,1,0,0,1,0|2,0,0]=4 4976 B16R2.88 CC(Oc1cccnc1)c2ccccc2 34a_100000210849_100000211855 [0,1,0,0,1,0|1,0,0]=3 4977 B16R2.88 CC(Oc1cccnc1)c2ccccc2 7a_100000210849_100000230085 [0,1,0,0,1,0|1,0,0]=3 4978 B16R2.88 CC(Oc1ccncc1)c2ccccc2 34a_100000212176_100000211855 [0,1,0,0,1,0|1,0,0]=3 4979 B16R2.88 CC(Oc1ccnnc1)c2ccccc2 34a_100015204005_100000211855 [0,1,0,0,1,0|2,0,0]=4 4980 B16R2.88 CC(Oc1cncnc1)c2ccccc2 7a_100000754086_100000230085 [0,1,0,0,1,0|2,0,0]=4 4981 B16R2.88 CC(Sc1ccccc1)c2ccccc2 62a_100000230085_100000041952 [0,1,0,0,1,0|0,1,0]=3 4982 B16R2.88 CC(Sc1ccccc1)c2ccccc2 62a_100000719477_100000230085 [0,1,0,0,1,0|0,1,0]=3 4983 B16R2.88 CC(Sc1ccccn1)c2ccccc2 62a_100000230085_100011216584 [0,1,0,0,1,0|1,1,0]=4 4984 B16R2.88 CC(Sc1ccccn1)c2ccccc2 62a_100011216584_100000230085 [0,1,0,0,1,0|1,1,0]=4 4985 B16R2.88 CC(Sc1cccnc1)c2ccccc2 62a_100000210063_100000230085 [0,1,0,0,1,0|1,1,0]=4 4986 B16R2.88 CC(Sc1cccnc1)c2ccccc2 62a_100000230085_100000210063 [0,1,0,0,1,0|1,1,0]=4 4987 B16R2.88 CC(Sc1ccncc1)c2ccccc2 62a_100000230085_100000728582 [0,1,0,0,1,0|1,1,0]=4 4988 B16R2.88 CC(Sc1ccncc1)c2ccccc2 62a_100000728582_100000230085 [0,1,0,0,1,0|1,1,0]=4 4989 B16R2.88 CN(Cc1ccccc1)c2ccccc2 2230a_100000188819_200000210301 [0,1,0,0,1,0|1,0,0]=3 4990 B16R2.88 CN(Cc1ccccc1)c2ccccc2 2230a_100000210012_100015291786 [0,1,0,0,1,0|1,0,0]=3 4991 B16R2.88 CN(Cc1ccccc1)c2ccccc2 269982a_100000188819_200000210301 [0,1,0,0,1,0|1,0,0]=3 4992 B16R2.88 CN(Cc1ccccc1)c2ccccc2 269982a_100000210012_100000211182 [0,1,0,0,1,0|1,0,0]=3 4993 B16R2.88 CN(Cc1ccccc1)c2ccccc2 34a_100000188819_200000210301 [0,1,0,0,1,0|1,0,0]=3 4994 B16R2.88 CN(Cc1ccccc1)c2ccccc2 34a_100000210012_100015291786 [0,1,0,0,1,0|1,0,0]=3 4995 B16R2.88 CN(Cc1ccccn1)c2ccccc2 2230a_100000210012_100000721315 [0,1,0,0,1,0|2,0,0]=4 4996 B16R2.88 CN(Cc1ccccn1)c2ccccc2 269982a_100000210012_100000721315 [0,1,0,0,1,0|2,0,0]=4 4997 B16R2.88 CN(Cc1ccccn1)c2ccccc2 34a_100000210012_100000721315 [0,1,0,0,1,0|2,0,0]=4 4998 B16R2.88 CN(Cc1cccnc1)c2ccccc2 2230a_100000210012_100000741622 [0,1,0,0,1,0|2,0,0]=4 4999 B16R2.88 CN(Cc1cccnc1)c2ccccc2 269982a_100000210012_100000733263 [0,1,0,0,1,0|2,0,0]=4 5000 B16R2.88 CN(Cc1cccnc1)c2ccccc2 34a_100000210012_100000733263 [0,1,0,0,1,0|2,0,0]=4 5001 B16R2.88 CN(Cc1ccncc1)c2ccccc2 2230a_100000210012_100015193705 [0,1,0,0,1,0|2,0,0]=4 5002 B16R2.88 CN(Cc1ccncc1)c2ccccc2 269982a_100000210012_100015193705 [0,1,0,0,1,0|2,0,0]=4 5003 B16R2.88 O=C(Cc1ccccc1)c2ccccc2 1458a_100000185807_100015291786 [0,1,0,0,1,0|0,0,1]=3 5004 B16R2.88 O=C(Cc1ccccn1)c2ccccc2 1458a_100000185807_100000721315 [0,1,0,0,1,0|1,0,1]=4 5005 B16R2.88 O=C(Cc1cccnc1)c2ccccc2 1458a_100000185807_100000733263 [0,1,0,0,1,0|1,0,1]=4 5006 B16R2.88 O=C(Cc1ccncc1)c2ccccc2 1458a_100000185807_100000705612 [0,1,0,0,1,0|1,0,1]=4 5007 B16R2.88 O=C(Nc1ccccc1)c2ccccc2 11a_100000106764_100000185807 [0,1,0,0,1,0|1,0,1]=4 5008 B16R2.88 O=C(Nc1ccccc1)c2ccccc2 1626a_100000106764_100000185807 [0,1,0,0,1,0|1,0,1]=4 5009 B16R2.88 O=C(Nc1ccccc1)c2ccccc2 22a_100000106764_100000185807 [0,1,0,0,1,0|1,0,1]=4 5010 B16R2.88 O=C(Nc1ccccc1)c2ccccc2 527a_100000106764_100000185807 [0,1,0,0,1,0|1,0,1]=4 5011 B16R2.88 [13CH3]N(Cc1ccccc1)c2ccccc2 2230a_100000188819_200025704644 [0,1,0,0,1,0|1,0,0]=3 5012 B16R2.88 [13CH3]N(Cc1ccccc1)c2ccccc2 269982a_100000188819_200025704644 [0,1,0,0,1,0|1,0,0]=3 5013 B16R2.88 [13CH3]N(Cc1ccccc1)c2ccccc2 34a_100000188819_200025704644 [0,1,0,0,1,0|1,0,0]=3 5014 B16R2.132 Brc1ccc(cc1)C#Cc2ccccc2 271570a_100000069678_100000752885 [0,1,0,0,1,0|0,0,2]=4 5015 B16R2.132 Brc1ccc(cc1)C=Cc2ccccc2 271570a_100102527694_100000752885 [0,1,0,0,1,0|0,0,2]=4 5016 B16R2.132 Brc1ccc(cc1)C=Cc2ccccc2 271570a_100102527914_100000210277 [0,1,0,0,1,0|0,0,2]=4 5017 B16R2.132 Brc1ccc(cc1)CNc2ccccc2 207a_100000106764_100000186029 [0,1,0,0,1,0|1,0,0]=3 5018 B16R2.132 Brc1ccc(cc1)CNc2ccccc2 270302a_100000106764_100000186029 [0,1,0,0,1,0|1,0,0]=3 5019 B16R2.132 Brc1ccc(cc1)CNc2ccccc2 34a_100000106764_100000189115 [0,1,0,0,1,0|1,0,0]=3 5020 B16R2.132 Brc1ccc(cc1)COc2ccccc2 34a_100000210340_100000189115 [0,1,0,0,1,0|0,0,0]=2 5021 B16R2.132 Brc1ccc(cc1)COc2ccccc2 7a_100000210340_100011217064 [0,1,0,0,1,0|0,0,0]=2 5022 B16R2.132 Brc1ccc(cc1)COc2cccnc2 34a_100000210849_100000189115 [0,1,0,0,1,0|1,0,0]=3 5023 B16R2.132 Brc1ccc(cc1)COc2cccnc2 7a_100000210849_100011217064 [0,1,0,0,1,0|1,0,0]=3 5024 B16R2.132 Brc1ccc(cc1)COc2ccncc2 34a_100000212176_100000189115 [0,1,0,0,1,0|1,0,0]=3 5025 B16R2.132 Brc1ccc(cc1)COc2ccnnc2 34a_100015204005_100000189115 [0,1,0,0,1,0|2,0,0]=4 5026 B16R2.132 Brc1ccc(cc1)COc2cncnc2 7a_100000754086_100011217064 [0,1,0,0,1,0|2,0,0]=4 5027 B16R2.132 Brc1ccc(cc1)CSc2ccccc2 62a_100000189115_100000041952 [0,1,0,0,1,0|0,1,0]=3 5028 B16R2.132 Brc1ccc(cc1)CSc2ccccc2 62a_100000719477_100000189115 [0,1,0,0,1,0|0,1,0]=3 5029 B16R2.132 Brc1ccc(cc1)CSc2ccccn2 62a_100000189115_100011216584 [0,1,0,0,1,0|1,1,0]=4 5030 B16R2.132 Brc1ccc(cc1)CSc2ccccn2 62a_100011216584_100000189115 [0,1,0,0,1,0|1,1,0]=4 5031 B16R2.132 Brc1ccc(cc1)CSc2cccnc2 62a_100000189115_100000210063 [0,1,0,0,1,0|1,1,0]=4 5032 B16R2.132 Brc1ccc(cc1)CSc2cccnc2 62a_100000210063_100000189115 [0,1,0,0,1,0|1,1,0]=4 5033 B16R2.132 Brc1ccc(cc1)CSc2ccncc2 62a_100000189115_100000728582 [0,1,0,0,1,0|1,1,0]=4 5034 B16R2.132 Brc1ccc(cc1)CSc2ccncc2 62a_100000728582_100000189115 [0,1,0,0,1,0|1,1,0]=4 5035 B16R2.132 Brc1ccc(cc1)NCc2ccccc2 207a_100000210018_100015611070 [0,1,0,0,1,0|1,0,0]=3 5036 B16R2.132 Brc1ccc(cc1)NCc2ccccc2 2230a_100000210018_100015291786 [0,1,0,0,1,0|1,0,0]=3 5037 B16R2.132 Brc1ccc(cc1)NCc2ccccc2 270302a_100000210018_100015611070 [0,1,0,0,1,0|1,0,0]=3 5038 B16R2.132 Brc1ccc(cc1)NCc2ccccc2 34a_100000210018_100015291786 [0,1,0,0,1,0|1,0,0]=3 5039 B16R2.132 Brc1ccc(cc1)NCc2ccccn2 207a_100000210018_100000209966 [0,1,0,0,1,0|2,0,0]=4 5040 B16R2.132 Brc1ccc(cc1)NCc2ccccn2 2230a_100000210018_100000721315 [0,1,0,0,1,0|2,0,0]=4 5041 B16R2.132 Brc1ccc(cc1)NCc2ccccn2 270302a_100000210018_100000209966 [0,1,0,0,1,0|2,0,0]=4 5042 B16R2.132 Brc1ccc(cc1)NCc2ccccn2 34a_100000210018_100000721315 [0,1,0,0,1,0|2,0,0]=4 5043 B16R2.132 Brc1ccc(cc1)NCc2cccnc2 207a_100000210018_100000209961 [0,1,0,0,1,0|2,0,0]=4 5044 B16R2.132 Brc1ccc(cc1)NCc2cccnc2 2230a_100000210018_100000741622 [0,1,0,0,1,0|2,0,0]=4 5045 B16R2.132 Brc1ccc(cc1)NCc2cccnc2 270302a_100000210018_100000209961 [0,1,0,0,1,0|2,0,0]=4 5046 B16R2.132 Brc1ccc(cc1)NCc2cccnc2 34a_100000210018_100000733263 [0,1,0,0,1,0|2,0,0]=4 5047 B16R2.132 Brc1ccc(cc1)NCc2ccncc2 207a_100000210018_100000186114 [0,1,0,0,1,0|2,0,0]=4 5048 B16R2.132 Brc1ccc(cc1)NCc2ccncc2 2230a_100000210018_100015193705 [0,1,0,0,1,0|2,0,0]=4 5049 B16R2.132 Brc1ccc(cc1)OCc2ccccc2 34a_100000185759_100015291786 [0,1,0,0,1,0|0,0,0]=2 5050 B16R2.132 Brc1ccc(cc1)OCc2ccccc2 7a_100000185759_100000211182 [0,1,0,0,1,0|0,0,0]=2 5051 B16R2.132 Brc1ccc(cc1)OCc2ccccn2 34a_100000185759_100000721315 [0,1,0,0,1,0|1,0,0]=3 5052 B16R2.132 Brc1ccc(cc1)OCc2ccccn2 7a_100000185759_100000721315 [0,1,0,0,1,0|1,0,0]=3 5053 B16R2.132 Brc1ccc(cc1)OCc2cccnc2 34a_100000185759_100000733263 [0,1,0,0,1,0|1,0,0]=3 5054 B16R2.132 Brc1ccc(cc1)OCc2cccnc2 7a_100000185759_100000741622 [0,1,0,0,1,0|1,0,0]=3 5055 B16R2.132 Brc1ccc(cc1)OCc2cccnn2 34a_100000185759_100016990269 [0,1,0,0,1,0|2,0,0]=4 5056 B16R2.132 Brc1ccc(cc1)OCc2cccnn2 7a_100000185759_100016990269 [0,1,0,0,1,0|2,0,0]=4 5057 B16R2.132 Brc1ccc(cc1)OCc2ccncc2 7a_100000185759_100015193705 [0,1,0,0,1,0|1,0,0]=3 5058 B16R2.132 Brc1ccc(cc1)OCc2cnccn2 34a_100000185759_100016995436 [0,1,0,0,1,0|2,0,0]=4 5059 B16R2.132 Brc1ccc(cc1)OCc2cnccn2 7a_100000185759_100016995436 [0,1,0,0,1,0|2,0,0]=4 5060 B16R2.132 Brc1ccc(cc1)OCc2cncnc2 34a_100000185759_100015196519 [0,1,0,0,1,0|2,0,0]=4 5061 B16R2.132 Brc1ccc(cc1)OCc2cncnc2 7a_100000185759_100015196519 [0,1,0,0,1,0|2,0,0]=4 5062 B16R2.132 Brc1ccc(cc1)OCc2ncccn2 34a_100000185759_100000703007 [0,1,0,0,1,0|2,0,0]=4 5063 B16R2.132 Brc1ccc(cc1)OCc2ncccn2 7a_100000185759_100000703007 [0,1,0,0,1,0|2,0,0]=4 5064 B16R2.132 Brc1ccc(cc1)SCc2ccccc2 62a_100000211182_100000752885 [0,1,0,0,1,0|0,1,0]=3 5065 B16R2.132 Brc1ccc(cc1)SCc2ccccc2 62a_100000752885_100015291786 [0,1,0,0,1,0|0,1,0]=3 5066 B16R2.132 Brc1ccc(cc1)SCc2ccccn2 62a_100000721315_100000752885 [0,1,0,0,1,0|1,1,0]=4 5067 B16R2.132 Brc1ccc(cc1)SCc2ccccn2 62a_100000752885_100000721315 [0,1,0,0,1,0|1,1,0]=4 5068 B16R2.132 Brc1ccc(cc1)SCc2cccnc2 62a_100000741622_100000752885 [0,1,0,0,1,0|1,1,0]=4 5069 B16R2.132 Brc1ccc(cc1)SCc2cccnc2 62a_100000752885_100000741622 [0,1,0,0,1,0|1,1,0]=4 5070 B16R2.132 Brc1ccc(cc1)SCc2ccncc2 62a_100000752885_100015193705 [0,1,0,0,1,0|1,1,0]=4 5071 B16R2.132 Brc1ccc(cc1)SCc2ccncc2 62a_100015193705_100000752885 [0,1,0,0,1,0|1,1,0]=4 5072 B16R2.132 Brc1ccc(cn1)CNc2ccccc2 34a_100000106764_100009831999 [0,1,0,0,1,0|2,0,0]=4 5073 B16R2.132 Brc1ccc(cn1)COc2ccccc2 34a_100000210340_100009831999 [0,1,0,0,1,0|1,0,0]=3 5074 B16R2.132 Brc1ccc(cn1)COc2ccccc2 7a_100000210340_100009831999 [0,1,0,0,1,0|1,0,0]=3 5075 B16R2.132 Brc1ccc(cn1)COc2cccnc2 34a_100000210849_100009831999 [0,1,0,0,1,0|2,0,0]=4 5076 B16R2.132 Brc1ccc(cn1)COc2cccnc2 7a_100000210849_100009831999 [0,1,0,0,1,0|2,0,0]=4 5077 B16R2.132 Brc1ccc(cn1)COc2ccncc2 34a_100000212176_100009831999 [0,1,0,0,1,0|2,0,0]=4 5078 B16R2.132 Brc1ccc(cn1)CSc2ccccc2 62a_100000719477_100009831999 [0,1,0,0,1,0|1,1,0]=4 5079 B16R2.132 Brc1ccc(cn1)CSc2ccccc2 62a_100009831999_100000041952 [0,1,0,0,1,0|1,1,0]=4 5080 B16R2.132 Brc1ccc(cn1)OCc2ccccc2 34a_100000685995_100015291786 [0,1,0,0,1,0|1,0,0]=3 5081 B16R2.132 Brc1ccc(cn1)OCc2ccccc2 7a_100000685995_100000211182 [0,1,0,0,1,0|1,0,0]=3 5082 B16R2.132 Brc1ccc(cn1)OCc2ccccn2 34a_100000685995_100000721315 [0,1,0,0,1,0|2,0,0]=4 5083 B16R2.132 Brc1ccc(cn1)OCc2ccccn2 7a_100000685995_100000721315 [0,1,0,0,1,0|2,0,0]=4 5084 B16R2.132 Brc1ccc(cn1)OCc2cccnc2 34a_100000685995_100000733263 [0,1,0,0,1,0|2,0,0]=4 5085 B16R2.132 Brc1ccc(cn1)OCc2cccnc2 7a_100000685995_100000741622 [0,1,0,0,1,0|2,0,0]=4 5086 B16R2.132 Brc1ccc(cn1)OCc2ccncc2 7a_100000685995_100015193705 [0,1,0,0,1,0|2,0,0]=4 5087 B16R2.132 Brc1ccc(cn1)SCc2ccccc2 62a_100000211182_100009814638 [0,1,0,0,1,0|1,1,0]=4 5088 B16R2.132 Brc1ccc(cn1)SCc2ccccc2 62a_100009814638_100015291786 [0,1,0,0,1,0|1,1,0]=4 5089 B16R2.132 Brc1ccc(nc1)CNc2ccccc2 207a_100000106764_100000754260 [0,1,0,0,1,0|2,0,0]=4 5090 B16R2.132 Brc1ccc(nc1)CNc2ccccc2 270302a_100000106764_100000754260 [0,1,0,0,1,0|2,0,0]=4 5091 B16R2.132 Brc1ccc(nc1)CNc2ccccc2 34a_100000106764_100000702658 [0,1,0,0,1,0|2,0,0]=4 5092 B16R2.132 Brc1ccc(nc1)COc2ccccc2 34a_100000210340_100000702658 [0,1,0,0,1,0|1,0,0]=3 5093 B16R2.132 Brc1ccc(nc1)COc2ccccc2 7a_100000210340_100000702658 [0,1,0,0,1,0|1,0,0]=3 5094 B16R2.132 Brc1ccc(nc1)COc2cccnc2 34a_100000210849_100000702658 [0,1,0,0,1,0|2,0,0]=4 5095 B16R2.132 Brc1ccc(nc1)COc2cccnc2 7a_100000210849_100000702658 [0,1,0,0,1,0|2,0,0]=4 5096 B16R2.132 Brc1ccc(nc1)COc2ccncc2 34a_100000212176_100000702658 [0,1,0,0,1,0|2,0,0]=4 5097 B16R2.132 Brc1ccc(nc1)CSc2ccccc2 62a_100000702658_100000041952 [0,1,0,0,1,0|1,1,0]=4 5098 B16R2.132 Brc1ccc(nc1)CSc2ccccc2 62a_100000719477_100000702658 [0,1,0,0,1,0|1,1,0]=4 5099 B16R2.132 Brc1ccc(nc1)NCc2ccccc2 27a_100015324214_100000686858 [0,1,0,0,1,0|2,0,0]=4 5100 B16R2.132 Brc1ccc(nc1)SCc2ccccc2 62a_100000211182_100000686858 [0,1,0,0,1,0|1,1,0]=4 5101 B16R2.132 Brc1ccc(nc1)SCc2ccccc2 62a_100000686858_100015291786 [0,1,0,0,1,0|1,1,0]=4 5102 B16R2.132 Brc1cnc(cn1)OCc2ccccc2 34a_100011934580_100015291786 [0,1,0,0,1,0|2,0,0]=4 5103 B16R2.132 Brc1cnc(nc1)COc2ccccc2 34a_100000210340_100010064664 [0,1,0,0,1,0|2,0,0]=4 5104 B16R2.132 Brc1cnc(nc1)COc2ccccc2 7a_100000210340_100010064664 [0,1,0,0,1,0|2,0,0]=4 5105 B16R2.132 Brc1ncc(cn1)OCc2ccccc2 34a_100000730009_100015291786 [0,1,0,0,1,0|2,0,0]=4 5106 B16R2.132 Brc1ncc(cn1)OCc2ccccc2 7a_100000730009_100000211182 [0,1,0,0,1,0|2,0,0]=4 5107 B16R2.132 Cc1ccc(cc1)C#Cc2ccccc2 271570a_100000069678_100000186775 [0,1,0,0,1,0|0,0,2]=4 5108 B16R2.132 Cc1ccc(cc1)C=Cc2ccccc2 271570a_100102527694_100000186775 [0,1,0,0,1,0|0,0,2]=4 5109 B16R2.132 Cc1ccc(cc1)C=Cc2ccccc2 271570a_100102527916_100000210277 [0,1,0,0,1,0|0,0,2]=4 5110 B16R2.132 Cc1ccc(cc1)CNc2ccccc2 207a_100000106764_100000211033 [0,1,0,0,1,0|1,0,0]=3 5111 B16R2.132 Cc1ccc(cc1)CNc2ccccc2 270302a_100000106764_100000211033 [0,1,0,0,1,0|1,0,0]=3 5112 B16R2.132 Cc1ccc(cc1)CNc2ccccc2 34a_100000106764_100000210814 [0,1,0,0,1,0|1,0,0]=3 5113 B16R2.132 Cc1ccc(cc1)COc2ccccc2 34a_100000210340_100000210814 [0,1,0,0,1,0|0,0,0]=2 5114 B16R2.132 Cc1ccc(cc1)COc2ccccc2 7a_100000210340_100000210814 [0,1,0,0,1,0|0,0,0]=2 5115 B16R2.132 Cc1ccc(cc1)COc2cccnc2 34a_100000210849_100000210814 [0,1,0,0,1,0|1,0,0]=3 5116 B16R2.132 Cc1ccc(cc1)COc2cccnc2 7a_100000210849_100000210814 [0,1,0,0,1,0|1,0,0]=3 5117 B16R2.132 Cc1ccc(cc1)COc2ccncc2 34a_100000212176_100000210814 [0,1,0,0,1,0|1,0,0]=3 5118 B16R2.132 Cc1ccc(cc1)COc2ccnnc2 34a_100015204005_100000210814 [0,1,0,0,1,0|2,0,0]=4 5119 B16R2.132 Cc1ccc(cc1)COc2cncnc2 7a_100000754086_100000210814 [0,1,0,0,1,0|2,0,0]=4 5120 B16R2.132 Cc1ccc(cc1)CSc2ccccc2 62a_100000210814_100000041952 [0,1,0,0,1,0|0,1,0]=3 5121 B16R2.132 Cc1ccc(cc1)CSc2ccccc2 62a_100000719477_100000210814 [0,1,0,0,1,0|0,1,0]=3 5122 B16R2.132 Cc1ccc(cc1)CSc2ccccn2 62a_100000210814_100011216584 [0,1,0,0,1,0|1,1,0]=4 5123 B16R2.132 Cc1ccc(cc1)CSc2ccccn2 62a_100011216584_100000210814 [0,1,0,0,1,0|1,1,0]=4 5124 B16R2.132 Cc1ccc(cc1)CSc2cccnc2 62a_100000210063_100000210814 [0,1,0,0,1,0|1,1,0]=4 5125 B16R2.132 Cc1ccc(cc1)CSc2cccnc2 62a_100000210814_100000210063 [0,1,0,0,1,0|1,1,0]=4 5126 B16R2.132 Cc1ccc(cc1)CSc2ccncc2 62a_100000210814_100000728582 [0,1,0,0,1,0|1,1,0]=4 5127 B16R2.132 Cc1ccc(cc1)CSc2ccncc2 62a_100000728582_100000210814 [0,1,0,0,1,0|1,1,0]=4 5128 B16R2.132 Cc1ccc(cc1)NCc2ccccc2 207a_100000124888_100015611070 [0,1,0,0,1,0|1,0,0]=3 5129 B16R2.132 Cc1ccc(cc1)NCc2ccccc2 270302a_100000124888_100015611070 [0,1,0,0,1,0|1,0,0]=3 5130 B16R2.132 Cc1ccc(cc1)NCc2ccccc2 34a_100000124888_100015291786 [0,1,0,0,1,0|1,0,0]=3 5131 B16R2.132 Cc1ccc(cc1)NCc2ccccn2 207a_100000124888_100000209966 [0,1,0,0,1,0|2,0,0]=4 5132 B16R2.132 Cc1ccc(cc1)NCc2ccccn2 270302a_100000124888_100000209966 [0,1,0,0,1,0|2,0,0]=4 5133 B16R2.132 Cc1ccc(cc1)NCc2ccccn2 34a_100000124888_100000721315 [0,1,0,0,1,0|2,0,0]=4 5134 B16R2.132 Cc1ccc(cc1)NCc2cccnc2 207a_100000124888_100000209961 [0,1,0,0,1,0|2,0,0]=4 5135 B16R2.132 Cc1ccc(cc1)NCc2cccnc2 270302a_100000124888_100000209961 [0,1,0,0,1,0|2,0,0]=4 5136 B16R2.132 Cc1ccc(cc1)NCc2cccnc2 34a_100000124888_100000733263 [0,1,0,0,1,0|2,0,0]=4 5137 B16R2.132 Cc1ccc(cc1)NCc2ccncc2 207a_100000124888_100000186114 [0,1,0,0,1,0|2,0,0]=4 5138 B16R2.132 Cc1ccc(cc1)OCc2ccccc2 34a_100000210336_100015291786 [0,1,0,0,1,0|0,0,0]=2 5139 B16R2.132 Cc1ccc(cc1)OCc2ccccc2 7a_100000210336_100000211182 [0,1,0,0,1,0|0,0,0]=2 5140 B16R2.132 Cc1ccc(cc1)OCc2ccccn2 34a_100000210336_100000721315 [0,1,0,0,1,0|1,0,0]=3 5141 B16R2.132 Cc1ccc(cc1)OCc2ccccn2 7a_100000210336_100000721315 [0,1,0,0,1,0|1,0,0]=3 5142 B16R2.132 Cc1ccc(cc1)OCc2cccnc2 34a_100000210336_100000733263 [0,1,0,0,1,0|1,0,0]=3 5143 B16R2.132 Cc1ccc(cc1)OCc2cccnc2 7a_100000210336_100000741622 [0,1,0,0,1,0|1,0,0]=3 5144 B16R2.132 Cc1ccc(cc1)OCc2cccnn2 34a_100000210336_100016990269 [0,1,0,0,1,0|2,0,0]=4 5145 B16R2.132 Cc1ccc(cc1)OCc2cccnn2 7a_100000210336_100016990269 [0,1,0,0,1,0|2,0,0]=4 5146 B16R2.132 Cc1ccc(cc1)OCc2ccncc2 7a_100000210336_100015193705 [0,1,0,0,1,0|1,0,0]=3 5147 B16R2.132 Cc1ccc(cc1)OCc2cnccn2 34a_100000210336_100016995436 [0,1,0,0,1,0|2,0,0]=4 5148 B16R2.132 Cc1ccc(cc1)OCc2cnccn2 7a_100000210336_100016995436 [0,1,0,0,1,0|2,0,0]=4 5149 B16R2.132 Cc1ccc(cc1)OCc2cncnc2 34a_100000210336_100015196519 [0,1,0,0,1,0|2,0,0]=4 5150 B16R2.132 Cc1ccc(cc1)OCc2cncnc2 7a_100000210336_100015196519 [0,1,0,0,1,0|2,0,0]=4 5151 B16R2.132 Cc1ccc(cc1)OCc2ncccn2 34a_100000210336_100000703007 [0,1,0,0,1,0|2,0,0]=4 5152 B16R2.132 Cc1ccc(cc1)OCc2ncccn2 7a_100000210336_100000703007 [0,1,0,0,1,0|2,0,0]=4 5153 B16R2.132 Cc1ccc(cc1)SCc2ccccc2 62a_100000186775_100015291786 [0,1,0,0,1,0|0,1,0]=3 5154 B16R2.132 Cc1ccc(cc1)SCc2ccccc2 62a_100000211182_100000186775 [0,1,0,0,1,0|0,1,0]=3 5155 B16R2.132 Cc1ccc(cc1)SCc2ccccn2 62a_100000186775_100000721315 [0,1,0,0,1,0|1,1,0]=4 5156 B16R2.132 Cc1ccc(cc1)SCc2ccccn2 62a_100000721315_100000186775 [0,1,0,0,1,0|1,1,0]=4 5157 B16R2.132 Cc1ccc(cc1)SCc2cccnc2 62a_100000186775_100000741622 [0,1,0,0,1,0|1,1,0]=4 5158 B16R2.132 Cc1ccc(cc1)SCc2cccnc2 62a_100000741622_100000186775 [0,1,0,0,1,0|1,1,0]=4 5159 B16R2.132 Cc1ccc(cc1)SCc2ccncc2 62a_100000186775_100015193705 [0,1,0,0,1,0|1,1,0]=4 5160 B16R2.132 Cc1ccc(cc1)SCc2ccncc2 62a_100015193705_100000186775 [0,1,0,0,1,0|1,1,0]=4 5161 B16R2.132 Cc1ccc(cn1)CNc2ccccc2 270302a_100000106764_100000743784 [0,1,0,0,1,0|2,0,0]=4 5162 B16R2.132 Cc1ccc(cn1)CNc2ccccc2 34a_100000106764_100016987292 [0,1,0,0,1,0|2,0,0]=4 5163 B16R2.132 Cc1ccc(cn1)COc2ccccc2 34a_100000210340_100016987292 [0,1,0,0,1,0|1,0,0]=3 5164 B16R2.132 Cc1ccc(cn1)COc2ccccc2 7a_100000210340_100016987292 [0,1,0,0,1,0|1,0,0]=3 5165 B16R2.132 Cc1ccc(cn1)COc2cccnc2 34a_100000210849_100016987292 [0,1,0,0,1,0|2,0,0]=4 5166 B16R2.132 Cc1ccc(cn1)COc2cccnc2 7a_100000210849_100016987292 [0,1,0,0,1,0|2,0,0]=4 5167 B16R2.132 Cc1ccc(cn1)COc2ccncc2 34a_100000212176_100016987292 [0,1,0,0,1,0|2,0,0]=4 5168 B16R2.132 Cc1ccc(cn1)CSc2ccccc2 62a_100000719477_100016987292 [0,1,0,0,1,0|1,1,0]=4 5169 B16R2.132 Cc1ccc(cn1)CSc2ccccc2 62a_100016987292_100000041952 [0,1,0,0,1,0|1,1,0]=4 5170 B16R2.132 Cc1ccc(cn1)OCc2ccccc2 34a_100000745506_100015291786 [0,1,0,0,1,0|1,0,0]=3 5171 B16R2.132 Cc1ccc(cn1)OCc2ccccc2 7a_100000745506_100000211182 [0,1,0,0,1,0|1,0,0]=3 5172 B16R2.132 Cc1ccc(cn1)OCc2ccccn2 34a_100000745506_100000721315 [0,1,0,0,1,0|2,0,0]=4 5173 B16R2.132 Cc1ccc(cn1)OCc2ccccn2 7a_100000745506_100000721315 [0,1,0,0,1,0|2,0,0]=4 5174 B16R2.132 Cc1ccc(cn1)OCc2cccnc2 34a_100000745506_100000733263 [0,1,0,0,1,0|2,0,0]=4 5175 B16R2.132 Cc1ccc(cn1)OCc2cccnc2 7a_100000745506_100000741622 [0,1,0,0,1,0|2,0,0]=4 5176 B16R2.132 Cc1ccc(cn1)OCc2ccncc2 7a_100000745506_100015193705 [0,1,0,0,1,0|2,0,0]=4 5177 B16R2.132 Cc1ccc(cn1)SCc2ccccc2 62a_100000211182_100000751577 [0,1,0,0,1,0|1,1,0]=4 5178 B16R2.132 Cc1ccc(cn1)SCc2ccccc2 62a_100000751577_100015291786 [0,1,0,0,1,0|1,1,0]=4 5179 B16R2.132 Cc1ccc(nc1)CNc2ccccc2 207a_100000106764_100000050478 [0,1,0,0,1,0|2,0,0]=4 5180 B16R2.132 Cc1ccc(nc1)CNc2ccccc2 34a_100000106764_100000691093 [0,1,0,0,1,0|2,0,0]=4 5181 B16R2.132 Cc1ccc(nc1)COc2ccccc2 34a_100000210340_100000691093 [0,1,0,0,1,0|1,0,0]=3 5182 B16R2.132 Cc1ccc(nc1)COc2ccccc2 7a_100000210340_100000691093 [0,1,0,0,1,0|1,0,0]=3 5183 B16R2.132 Cc1ccc(nc1)COc2cccnc2 34a_100000210849_100000691093 [0,1,0,0,1,0|2,0,0]=4 5184 B16R2.132 Cc1ccc(nc1)COc2cccnc2 7a_100000210849_100000691093 [0,1,0,0,1,0|2,0,0]=4 5185 B16R2.132 Cc1ccc(nc1)COc2ccncc2 34a_100000212176_100000691093 [0,1,0,0,1,0|2,0,0]=4 5186 B16R2.132 Cc1ccc(nc1)CSc2ccccc2 62a_100000691093_100000041952 [0,1,0,0,1,0|1,1,0]=4 5187 B16R2.132 Cc1ccc(nc1)CSc2ccccc2 62a_100000719477_100000691093 [0,1,0,0,1,0|1,1,0]=4 5188 B16R2.132 Cc1ccc(nc1)OCc2ccccc2 34a_100000759353_100015291786 [0,1,0,0,1,0|1,0,0]=3 5189 B16R2.132 Cc1ccc(nc1)OCc2ccccn2 34a_100000759353_100000721315 [0,1,0,0,1,0|2,0,0]=4 5190 B16R2.132 Cc1ccc(nc1)OCc2cccnc2 34a_100000759353_100000733263 [0,1,0,0,1,0|2,0,0]=4 5191 B16R2.132 Cc1ccc(nc1)SCc2ccccc2 62a_100000211182_100000754016 [0,1,0,0,1,0|1,1,0]=4 5192 B16R2.132 Cc1ccc(nc1)SCc2ccccc2 62a_100011192072_100015291786 [0,1,0,0,1,0|1,1,0]=4 5193 B16R2.132 Cc1cnc(cn1)COc2ccccc2 7a_100000210340_100000752025 [0,1,0,0,1,0|2,0,0]=4 5194 B16R2.132 Cc1cnc(nc1)COc2ccccc2 34a_100000210340_100000685645 [0,1,0,0,1,0|2,0,0]=4 5195 B16R2.132 Cc1cnc(nc1)COc2ccccc2 7a_100000210340_100000685645 [0,1,0,0,1,0|2,0,0]=4 5196 B16R2.132 Cc1ncc(cn1)OCc2ccccc2 34a_100000062939_100015291786 [0,1,0,0,1,0|2,0,0]=4 5197 B16R2.132 Cc1ncc(cn1)OCc2ccccc2 7a_100000062939_100000211182 [0,1,0,0,1,0|2,0,0]=4 5198 B16R2.132 Clc1ccc(cc1)C#Cc2ccccc2 271570a_100000069678_100000755918 [0,1,0,0,1,0|0,0,2]=4 5199 B16R2.132 Clc1ccc(cc1)C=Cc2ccccc2 271570a_100102527694_100000755918 [0,1,0,0,1,0|0,0,2]=4 5200 B16R2.132 Clc1ccc(cc1)C=Cc2ccccc2 271570a_100102527930_100000210277 [0,1,0,0,1,0|0,0,2]=4 5201 B16R2.132 Clc1ccc(cc1)CNc2ccccc2 207a_100000106764_100000189385 [0,1,0,0,1,0|1,0,0]=3 5202 B16R2.132 Clc1ccc(cc1)CNc2ccccc2 270302a_100000106764_100000189385 [0,1,0,0,1,0|1,0,0]=3 5203 B16R2.132 Clc1ccc(cc1)CNc2ccccc2 34a_100000106764_100000694040 [0,1,0,0,1,0|1,0,0]=3 5204 B16R2.132 Clc1ccc(cc1)COc2ccccc2 34a_100000210340_100000694040 [0,1,0,0,1,0|0,0,0]=2 5205 B16R2.132 Clc1ccc(cc1)COc2ccccc2 7a_100000210340_100000187161 [0,1,0,0,1,0|0,0,0]=2 5206 B16R2.132 Clc1ccc(cc1)COc2cccnc2 34a_100000210849_100000694040 [0,1,0,0,1,0|1,0,0]=3 5207 B16R2.132 Clc1ccc(cc1)COc2cccnc2 7a_100000210849_100000187161 [0,1,0,0,1,0|1,0,0]=3 5208 B16R2.132 Clc1ccc(cc1)COc2ccncc2 34a_100000212176_100000694040 [0,1,0,0,1,0|1,0,0]=3 5209 B16R2.132 Clc1ccc(cc1)COc2ccnnc2 34a_100015204005_100000694040 [0,1,0,0,1,0|2,0,0]=4 5210 B16R2.132 Clc1ccc(cc1)COc2cncnc2 7a_100000754086_100000187161 [0,1,0,0,1,0|2,0,0]=4 5211 B16R2.132 Clc1ccc(cc1)CSc2ccccc2 62a_100000187161_100000041952 [0,1,0,0,1,0|0,1,0]=3 5212 B16R2.132 Clc1ccc(cc1)CSc2ccccc2 62a_100000719477_100000187161 [0,1,0,0,1,0|0,1,0]=3 5213 B16R2.132 Clc1ccc(cc1)CSc2ccccn2 62a_100000187161_100011216584 [0,1,0,0,1,0|1,1,0]=4 5214 B16R2.132 Clc1ccc(cc1)CSc2ccccn2 62a_100011216584_100000187161 [0,1,0,0,1,0|1,1,0]=4 5215 B16R2.132 Clc1ccc(cc1)CSc2cccnc2 62a_100000187161_100000210063 [0,1,0,0,1,0|1,1,0]=4 5216 B16R2.132 Clc1ccc(cc1)CSc2cccnc2 62a_100000210063_100000187161 [0,1,0,0,1,0|1,1,0]=4 5217 B16R2.132 Clc1ccc(cc1)CSc2ccncc2 62a_100000187161_100000728582 [0,1,0,0,1,0|1,1,0]=4 5218 B16R2.132 Clc1ccc(cc1)CSc2ccncc2 62a_100000728582_100000187161 [0,1,0,0,1,0|1,1,0]=4 5219 B16R2.132 Clc1ccc(cc1)NCc2ccccc2 207a_100000210052_100015611070 [0,1,0,0,1,0|1,0,0]=3 5220 B16R2.132 Clc1ccc(cc1)NCc2ccccc2 2230a_100000210052_100015291786 [0,1,0,0,1,0|1,0,0]=3 5221 B16R2.132 Clc1ccc(cc1)NCc2ccccc2 270302a_100000210052_100015611070 [0,1,0,0,1,0|1,0,0]=3 5222 B16R2.132 Clc1ccc(cc1)NCc2ccccc2 34a_100000210052_100015291786 [0,1,0,0,1,0|1,0,0]=3 5223 B16R2.132 Clc1ccc(cc1)NCc2ccccn2 207a_100000210052_100000209966 [0,1,0,0,1,0|2,0,0]=4 5224 B16R2.132 Clc1ccc(cc1)NCc2ccccn2 2230a_100000210052_100000721315 [0,1,0,0,1,0|2,0,0]=4 5225 B16R2.132 Clc1ccc(cc1)NCc2ccccn2 270302a_100000210052_100000209966 [0,1,0,0,1,0|2,0,0]=4 5226 B16R2.132 Clc1ccc(cc1)NCc2ccccn2 34a_100000210052_100000721315 [0,1,0,0,1,0|2,0,0]=4 5227 B16R2.132 Clc1ccc(cc1)NCc2cccnc2 207a_100000210052_100000209961 [0,1,0,0,1,0|2,0,0]=4 5228 B16R2.132 Clc1ccc(cc1)NCc2cccnc2 2230a_100000210052_100000741622 [0,1,0,0,1,0|2,0,0]=4 5229 B16R2.132 Clc1ccc(cc1)NCc2cccnc2 270302a_100000210052_100000209961 [0,1,0,0,1,0|2,0,0]=4 5230 B16R2.132 Clc1ccc(cc1)NCc2cccnc2 34a_100000210052_100000733263 [0,1,0,0,1,0|2,0,0]=4 5231 B16R2.132 Clc1ccc(cc1)NCc2ccncc2 207a_100000210052_100000186114 [0,1,0,0,1,0|2,0,0]=4 5232 B16R2.132 Clc1ccc(cc1)NCc2ccncc2 2230a_100000210052_100015193705 [0,1,0,0,1,0|2,0,0]=4 5233 B16R2.132 Clc1ccc(cc1)OCc2ccccc2 34a_100000210216_100015291786 [0,1,0,0,1,0|0,0,0]=2 5234 B16R2.132 Clc1ccc(cc1)OCc2ccccc2 7a_100000210216_100000211182 [0,1,0,0,1,0|0,0,0]=2 5235 B16R2.132 Clc1ccc(cc1)OCc2ccccn2 34a_100000210216_100000721315 [0,1,0,0,1,0|1,0,0]=3 5236 B16R2.132 Clc1ccc(cc1)OCc2ccccn2 7a_100000210216_100000721315 [0,1,0,0,1,0|1,0,0]=3 5237 B16R2.132 Clc1ccc(cc1)OCc2cccnc2 34a_100000210216_100000733263 [0,1,0,0,1,0|1,0,0]=3 5238 B16R2.132 Clc1ccc(cc1)OCc2cccnc2 7a_100000210216_100000741622 [0,1,0,0,1,0|1,0,0]=3 5239 B16R2.132 Clc1ccc(cc1)OCc2cccnn2 34a_100000210216_100016990269 [0,1,0,0,1,0|2,0,0]=4 5240 B16R2.132 Clc1ccc(cc1)OCc2cccnn2 7a_100000210216_100016990269 [0,1,0,0,1,0|2,0,0]=4 5241 B16R2.132 Clc1ccc(cc1)OCc2ccncc2 7a_100000210216_100015193705 [0,1,0,0,1,0|1,0,0]=3 5242 B16R2.132 Clc1ccc(cc1)OCc2cnccn2 34a_100000210216_100016995436 [0,1,0,0,1,0|2,0,0]=4 5243 B16R2.132 Clc1ccc(cc1)OCc2cnccn2 7a_100000210216_100016995436 [0,1,0,0,1,0|2,0,0]=4 5244 B16R2.132 Clc1ccc(cc1)OCc2cncnc2 34a_100000210216_100015196519 [0,1,0,0,1,0|2,0,0]=4 5245 B16R2.132 Clc1ccc(cc1)OCc2cncnc2 7a_100000210216_100015196519 [0,1,0,0,1,0|2,0,0]=4 5246 B16R2.132 Clc1ccc(cc1)OCc2ncccn2 34a_100000210216_100000703007 [0,1,0,0,1,0|2,0,0]=4 5247 B16R2.132 Clc1ccc(cc1)OCc2ncccn2 7a_100000210216_100000703007 [0,1,0,0,1,0|2,0,0]=4 5248 B16R2.132 Clc1ccc(cc1)SCc2ccccc2 62a_100000211182_100000755918 [0,1,0,0,1,0|0,1,0]=3 5249 B16R2.132 Clc1ccc(cc1)SCc2ccccc2 62a_100000755918_100015291786 [0,1,0,0,1,0|0,1,0]=3 5250 B16R2.132 Clc1ccc(cc1)SCc2ccccn2 62a_100000721315_100000755918 [0,1,0,0,1,0|1,1,0]=4 5251 B16R2.132 Clc1ccc(cc1)SCc2ccccn2 62a_100000755918_100000721315 [0,1,0,0,1,0|1,1,0]=4 5252 B16R2.132 Clc1ccc(cc1)SCc2cccnc2 62a_100000741622_100000755918 [0,1,0,0,1,0|1,1,0]=4 5253 B16R2.132 Clc1ccc(cc1)SCc2cccnc2 62a_100000755918_100000741622 [0,1,0,0,1,0|1,1,0]=4 5254 B16R2.132 Clc1ccc(cc1)SCc2ccncc2 62a_100000755918_100015193705 [0,1,0,0,1,0|1,1,0]=4 5255 B16R2.132 Clc1ccc(cc1)SCc2ccncc2 62a_100015193705_100000755918 [0,1,0,0,1,0|1,1,0]=4 5256 B16R2.132 Clc1ccc(cn1)CNc2ccccc2 270302a_100000106764_100000766901 [0,1,0,0,1,0|2,0,0]=4 5257 B16R2.132 Clc1ccc(cn1)CNc2ccccc2 34a_100000106764_100000735431 [0,1,0,0,1,0|2,0,0]=4 5258 B16R2.132 Clc1ccc(cn1)COc2ccccc2 34a_100000210340_100000735431 [0,1,0,0,1,0|1,0,0]=3 5259 B16R2.132 Clc1ccc(cn1)COc2ccccc2 7a_100000210340_100000735431 [0,1,0,0,1,0|1,0,0]=3 5260 B16R2.132 Clc1ccc(cn1)COc2cccnc2 34a_100000210849_100000735431 [0,1,0,0,1,0|2,0,0]=4 5261 B16R2.132 Clc1ccc(cn1)COc2cccnc2 7a_100000210849_100000735431 [0,1,0,0,1,0|2,0,0]=4 5262 B16R2.132 Clc1ccc(cn1)COc2ccncc2 34a_100000212176_100000735431 [0,1,0,0,1,0|2,0,0]=4 5263 B16R2.132 Clc1ccc(cn1)CSc2ccccc2 62a_100000719477_100000735431 [0,1,0,0,1,0|1,1,0]=4 5264 B16R2.132 Clc1ccc(cn1)CSc2ccccc2 62a_100000735431_100000041952 [0,1,0,0,1,0|1,1,0]=4 5265 B16R2.132 Clc1ccc(cn1)OCc2ccccc2 34a_100000744096_100015291786 [0,1,0,0,1,0|1,0,0]=3 5266 B16R2.132 Clc1ccc(cn1)OCc2ccccc2 7a_100000744096_100000211182 [0,1,0,0,1,0|1,0,0]=3 5267 B16R2.132 Clc1ccc(cn1)OCc2ccccn2 34a_100000744096_100000721315 [0,1,0,0,1,0|2,0,0]=4 5268 B16R2.132 Clc1ccc(cn1)OCc2ccccn2 7a_100000744096_100000721315 [0,1,0,0,1,0|2,0,0]=4 5269 B16R2.132 Clc1ccc(cn1)OCc2cccnc2 34a_100000744096_100000733263 [0,1,0,0,1,0|2,0,0]=4 5270 B16R2.132 Clc1ccc(cn1)OCc2cccnc2 7a_100000744096_100000741622 [0,1,0,0,1,0|2,0,0]=4 5271 B16R2.132 Clc1ccc(cn1)OCc2ccncc2 7a_100000744096_100015193705 [0,1,0,0,1,0|2,0,0]=4 5272 B16R2.132 Clc1ccc(cn1)SCc2ccccc2 62a_100000034144_100015291786 [0,1,0,0,1,0|1,1,0]=4 5273 B16R2.132 Clc1ccc(cn1)SCc2ccccc2 62a_100000211182_100000034144 [0,1,0,0,1,0|1,1,0]=4 5274 B16R2.132 Clc1ccc(nc1)CNc2ccccc2 207a_100000106764_100011361569 [0,1,0,0,1,0|2,0,0]=4 5275 B16R2.132 Clc1ccc(nc1)CNc2ccccc2 270302a_100000106764_100011361569 [0,1,0,0,1,0|2,0,0]=4 5276 B16R2.132 Clc1ccc(nc1)CNc2ccccc2 34a_100000106764_100012066911 [0,1,0,0,1,0|2,0,0]=4 5277 B16R2.132 Clc1ccc(nc1)COc2ccccc2 34a_100000210340_100012066911 [0,1,0,0,1,0|1,0,0]=3 5278 B16R2.132 Clc1ccc(nc1)COc2ccccc2 7a_100000210340_100012066911 [0,1,0,0,1,0|1,0,0]=3 5279 B16R2.132 Clc1ccc(nc1)COc2cccnc2 34a_100000210849_100012066911 [0,1,0,0,1,0|2,0,0]=4 5280 B16R2.132 Clc1ccc(nc1)COc2cccnc2 7a_100000210849_100012066911 [0,1,0,0,1,0|2,0,0]=4 5281 B16R2.132 Clc1ccc(nc1)COc2ccncc2 34a_100000212176_100012066911 [0,1,0,0,1,0|2,0,0]=4 5282 B16R2.132 Clc1ccc(nc1)CSc2ccccc2 62a_100000719477_100000697101 [0,1,0,0,1,0|1,1,0]=4 5283 B16R2.132 Clc1ccc(nc1)CSc2ccccc2 62a_100012066911_100000041952 [0,1,0,0,1,0|1,1,0]=4 5284 B16R2.132 Clc1ccc(nc1)OCc2ccccc2 34a_100011215309_100015291786 [0,1,0,0,1,0|1,0,0]=3 5285 B16R2.132 Clc1ccc(nc1)OCc2ccccn2 34a_100011215309_100000721315 [0,1,0,0,1,0|2,0,0]=4 5286 B16R2.132 Clc1ccc(nc1)OCc2cccnc2 34a_100011215309_100000733263 [0,1,0,0,1,0|2,0,0]=4 5287 B16R2.132 Clc1ccc(nc1)SCc2ccccc2 62a_100000211182_100011356976 [0,1,0,0,1,0|1,1,0]=4 5288 B16R2.132 Clc1ccc(nc1)SCc2ccccc2 62a_100011356976_100015291786 [0,1,0,0,1,0|1,1,0]=4 5289 B16R2.132 Clc1ccc(nn1)COc2ccccc2 34a_100000210340_100016992710 [0,1,0,0,1,0|2,0,0]=4 5290 B16R2.132 Clc1ccc(nn1)COc2ccccc2 7a_100000210340_100016992710 [0,1,0,0,1,0|2,0,0]=4 5291 B16R2.132 Clc1cnc(cn1)OCc2ccccc2 34a_100015839800_100015291786 [0,1,0,0,1,0|2,0,0]=4 5292 B16R2.132 Clc1ncc(cn1)OCc2ccccc2 34a_100000092845_100015291786 [0,1,0,0,1,0|2,0,0]=4 5293 B16R2.132 Clc1ncc(cn1)OCc2ccccc2 7a_100000092845_100000211182 [0,1,0,0,1,0|2,0,0]=4 5294 B16R2.132 Fc1ccc(cc1)C#Cc2ccccc2 271570a_100000069678_100000211213 [0,1,0,0,1,0|0,0,2]=4 5295 B16R2.132 Fc1ccc(cc1)C=Cc2ccccc2 271570a_100102525539_100000210277 [0,1,0,0,1,0|0,0,2]=4 5296 B16R2.132 Fc1ccc(cc1)C=Cc2ccccc2 271570a_100102527694_100000211213 [0,1,0,0,1,0|0,0,2]=4 5297 B16R2.132 Fc1ccc(cc1)CNc2ccccc2 207a_100000106764_100000210084 [0,1,0,0,1,0|1,0,0]=3 5298 B16R2.132 Fc1ccc(cc1)CNc2ccccc2 270302a_100000106764_100000210084 [0,1,0,0,1,0|1,0,0]=3 5299 B16R2.132 Fc1ccc(cc1)CNc2ccccc2 34a_100000106764_100000198546 [0,1,0,0,1,0|1,0,0]=3 5300 B16R2.132 Fc1ccc(cc1)COc2ccccc2 34a_100000210340_100000198546 [0,1,0,0,1,0|0,0,0]=2 5301 B16R2.132 Fc1ccc(cc1)COc2ccccc2 7a_100000210340_100000198546 [0,1,0,0,1,0|0,0,0]=2 5302 B16R2.132 Fc1ccc(cc1)COc2cccnc2 34a_100000210849_100000198546 [0,1,0,0,1,0|1,0,0]=3 5303 B16R2.132 Fc1ccc(cc1)COc2cccnc2 7a_100000210849_100000198546 [0,1,0,0,1,0|1,0,0]=3 5304 B16R2.132 Fc1ccc(cc1)COc2ccncc2 34a_100000212176_100000198546 [0,1,0,0,1,0|1,0,0]=3 5305 B16R2.132 Fc1ccc(cc1)COc2ccnnc2 34a_100015204005_100000198546 [0,1,0,0,1,0|2,0,0]=4 5306 B16R2.132 Fc1ccc(cc1)COc2cncnc2 7a_100000754086_100000198546 [0,1,0,0,1,0|2,0,0]=4 5307 B16R2.132 Fc1ccc(cc1)CSc2ccccc2 62a_100000198546_100000041952 [0,1,0,0,1,0|0,1,0]=3 5308 B16R2.132 Fc1ccc(cc1)CSc2ccccc2 62a_100000719477_100000187164 [0,1,0,0,1,0|0,1,0]=3 5309 B16R2.132 Fc1ccc(cc1)CSc2ccccn2 62a_100000198546_100011216584 [0,1,0,0,1,0|1,1,0]=4 5310 B16R2.132 Fc1ccc(cc1)CSc2ccccn2 62a_100011216584_100000187164 [0,1,0,0,1,0|1,1,0]=4 5311 B16R2.132 Fc1ccc(cc1)CSc2cccnc2 62a_100000198546_100000210063 [0,1,0,0,1,0|1,1,0]=4 5312 B16R2.132 Fc1ccc(cc1)CSc2cccnc2 62a_100000210063_100000187164 [0,1,0,0,1,0|1,1,0]=4 5313 B16R2.132 Fc1ccc(cc1)CSc2ccncc2 62a_100000198546_100000728582 [0,1,0,0,1,0|1,1,0]=4 5314 B16R2.132 Fc1ccc(cc1)CSc2ccncc2 62a_100000728582_100000187164 [0,1,0,0,1,0|1,1,0]=4 5315 B16R2.132 Fc1ccc(cc1)NCc2ccccc2 207a_100000185862_100015611070 [0,1,0,0,1,0|1,0,0]=3 5316 B16R2.132 Fc1ccc(cc1)NCc2ccccc2 270302a_100000185862_100015611070 [0,1,0,0,1,0|1,0,0]=3 5317 B16R2.132 Fc1ccc(cc1)NCc2ccccc2 34a_100000185862_100015291786 [0,1,0,0,1,0|1,0,0]=3 5318 B16R2.132 Fc1ccc(cc1)NCc2ccccn2 207a_100000185862_100000209966 [0,1,0,0,1,0|2,0,0]=4 5319 B16R2.132 Fc1ccc(cc1)NCc2ccccn2 270302a_100000185862_100000209966 [0,1,0,0,1,0|2,0,0]=4 5320 B16R2.132 Fc1ccc(cc1)NCc2ccccn2 34a_100000185862_100000721315 [0,1,0,0,1,0|2,0,0]=4 5321 B16R2.132 Fc1ccc(cc1)NCc2cccnc2 207a_100000185862_100000209961 [0,1,0,0,1,0|2,0,0]=4 5322 B16R2.132 Fc1ccc(cc1)NCc2cccnc2 270302a_100000185862_100000209961 [0,1,0,0,1,0|2,0,0]=4 5323 B16R2.132 Fc1ccc(cc1)NCc2cccnc2 34a_100000185862_100000733263 [0,1,0,0,1,0|2,0,0]=4 5324 B16R2.132 Fc1ccc(cc1)NCc2ccncc2 207a_100000185862_100000186114 [0,1,0,0,1,0|2,0,0]=4 5325 B16R2.132 Fc1ccc(cc1)OCc2ccccc2 34a_100000210339_100015291786 [0,1,0,0,1,0|0,0,0]=2 5326 B16R2.132 Fc1ccc(cc1)OCc2ccccn2 34a_100000210339_100000721315 [0,1,0,0,1,0|1,0,0]=3 5327 B16R2.132 Fc1ccc(cc1)OCc2cccnc2 34a_100000210339_100000733263 [0,1,0,0,1,0|1,0,0]=3 5328 B16R2.132 Fc1ccc(cc1)OCc2cccnn2 34a_100000210339_100016990269 [0,1,0,0,1,0|2,0,0]=4 5329 B16R2.132 Fc1ccc(cc1)OCc2cnccn2 34a_100000210339_100016995436 [0,1,0,0,1,0|2,0,0]=4 5330 B16R2.132 Fc1ccc(cc1)OCc2cncnc2 34a_100000210339_100015196519 [0,1,0,0,1,0|2,0,0]=4 5331 B16R2.132 Fc1ccc(cc1)OCc2ncccn2 34a_100000210339_100000703007 [0,1,0,0,1,0|2,0,0]=4 5332 B16R2.132 Fc1ccc(cc1)SCc2ccccc2 62a_100000211182_100000211213 [0,1,0,0,1,0|0,1,0]=3 5333 B16R2.132 Fc1ccc(cc1)SCc2ccccc2 62a_100000211213_100015291786 [0,1,0,0,1,0|0,1,0]=3 5334 B16R2.132 Fc1ccc(cc1)SCc2ccccn2 62a_100000211213_100000721315 [0,1,0,0,1,0|1,1,0]=4 5335 B16R2.132 Fc1ccc(cc1)SCc2ccccn2 62a_100000721315_100000211213 [0,1,0,0,1,0|1,1,0]=4 5336 B16R2.132 Fc1ccc(cc1)SCc2cccnc2 62a_100000211213_100000741622 [0,1,0,0,1,0|1,1,0]=4 5337 B16R2.132 Fc1ccc(cc1)SCc2cccnc2 62a_100000741622_100000211213 [0,1,0,0,1,0|1,1,0]=4 5338 B16R2.132 Fc1ccc(cc1)SCc2ccncc2 62a_100000211213_100015193705 [0,1,0,0,1,0|1,1,0]=4 5339 B16R2.132 Fc1ccc(cc1)SCc2ccncc2 62a_100015193705_100000211213 [0,1,0,0,1,0|1,1,0]=4 5340 B16R2.132 Fc1ccc(cn1)CNc2ccccc2 270302a_100000106764_100000068566 [0,1,0,0,1,0|2,0,0]=4 5341 B16R2.132 Fc1ccc(cn1)CNc2ccccc2 34a_100000106764_100000099788 [0,1,0,0,1,0|2,0,0]=4 5342 B16R2.132 Fc1ccc(cn1)COc2ccccc2 34a_100000210340_100000099788 [0,1,0,0,1,0|1,0,0]=3 5343 B16R2.132 Fc1ccc(cn1)COc2ccccc2 7a_100000210340_100009820150 [0,1,0,0,1,0|1,0,0]=3 5344 B16R2.132 Fc1ccc(cn1)COc2cccnc2 34a_100000210849_100000099788 [0,1,0,0,1,0|2,0,0]=4 5345 B16R2.132 Fc1ccc(cn1)COc2cccnc2 7a_100000210849_100009820150 [0,1,0,0,1,0|2,0,0]=4 5346 B16R2.132 Fc1ccc(cn1)COc2ccncc2 34a_100000212176_100000099788 [0,1,0,0,1,0|2,0,0]=4 5347 B16R2.132 Fc1ccc(cn1)CSc2ccccc2 62a_100000719477_100000099788 [0,1,0,0,1,0|1,1,0]=4 5348 B16R2.132 Fc1ccc(cn1)CSc2ccccc2 62a_100009820150_100000041952 [0,1,0,0,1,0|1,1,0]=4 5349 B16R2.132 Fc1ccc(cn1)OCc2ccccc2 34a_100000688820_100015291786 [0,1,0,0,1,0|1,0,0]=3 5350 B16R2.132 Fc1ccc(cn1)OCc2ccccc2 7a_100000688820_100000211182 [0,1,0,0,1,0|1,0,0]=3 5351 B16R2.132 Fc1ccc(cn1)OCc2ccccn2 34a_100000688820_100000721315 [0,1,0,0,1,0|2,0,0]=4 5352 B16R2.132 Fc1ccc(cn1)OCc2ccccn2 7a_100000688820_100000721315 [0,1,0,0,1,0|2,0,0]=4 5353 B16R2.132 Fc1ccc(cn1)OCc2cccnc2 34a_100000688820_100000733263 [0,1,0,0,1,0|2,0,0]=4 5354 B16R2.132 Fc1ccc(cn1)OCc2cccnc2 7a_100000688820_100000741622 [0,1,0,0,1,0|2,0,0]=4 5355 B16R2.132 Fc1ccc(cn1)OCc2ccncc2 7a_100000688820_100015193705 [0,1,0,0,1,0|2,0,0]=4 5356 B16R2.132 Fc1ccc(cn1)SCc2ccccc2 62a_100000042367_100015291786 [0,1,0,0,1,0|1,1,0]=4 5357 B16R2.132 Fc1ccc(cn1)SCc2ccccc2 62a_100000211182_100000042367 [0,1,0,0,1,0|1,1,0]=4 5358 B16R2.132 Fc1ccc(nc1)CNc2ccccc2 207a_100000106764_100011934744 [0,1,0,0,1,0|2,0,0]=4 5359 B16R2.132 Fc1ccc(nc1)CNc2ccccc2 34a_100000106764_100000703193 [0,1,0,0,1,0|2,0,0]=4 5360 B16R2.132 Fc1ccc(nc1)COc2ccccc2 34a_100000210340_100000703193 [0,1,0,0,1,0|1,0,0]=3 5361 B16R2.132 Fc1ccc(nc1)COc2ccccc2 7a_100000210340_100000703193 [0,1,0,0,1,0|1,0,0]=3 5362 B16R2.132 Fc1ccc(nc1)COc2cccnc2 34a_100000210849_100000703193 [0,1,0,0,1,0|2,0,0]=4 5363 B16R2.132 Fc1ccc(nc1)COc2cccnc2 7a_100000210849_100000703193 [0,1,0,0,1,0|2,0,0]=4 5364 B16R2.132 Fc1ccc(nc1)COc2ccncc2 34a_100000212176_100000703193 [0,1,0,0,1,0|2,0,0]=4 5365 B16R2.132 Fc1ccc(nc1)CSc2ccccc2 62a_100000703193_100000041952 [0,1,0,0,1,0|1,1,0]=4 5366 B16R2.132 Fc1ccc(nc1)CSc2ccccc2 62a_100000719477_100000703193 [0,1,0,0,1,0|1,1,0]=4 5367 B16R2.132 Fc1ccc(nc1)OCc2ccccc2 34a_100000742473_100015291786 [0,1,0,0,1,0|1,0,0]=3 5368 B16R2.132 Fc1ccc(nc1)OCc2ccccn2 34a_100000742473_100000721315 [0,1,0,0,1,0|2,0,0]=4 5369 B16R2.132 Fc1ccc(nc1)OCc2cccnc2 34a_100000742473_100000733263 [0,1,0,0,1,0|2,0,0]=4 5370 B16R2.132 Fc1ccc(nc1)SCc2ccccc2 62a_100000211182_100000744514 [0,1,0,0,1,0|1,1,0]=4 5371 B16R2.132 Fc1ccc(nc1)SCc2ccccc2 62a_100000744514_100015291786 [0,1,0,0,1,0|1,1,0]=4 5372 B16R2.132 Fc1cnc(nc1)OCc2ccccc2 34a_100011934040_100015291786 [0,1,0,0,1,0|2,0,0]=4 5373 B16R2.132 Fc1ncc(cn1)OCc2ccccc2 34a_200009874573_100015291786 [0,1,0,0,1,0|2,0,0]=4 5374 B16R2.132 Fc1ncc(cn1)OCc2ccccc2 7a_200009874573_100000211182 [0,1,0,0,1,0|2,0,0]=4 5375 B16R2.132 Ic1ccc(cc1)CNc2ccccc2 207a_100000106764_100000188517 [0,1,0,0,1,0|1,0,0]=3 5376 B16R2.132 Ic1ccc(cc1)CNc2ccccc2 270302a_100000106764_100000188517 [0,1,0,0,1,0|1,0,0]=3 5377 B16R2.132 Ic1ccc(cc1)CNc2ccccc2 34a_100000106764_100000189116 [0,1,0,0,1,0|1,0,0]=3 5378 B16R2.132 Ic1ccc(cc1)COc2ccccc2 34a_100000210340_100000189116 [0,1,0,0,1,0|0,0,0]=2 5379 B16R2.132 Ic1ccc(cc1)COc2ccccc2 7a_100000210340_100000189116 [0,1,0,0,1,0|0,0,0]=2 5380 B16R2.132 Ic1ccc(cc1)COc2cccnc2 34a_100000210849_100000189116 [0,1,0,0,1,0|1,0,0]=3 5381 B16R2.132 Ic1ccc(cc1)COc2cccnc2 7a_100000210849_100000189116 [0,1,0,0,1,0|1,0,0]=3 5382 B16R2.132 Ic1ccc(cc1)COc2ccncc2 34a_100000212176_100000189116 [0,1,0,0,1,0|1,0,0]=3 5383 B16R2.132 Ic1ccc(cc1)COc2ccnnc2 34a_100015204005_100000189116 [0,1,0,0,1,0|2,0,0]=4 5384 B16R2.132 Ic1ccc(cc1)COc2cncnc2 7a_100000754086_100000189116 [0,1,0,0,1,0|2,0,0]=4 5385 B16R2.132 Ic1ccc(cc1)CSc2ccccc2 62a_100000189116_100000041952 [0,1,0,0,1,0|0,1,0]=3 5386 B16R2.132 Ic1ccc(cc1)CSc2ccccc2 62a_100000719477_100000189116 [0,1,0,0,1,0|0,1,0]=3 5387 B16R2.132 Ic1ccc(cc1)CSc2ccccn2 62a_100000189116_100011216584 [0,1,0,0,1,0|1,1,0]=4 5388 B16R2.132 Ic1ccc(cc1)CSc2ccccn2 62a_100011216584_100000189116 [0,1,0,0,1,0|1,1,0]=4 5389 B16R2.132 Ic1ccc(cc1)CSc2cccnc2 62a_100000189116_100000210063 [0,1,0,0,1,0|1,1,0]=4 5390 B16R2.132 Ic1ccc(cc1)CSc2cccnc2 62a_100000210063_100000189116 [0,1,0,0,1,0|1,1,0]=4 5391 B16R2.132 Ic1ccc(cc1)CSc2ccncc2 62a_100000189116_100000728582 [0,1,0,0,1,0|1,1,0]=4 5392 B16R2.132 Ic1ccc(cc1)CSc2ccncc2 62a_100000728582_100000189116 [0,1,0,0,1,0|1,1,0]=4 5393 B16R2.132 Ic1ccc(cc1)NCc2ccccc2 207a_100000185761_100015611070 [0,1,0,0,1,0|1,0,0]=3 5394 B16R2.132 Ic1ccc(cc1)NCc2ccccc2 270302a_100000185761_100015611070 [0,1,0,0,1,0|1,0,0]=3 5395 B16R2.132 Ic1ccc(cc1)NCc2ccccc2 34a_100000185761_100015291786 [0,1,0,0,1,0|1,0,0]=3 5396 B16R2.132 Ic1ccc(cc1)NCc2ccccn2 207a_100000185761_100000209966 [0,1,0,0,1,0|2,0,0]=4 5397 B16R2.132 Ic1ccc(cc1)NCc2ccccn2 270302a_100000185761_100000209966 [0,1,0,0,1,0|2,0,0]=4 5398 B16R2.132 Ic1ccc(cc1)NCc2ccccn2 34a_100000185761_100000721315 [0,1,0,0,1,0|2,0,0]=4 5399 B16R2.132 Ic1ccc(cc1)NCc2cccnc2 207a_100000185761_100000209961 [0,1,0,0,1,0|2,0,0]=4 5400 B16R2.132 Ic1ccc(cc1)NCc2cccnc2 270302a_100000185761_100000209961 [0,1,0,0,1,0|2,0,0]=4 5401 B16R2.132 Ic1ccc(cc1)NCc2cccnc2 34a_100000185761_100000733263 [0,1,0,0,1,0|2,0,0]=4 5402 B16R2.132 Ic1ccc(cc1)NCc2ccncc2 207a_100000185761_100000186114 [0,1,0,0,1,0|2,0,0]=4 5403 B16R2.132 Ic1ccc(cc1)OCc2ccccc2 34a_100000212066_100015291786 [0,1,0,0,1,0|0,0,0]=2 5404 B16R2.132 Ic1ccc(cc1)OCc2ccccc2 7a_100000212066_100000211182 [0,1,0,0,1,0|0,0,0]=2 5405 B16R2.132 Ic1ccc(cc1)OCc2ccccn2 34a_100000212066_100000721315 [0,1,0,0,1,0|1,0,0]=3 5406 B16R2.132 Ic1ccc(cc1)OCc2ccccn2 7a_100000212066_100000721315 [0,1,0,0,1,0|1,0,0]=3 5407 B16R2.132 Ic1ccc(cc1)OCc2cccnc2 34a_100000212066_100000733263 [0,1,0,0,1,0|1,0,0]=3 5408 B16R2.132 Ic1ccc(cc1)OCc2cccnc2 7a_100000212066_100000741622 [0,1,0,0,1,0|1,0,0]=3 5409 B16R2.132 Ic1ccc(cc1)OCc2cccnn2 34a_100000212066_100016990269 [0,1,0,0,1,0|2,0,0]=4 5410 B16R2.132 Ic1ccc(cc1)OCc2cccnn2 7a_100000212066_100016990269 [0,1,0,0,1,0|2,0,0]=4 5411 B16R2.132 Ic1ccc(cc1)OCc2ccncc2 7a_100000212066_100015193705 [0,1,0,0,1,0|1,0,0]=3 5412 B16R2.132 Ic1ccc(cc1)OCc2cnccn2 34a_100000212066_100016995436 [0,1,0,0,1,0|2,0,0]=4 5413 B16R2.132 Ic1ccc(cc1)OCc2cnccn2 7a_100000212066_100016995436 [0,1,0,0,1,0|2,0,0]=4 5414 B16R2.132 Ic1ccc(cc1)OCc2cncnc2 34a_100000212066_100015196519 [0,1,0,0,1,0|2,0,0]=4 5415 B16R2.132 Ic1ccc(cc1)OCc2cncnc2 7a_100000212066_100015196519 [0,1,0,0,1,0|2,0,0]=4 5416 B16R2.132 Ic1ccc(cc1)OCc2ncccn2 34a_100000212066_100000703007 [0,1,0,0,1,0|2,0,0]=4 5417 B16R2.132 Ic1ccc(cc1)OCc2ncccn2 7a_100000212066_100000703007 [0,1,0,0,1,0|2,0,0]=4 5418 B16R2.132 Ic1ccc(cn1)OCc2ccccc2 34a_100000687607_100015291786 [0,1,0,0,1,0|1,0,0]=3 5419 B16R2.132 Ic1ccc(cn1)OCc2ccccc2 7a_100000687607_100000211182 [0,1,0,0,1,0|1,0,0]=3 5420 B16R2.132 Ic1ccc(cn1)OCc2ccccn2 34a_100000687607_100000721315 [0,1,0,0,1,0|2,0,0]=4 5421 B16R2.132 Ic1ccc(cn1)OCc2ccccn2 7a_100000687607_100000721315 [0,1,0,0,1,0|2,0,0]=4 5422 B16R2.132 Ic1ccc(cn1)OCc2cccnc2 34a_100000687607_100000733263 [0,1,0,0,1,0|2,0,0]=4 5423 B16R2.132 Ic1ccc(cn1)OCc2cccnc2 7a_100000687607_100000741622 [0,1,0,0,1,0|2,0,0]=4 5424 B16R2.132 Ic1ccc(cn1)OCc2ccncc2 7a_100000687607_100015193705 [0,1,0,0,1,0|2,0,0]=4 5425 B16R2.132 Nc1ccc(cc1)C#Cc2ccccc2 271570a_100000069678_100000185761 [0,1,0,0,1,0|0,0,2]=4 5426 B16R2.132 Nc1ccc(cc1)C=Cc2ccccc2 271570a_100102527694_100000185761 [0,1,0,0,1,0|0,0,2]=4 5427 B16R2.132 Nc1ccc(cc1)OCc2ccccc2 34a_100000185829_100015291786 [0,1,0,0,1,0|0,0,0]=2 5428 B16R2.132 Nc1ccc(cc1)OCc2ccccn2 34a_100000185829_100000721315 [0,1,0,0,1,0|1,0,0]=3 5429 B16R2.132 Nc1ccc(cc1)OCc2cccnc2 34a_100000185829_100000733263 [0,1,0,0,1,0|1,0,0]=3 5430 B16R2.132 Nc1ccc(cc1)OCc2cccnn2 34a_100000185829_100016990269 [0,1,0,0,1,0|2,0,0]=4 5431 B16R2.132 Nc1ccc(cc1)OCc2cnccn2 34a_100000185829_100016995436 [0,1,0,0,1,0|2,0,0]=4 5432 B16R2.132 Nc1ccc(cc1)OCc2cncnc2 34a_100000185829_100015196519 [0,1,0,0,1,0|2,0,0]=4 5433 B16R2.132 Nc1ccc(cc1)OCc2ncccn2 34a_100000185829_100000703007 [0,1,0,0,1,0|2,0,0]=4 5434 B16R2.132 Nc1ccc(cc1)SCc2ccccc2 62a_100000185761_100015291786 [0,1,0,0,1,0|0,1,0]=3 5435 B16R2.132 Nc1ccc(cc1)SCc2ccccc2 62a_100000211182_100000185761 [0,1,0,0,1,0|0,1,0]=3 5436 B16R2.132 Nc1ccc(cc1)SCc2ccccn2 62a_100000185761_100000721315 [0,1,0,0,1,0|1,1,0]=4 5437 B16R2.132 Nc1ccc(cc1)SCc2ccccn2 62a_100000721315_100000185761 [0,1,0,0,1,0|1,1,0]=4 5438 B16R2.132 Nc1ccc(cc1)SCc2cccnc2 62a_100000185761_100000741622 [0,1,0,0,1,0|1,1,0]=4 5439 B16R2.132 Nc1ccc(cc1)SCc2cccnc2 62a_100000741622_100000185761 [0,1,0,0,1,0|1,1,0]=4 5440 B16R2.132 Nc1ccc(cc1)SCc2ccncc2 62a_100000185761_100015193705 [0,1,0,0,1,0|1,1,0]=4 5441 B16R2.132 Nc1ccc(cc1)SCc2ccncc2 62a_100015193705_100000185761 [0,1,0,0,1,0|1,1,0]=4 5442 B16R2.132 Nc1ccc(cn1)OCc2ccccc2 34a_100015188713_100015291786 [0,1,0,0,1,0|1,0,0]=3 5443 B16R2.132 Nc1ccc(cn1)OCc2ccccc2 7a_100015188713_100000211182 [0,1,0,0,1,0|1,0,0]=3 5444 B16R2.132 Nc1ccc(cn1)OCc2ccccn2 34a_100015188713_100000721315 [0,1,0,0,1,0|2,0,0]=4 5445 B16R2.132 Nc1ccc(cn1)OCc2ccccn2 7a_100015188713_100000721315 [0,1,0,0,1,0|2,0,0]=4 5446 B16R2.132 Nc1ccc(cn1)OCc2cccnc2 34a_100015188713_100000733263 [0,1,0,0,1,0|2,0,0]=4 5447 B16R2.132 Nc1ccc(cn1)OCc2cccnc2 7a_100015188713_100000741622 [0,1,0,0,1,0|2,0,0]=4 5448 B16R2.132 Nc1ccc(cn1)OCc2ccncc2 7a_100015188713_100015193705 [0,1,0,0,1,0|2,0,0]=4 5449 B16R2.132 Nc1ccc(cn1)SCc2ccccc2 62a_100000187370_100015291786 [0,1,0,0,1,0|1,1,0]=4 5450 B16R2.132 Nc1ccc(cn1)SCc2ccccc2 62a_100000211182_100000187370 [0,1,0,0,1,0|1,1,0]=4 5451 B16R2.132 Nc1ccc(nc1)OCc2ccccc2 34a_100000729260_100015291786 [0,1,0,0,1,0|1,0,0]=3 5452 B16R2.132 Nc1ccc(nc1)OCc2ccccn2 34a_100000729260_100000721315 [0,1,0,0,1,0|2,0,0]=4 5453 B16R2.132 Nc1ccc(nc1)OCc2cccnc2 34a_100000729260_100000733263 [0,1,0,0,1,0|2,0,0]=4 5454 B16R2.132 Nc1ccc(nc1)SCc2ccccc2 62a_100000211182_100000737798 [0,1,0,0,1,0|1,1,0]=4 5455 B16R2.132 Nc1ccc(nc1)SCc2ccccc2 62a_100000737798_100015291786 [0,1,0,0,1,0|1,1,0]=4 5456 B16R2.132 Nc1ncc(cn1)OCc2ccccc2 34a_100000087137_100015291786 [0,1,0,0,1,0|2,0,0]=4 5457 B16R2.132 Nc1ncc(cn1)OCc2ccccc2 7a_100000087137_100000211182 [0,1,0,0,1,0|2,0,0]=4 5458 B16R2.132 O=c1ccc(c[nH]1)OCc2ccccc2 34a_100000075641_100015291786 [0,1,0,0,1,0|1,0,0]=3 5459 B16R2.132 O=c1ccc(c[nH]1)OCc2ccccn2 34a_100000075641_100000721315 [0,1,0,0,1,0|2,0,0]=4 5460 B16R2.132 O=c1ccc(c[nH]1)OCc2cccnc2 34a_100000075641_100000733263 [0,1,0,0,1,0|2,0,0]=4 5461 B16R2.132 O=c1ccc(c[nH]1)SCc2ccccc2 62a_100000211182_100000212171 [0,1,0,0,1,0|1,1,0]=4 5462 B16R2.132 O=c1ccc(c[nH]1)SCc2ccccc2 62a_100000212171_100015291786 [0,1,0,0,1,0|1,1,0]=4 5463 B16R2.132 Oc1ccc(cc1)/C=C/c2ccccc2 271570a_203496583355_100016990502 [0,1,0,0,1,0|0,0,2]=4 5464 B16R2.132 Oc1ccc(cc1)/N=N/c2ccccc2 271570a_203496583355_100029724385 [0,1,0,0,1,0|2,0,0]=4 5465 B16R2.132 Oc1ccc(cc1)C#Cc2ccccc2 271570a_100000069678_100000185759 [0,1,0,0,1,0|0,0,2]=4 5466 B16R2.132 Oc1ccc(cc1)C#Cc2ccccc2 271570a_203496583355_100010000412 [0,1,0,0,1,0|0,0,2]=4 5467 B16R2.132 Oc1ccc(cc1)C=Cc2ccccc2 271570a_100102527694_100000185759 [0,1,0,0,1,0|0,0,2]=4 5468 B16R2.132 Oc1ccc(cc1)NCc2ccccc2 270302a_100000185829_100015611070 [0,1,0,0,1,0|1,0,0]=3 5469 B16R2.132 Oc1ccc(cc1)NCc2ccccc2 271570a_203496583355_100000187040 [0,1,0,0,1,0|1,0,0]=3 5470 B16R2.132 Oc1ccc(cc1)NCc2ccccc2 34a_100000185829_100015291786 [0,1,0,0,1,0|1,0,0]=3 5471 B16R2.132 Oc1ccc(cc1)NCc2ccccn2 270302a_100000185829_100000209966 [0,1,0,0,1,0|2,0,0]=4 5472 B16R2.132 Oc1ccc(cc1)NCc2ccccn2 271570a_203496583355_100000238286 [0,1,0,0,1,0|2,0,0]=4 5473 B16R2.132 Oc1ccc(cc1)NCc2ccccn2 34a_100000185829_100000721315 [0,1,0,0,1,0|2,0,0]=4 5474 B16R2.132 Oc1ccc(cc1)NCc2cccnc2 270302a_100000185829_100000209961 [0,1,0,0,1,0|2,0,0]=4 5475 B16R2.132 Oc1ccc(cc1)NCc2cccnc2 271570a_203496583355_100000189165 [0,1,0,0,1,0|2,0,0]=4 5476 B16R2.132 Oc1ccc(cc1)NCc2cccnc2 34a_100000185829_100000733263 [0,1,0,0,1,0|2,0,0]=4 5477 B16R2.132 Oc1ccc(cc1)OCc2ccccc2 271570a_203496583355_100000151783 [0,1,0,0,1,0|0,0,0]=2 5478 B16R2.132 Oc1ccc(cc1)SCc2ccccc2 271570a_203496583355_100009811532 [0,1,0,0,1,0|0,1,0]=3 5479 B16R2.132 Oc1ccc(cc1)SCc2ccccc2 62a_100000211182_100000185759 [0,1,0,0,1,0|0,1,0]=3 5480 B16R2.132 Oc1ccc(cc1)SCc2ccccn2 62a_100000721315_100000185759 [0,1,0,0,1,0|1,1,0]=4 5481 B16R2.132 Oc1ccc(cc1)SCc2cccnc2 62a_100000741622_100000185759 [0,1,0,0,1,0|1,1,0]=4 5482 B16R2.132 Oc1ccc(cc1)SCc2ccncc2 62a_100015193705_100000185759 [0,1,0,0,1,0|1,1,0]=4 5483 B16R2.132 Oc1ccc(cn1)CNc2ccccc2 207a_100000106764_100011361521 [0,1,0,0,1,0|2,0,0]=4 5484 B16R2.132 Oc1ccc(cn1)CNc2ccccc2 270302a_100000106764_100011361521 [0,1,0,0,1,0|2,0,0]=4 5485 B16R2.132 Oc1ccc(cn1)OCc2ccccc2 271570a_203496583355_200012361712 [0,1,0,0,1,0|1,0,0]=3 5486 B16R2.132 Oc1ccc(cn1)OCc2ccccn2 271570a_203496583355_100013423275 [0,1,0,0,1,0|2,0,0]=4 5487 B16R2.132 Oc1ccc(nc1)NCc2ccccc2 271570a_203496583355_200000239955 [0,1,0,0,1,0|2,0,0]=4 5488 B16R2.132 Oc1ccc(nc1)OCc2ccccc2 271570a_203496583355_100011465491 [0,1,0,0,1,0|1,0,0]=3 5489 B16R2.132 Oc1ccc(nc1)SCc2ccccc2 62a_100000211182_100000744096 [0,1,0,0,1,0|1,1,0]=4 5490 B16R2.132 Oc1ccc(nc1)SCc2ccccc2 62a_100000685995_100015291786 [0,1,0,0,1,0|1,1,0]=4 5491 B16R2.132 Oc1ccc(nn1)OCc2ccccc2 271570a_203496583355_100011211657 [0,1,0,0,1,0|2,0,0]=4 5492 B16R2.132 Oc1cnc(nc1)OCc2ccccc2 271570a_203496583355_100011830389 [0,1,0,0,1,0|2,0,0]=4 5493 B16R2.132 Oc1ncc(cn1)OCc2ccccc2 271570a_203496583355_100010205888 [0,1,0,0,1,0|2,0,0]=4 5494 B16R2.132 [O-][n+]1ccc(cc1)SCc2ccccc2 62a_100000211182_100000039755 [0,1,0,0,1,0|1,1,0]=4 5495 B16R2.252 Brc1cc(ccn1)CNc2ccccc2 34a_100000106764_100010243470 [0,1,0,0,1,0|2,0,0]=4 5496 B16R2.252 Brc1cc(ccn1)COc2ccccc2 34a_100000210340_100010243470 [0,1,0,0,1,0|1,0,0]=3 5497 B16R2.252 Brc1cc(ccn1)COc2ccccc2 7a_100000210340_100010254460 [0,1,0,0,1,0|1,0,0]=3 5498 B16R2.252 Brc1cc(ccn1)COc2cccnc2 34a_100000210849_100010243470 [0,1,0,0,1,0|2,0,0]=4 5499 B16R2.252 Brc1cc(ccn1)COc2cccnc2 7a_100000210849_100010254460 [0,1,0,0,1,0|2,0,0]=4 5500 B16R2.252 Brc1cc(ccn1)COc2ccncc2 34a_100000212176_100010243470 [0,1,0,0,1,0|2,0,0]=4 5501 B16R2.252 Brc1cc(ccn1)CSc2ccccc2 62a_100000719477_100010243470 [0,1,0,0,1,0|1,1,0]=4 5502 B16R2.252 Brc1cc(ccn1)CSc2ccccc2 62a_100010254460_100000041952 [0,1,0,0,1,0|1,1,0]=4 5503 B16R2.252 Brc1cc(ccn1)SCc2ccccc2 62a_100000211182_100009814637 [0,1,0,0,1,0|1,1,0]=4 5504 B16R2.252 Brc1cc(ccn1)SCc2ccccc2 62a_100009814637_100015291786 [0,1,0,0,1,0|1,1,0]=4 5505 B16R2.252 Brc1cccc(c1)C#Cc2ccccc2 271570a_100000069678_100000691529 [0,1,0,0,1,0|0,0,2]=4 5506 B16R2.252 Brc1cccc(c1)C=Cc2ccccc2 271570a_100102527694_100000691529 [0,1,0,0,1,0|0,0,2]=4 5507 B16R2.252 Brc1cccc(c1)CNc2ccccc2 207a_100000106764_100000210085 [0,1,0,0,1,0|1,0,0]=3 5508 B16R2.252 Brc1cccc(c1)CNc2ccccc2 270302a_100000106764_100000210085 [0,1,0,0,1,0|1,0,0]=3 5509 B16R2.252 Brc1cccc(c1)CNc2ccccc2 34a_100000106764_100000698116 [0,1,0,0,1,0|1,0,0]=3 5510 B16R2.252 Brc1cccc(c1)COc2ccccc2 34a_100000210340_100000698116 [0,1,0,0,1,0|0,0,0]=2 5511 B16R2.252 Brc1cccc(c1)COc2ccccc2 7a_100000210340_100000211773 [0,1,0,0,1,0|0,0,0]=2 5512 B16R2.252 Brc1cccc(c1)COc2cccnc2 34a_100000210849_100000698116 [0,1,0,0,1,0|1,0,0]=3 5513 B16R2.252 Brc1cccc(c1)COc2cccnc2 7a_100000210849_100000211773 [0,1,0,0,1,0|1,0,0]=3 5514 B16R2.252 Brc1cccc(c1)COc2ccncc2 34a_100000212176_100000698116 [0,1,0,0,1,0|1,0,0]=3 5515 B16R2.252 Brc1cccc(c1)COc2ccnnc2 34a_100015204005_100000698116 [0,1,0,0,1,0|2,0,0]=4 5516 B16R2.252 Brc1cccc(c1)COc2cncnc2 7a_100000754086_100000211773 [0,1,0,0,1,0|2,0,0]=4 5517 B16R2.252 Brc1cccc(c1)CSc2ccccc2 62a_100000211773_100000041952 [0,1,0,0,1,0|0,1,0]=3 5518 B16R2.252 Brc1cccc(c1)CSc2ccccc2 62a_100000719477_100000211773 [0,1,0,0,1,0|0,1,0]=3 5519 B16R2.252 Brc1cccc(c1)CSc2ccccn2 62a_100000211773_100011216584 [0,1,0,0,1,0|1,1,0]=4 5520 B16R2.252 Brc1cccc(c1)CSc2ccccn2 62a_100011216584_100000211773 [0,1,0,0,1,0|1,1,0]=4 5521 B16R2.252 Brc1cccc(c1)CSc2cccnc2 62a_100000210063_100000211773 [0,1,0,0,1,0|1,1,0]=4 5522 B16R2.252 Brc1cccc(c1)CSc2cccnc2 62a_100000211773_100000210063 [0,1,0,0,1,0|1,1,0]=4 5523 B16R2.252 Brc1cccc(c1)CSc2ccncc2 62a_100000211773_100000728582 [0,1,0,0,1,0|1,1,0]=4 5524 B16R2.252 Brc1cccc(c1)CSc2ccncc2 62a_100000728582_100000211773 [0,1,0,0,1,0|1,1,0]=4 5525 B16R2.252 Brc1cccc(c1)NCc2ccccc2 207a_100000210019_100015611070 [0,1,0,0,1,0|1,0,0]=3 5526 B16R2.252 Brc1cccc(c1)NCc2ccccc2 270302a_100000210019_100015611070 [0,1,0,0,1,0|1,0,0]=3 5527 B16R2.252 Brc1cccc(c1)NCc2ccccc2 34a_100000210019_100015291786 [0,1,0,0,1,0|1,0,0]=3 5528 B16R2.252 Brc1cccc(c1)NCc2ccccn2 207a_100000210019_100000209966 [0,1,0,0,1,0|2,0,0]=4 5529 B16R2.252 Brc1cccc(c1)NCc2ccccn2 270302a_100000210019_100000209966 [0,1,0,0,1,0|2,0,0]=4 5530 B16R2.252 Brc1cccc(c1)NCc2ccccn2 34a_100000210019_100000721315 [0,1,0,0,1,0|2,0,0]=4 5531 B16R2.252 Brc1cccc(c1)NCc2cccnc2 207a_100000210019_100000209961 [0,1,0,0,1,0|2,0,0]=4 5532 B16R2.252 Brc1cccc(c1)NCc2cccnc2 270302a_100000210019_100000209961 [0,1,0,0,1,0|2,0,0]=4 5533 B16R2.252 Brc1cccc(c1)NCc2cccnc2 34a_100000210019_100000733263 [0,1,0,0,1,0|2,0,0]=4 5534 B16R2.252 Brc1cccc(c1)NCc2ccncc2 207a_100000210019_100000186114 [0,1,0,0,1,0|2,0,0]=4 5535 B16R2.252 Brc1cccc(c1)OCc2ccccc2 34a_100000210342_100015291786 [0,1,0,0,1,0|0,0,0]=2 5536 B16R2.252 Brc1cccc(c1)OCc2ccccc2 7a_100000210342_100000211182 [0,1,0,0,1,0|0,0,0]=2 5537 B16R2.252 Brc1cccc(c1)OCc2ccccn2 34a_100000210342_100000721315 [0,1,0,0,1,0|1,0,0]=3 5538 B16R2.252 Brc1cccc(c1)OCc2ccccn2 7a_100000210342_100000721315 [0,1,0,0,1,0|1,0,0]=3 5539 B16R2.252 Brc1cccc(c1)OCc2cccnc2 34a_100000210342_100000733263 [0,1,0,0,1,0|1,0,0]=3 5540 B16R2.252 Brc1cccc(c1)OCc2cccnc2 7a_100000210342_100000741622 [0,1,0,0,1,0|1,0,0]=3 5541 B16R2.252 Brc1cccc(c1)OCc2cccnn2 34a_100000210342_100016990269 [0,1,0,0,1,0|2,0,0]=4 5542 B16R2.252 Brc1cccc(c1)OCc2cccnn2 7a_100000210342_100016990269 [0,1,0,0,1,0|2,0,0]=4 5543 B16R2.252 Brc1cccc(c1)OCc2ccncc2 7a_100000210342_100015193705 [0,1,0,0,1,0|1,0,0]=3 5544 B16R2.252 Brc1cccc(c1)OCc2cnccn2 34a_100000210342_100016995436 [0,1,0,0,1,0|2,0,0]=4 5545 B16R2.252 Brc1cccc(c1)OCc2cnccn2 7a_100000210342_100016995436 [0,1,0,0,1,0|2,0,0]=4 5546 B16R2.252 Brc1cccc(c1)OCc2cncnc2 34a_100000210342_100015196519 [0,1,0,0,1,0|2,0,0]=4 5547 B16R2.252 Brc1cccc(c1)OCc2cncnc2 7a_100000210342_100015196519 [0,1,0,0,1,0|2,0,0]=4 5548 B16R2.252 Brc1cccc(c1)OCc2ncccn2 34a_100000210342_100000703007 [0,1,0,0,1,0|2,0,0]=4 5549 B16R2.252 Brc1cccc(c1)OCc2ncccn2 7a_100000210342_100000703007 [0,1,0,0,1,0|2,0,0]=4 5550 B16R2.252 Brc1cccc(c1)SCc2ccccc2 62a_100000211182_100000691529 [0,1,0,0,1,0|0,1,0]=3 5551 B16R2.252 Brc1cccc(c1)SCc2ccccc2 62a_100000691529_100015291786 [0,1,0,0,1,0|0,1,0]=3 5552 B16R2.252 Brc1cccc(c1)SCc2ccccn2 62a_100000691529_100000721315 [0,1,0,0,1,0|1,1,0]=4 5553 B16R2.252 Brc1cccc(c1)SCc2ccccn2 62a_100000721315_100000691529 [0,1,0,0,1,0|1,1,0]=4 5554 B16R2.252 Brc1cccc(c1)SCc2cccnc2 62a_100000691529_100000741622 [0,1,0,0,1,0|1,1,0]=4 5555 B16R2.252 Brc1cccc(c1)SCc2cccnc2 62a_100000741622_100000691529 [0,1,0,0,1,0|1,1,0]=4 5556 B16R2.252 Brc1cccc(c1)SCc2ccncc2 62a_100000691529_100015193705 [0,1,0,0,1,0|1,1,0]=4 5557 B16R2.252 Brc1cccc(c1)SCc2ccncc2 62a_100015193705_100000691529 [0,1,0,0,1,0|1,1,0]=4 5558 B16R2.252 Brc1cccc(n1)CNc2ccccc2 34a_100000106764_100009889011 [0,1,0,0,1,0|2,0,0]=4 5559 B16R2.252 Brc1cccc(n1)COc2ccccc2 34a_100000210340_100009889011 [0,1,0,0,1,0|1,0,0]=3 5560 B16R2.252 Brc1cccc(n1)COc2ccccc2 7a_100000210340_100009889011 [0,1,0,0,1,0|1,0,0]=3 5561 B16R2.252 Brc1cccc(n1)COc2cccnc2 34a_100000210849_100009889011 [0,1,0,0,1,0|2,0,0]=4 5562 B16R2.252 Brc1cccc(n1)COc2cccnc2 7a_100000210849_100009889011 [0,1,0,0,1,0|2,0,0]=4 5563 B16R2.252 Brc1cccc(n1)COc2ccncc2 34a_100000212176_100009889011 [0,1,0,0,1,0|2,0,0]=4 5564 B16R2.252 Brc1cccc(n1)CSc2ccccc2 62a_100000719477_100009889011 [0,1,0,0,1,0|1,1,0]=4 5565 B16R2.252 Brc1cccc(n1)CSc2ccccc2 62a_100009889011_100000041952 [0,1,0,0,1,0|1,1,0]=4 5566 B16R2.252 Brc1cccc(n1)SCc2ccccc2 62a_100000211182_100000684672 [0,1,0,0,1,0|1,1,0]=4 5567 B16R2.252 Brc1cccc(n1)SCc2ccccc2 62a_100000684672_100015291786 [0,1,0,0,1,0|1,1,0]=4 5568 B16R2.252 Brc1ccnc(c1)CNc2ccccc2 34a_100000106764_100010173614 [0,1,0,0,1,0|2,0,0]=4 5569 B16R2.252 Brc1ccnc(c1)COc2ccccc2 34a_100000210340_100010173614 [0,1,0,0,1,0|1,0,0]=3 5570 B16R2.252 Brc1ccnc(c1)COc2ccccc2 7a_100000210340_100010173614 [0,1,0,0,1,0|1,0,0]=3 5571 B16R2.252 Brc1ccnc(c1)COc2cccnc2 34a_100000210849_100010173614 [0,1,0,0,1,0|2,0,0]=4 5572 B16R2.252 Brc1ccnc(c1)COc2cccnc2 7a_100000210849_100010173614 [0,1,0,0,1,0|2,0,0]=4 5573 B16R2.252 Brc1ccnc(c1)COc2ccncc2 34a_100000212176_100010173614 [0,1,0,0,1,0|2,0,0]=4 5574 B16R2.252 Brc1ccnc(c1)CSc2ccccc2 62a_100000719477_100010173614 [0,1,0,0,1,0|1,1,0]=4 5575 B16R2.252 Brc1ccnc(c1)CSc2ccccc2 62a_100010173614_100000041952 [0,1,0,0,1,0|1,1,0]=4 5576 B16R2.252 Brc1cncc(c1)CNc2ccccc2 207a_100000106764_100000687066 [0,1,0,0,1,0|2,0,0]=4 5577 B16R2.252 Brc1cncc(c1)CNc2ccccc2 270302a_100000106764_100000687066 [0,1,0,0,1,0|2,0,0]=4 5578 B16R2.252 Brc1cncc(c1)CNc2ccccc2 34a_100000106764_100000738771 [0,1,0,0,1,0|2,0,0]=4 5579 B16R2.252 Brc1cncc(c1)COc2ccccc2 34a_100000210340_100000738771 [0,1,0,0,1,0|1,0,0]=3 5580 B16R2.252 Brc1cncc(c1)COc2ccccc2 7a_100000210340_100000738771 [0,1,0,0,1,0|1,0,0]=3 5581 B16R2.252 Brc1cncc(c1)COc2cccnc2 34a_100000210849_100000738771 [0,1,0,0,1,0|2,0,0]=4 5582 B16R2.252 Brc1cncc(c1)COc2cccnc2 7a_100000210849_100000738771 [0,1,0,0,1,0|2,0,0]=4 5583 B16R2.252 Brc1cncc(c1)COc2ccncc2 34a_100000212176_100000738771 [0,1,0,0,1,0|2,0,0]=4 5584 B16R2.252 Brc1cncc(c1)CSc2ccccc2 62a_100000719477_100000738771 [0,1,0,0,1,0|1,1,0]=4 5585 B16R2.252 Brc1cncc(c1)CSc2ccccc2 62a_100000738771_100000041952 [0,1,0,0,1,0|1,1,0]=4 5586 B16R2.252 Brc1cncc(c1)OCc2ccccc2 34a_100000754920_100015291786 [0,1,0,0,1,0|1,0,0]=3 5587 B16R2.252 Brc1cncc(c1)OCc2ccccc2 7a_100000754920_100000211182 [0,1,0,0,1,0|1,0,0]=3 5588 B16R2.252 Brc1cncc(c1)OCc2ccccn2 34a_100000754920_100000721315 [0,1,0,0,1,0|2,0,0]=4 5589 B16R2.252 Brc1cncc(c1)OCc2ccccn2 7a_100000754920_100000721315 [0,1,0,0,1,0|2,0,0]=4 5590 B16R2.252 Brc1cncc(c1)OCc2cccnc2 34a_100000754920_100000733263 [0,1,0,0,1,0|2,0,0]=4 5591 B16R2.252 Brc1cncc(c1)OCc2cccnc2 7a_100000754920_100000741622 [0,1,0,0,1,0|2,0,0]=4 5592 B16R2.252 Brc1cncc(c1)OCc2ccncc2 7a_100000754920_100015193705 [0,1,0,0,1,0|2,0,0]=4 5593 B16R2.252 Brc1cncc(c1)SCc2ccccc2 62a_100000211182_100000728054 [0,1,0,0,1,0|1,1,0]=4 5594 B16R2.252 Brc1cncc(c1)SCc2ccccc2 62a_100000728054_100015291786 [0,1,0,0,1,0|1,1,0]=4 5595 B16R2.252 C[n+]1cccc(c1)SCc2ccccc2 62a_100000211182_100009996589 [0,1,0,0,1,0|1,1,0]=4 5596 B16R2.252 C[n+]1cccc(c1)SCc2ccccc2 62a_100009996589_100015291786 [0,1,0,0,1,0|1,1,0]=4 5597 B16R2.252 Cc1cc(ccn1)CNc2ccccc2 207a_100000106764_100011361630 [0,1,0,0,1,0|2,0,0]=4 5598 B16R2.252 Cc1cc(ccn1)CNc2ccccc2 34a_100000106764_200020672517 [0,1,0,0,1,0|2,0,0]=4 5599 B16R2.252 Cc1cc(ccn1)COc2ccccc2 34a_100000210340_200020672517 [0,1,0,0,1,0|1,0,0]=3 5600 B16R2.252 Cc1cc(ccn1)COc2ccccc2 7a_100000210340_200020672517 [0,1,0,0,1,0|1,0,0]=3 5601 B16R2.252 Cc1cc(ccn1)COc2cccnc2 34a_100000210849_200020672517 [0,1,0,0,1,0|2,0,0]=4 5602 B16R2.252 Cc1cc(ccn1)COc2cccnc2 7a_100000210849_200020672517 [0,1,0,0,1,0|2,0,0]=4 5603 B16R2.252 Cc1cc(ccn1)COc2ccncc2 34a_100000212176_200020672517 [0,1,0,0,1,0|2,0,0]=4 5604 B16R2.252 Cc1cc(ccn1)CSc2ccccc2 62a_100000719477_200020672517 [0,1,0,0,1,0|1,1,0]=4 5605 B16R2.252 Cc1cc(ccn1)CSc2ccccc2 62a_200020672517_100000041952 [0,1,0,0,1,0|1,1,0]=4 5606 B16R2.252 Cc1cc(ccn1)NCc2ccccc2 27a_100015324214_100000758586 [0,1,0,0,1,0|2,0,0]=4 5607 B16R2.252 Cc1cc(ccn1)OCc2ccccc2 34a_100000688365_100015291786 [0,1,0,0,1,0|1,0,0]=3 5608 B16R2.252 Cc1cc(ccn1)OCc2ccccn2 34a_100000688365_100000721315 [0,1,0,0,1,0|2,0,0]=4 5609 B16R2.252 Cc1cc(ccn1)OCc2cccnc2 34a_100000688365_100000733263 [0,1,0,0,1,0|2,0,0]=4 5610 B16R2.252 Cc1cc(ccn1)SCc2ccccc2 62a_100000211182_100000758586 [0,1,0,0,1,0|1,1,0]=4 5611 B16R2.252 Cc1cc(ccn1)SCc2ccccc2 62a_100000758586_100015291786 [0,1,0,0,1,0|1,1,0]=4 5612 B16R2.252 Cc1cccc(c1)C#Cc2ccccc2 271570a_100000069678_100011215228 [0,1,0,0,1,0|0,0,2]=4 5613 B16R2.252 Cc1cccc(c1)C=Cc2ccccc2 271570a_100102527694_100011215228 [0,1,0,0,1,0|0,0,2]=4 5614 B16R2.252 Cc1cccc(c1)C=Cc2ccccc2 271570a_200135466880_100000210277 [0,1,0,0,1,0|0,0,2]=4 5615 B16R2.252 Cc1cccc(c1)CNc2ccccc2 207a_100000106764_100000211157 [0,1,0,0,1,0|1,0,0]=3 5616 B16R2.252 Cc1cccc(c1)CNc2ccccc2 270302a_100000106764_100000211157 [0,1,0,0,1,0|1,0,0]=3 5617 B16R2.252 Cc1cccc(c1)CNc2ccccc2 34a_100000106764_100000211840 [0,1,0,0,1,0|1,0,0]=3 5618 B16R2.252 Cc1cccc(c1)COc2ccccc2 34a_100000210340_100000211840 [0,1,0,0,1,0|0,0,0]=2 5619 B16R2.252 Cc1cccc(c1)COc2ccccc2 7a_100000210340_100000211840 [0,1,0,0,1,0|0,0,0]=2 5620 B16R2.252 Cc1cccc(c1)COc2cccnc2 34a_100000210849_100000211840 [0,1,0,0,1,0|1,0,0]=3 5621 B16R2.252 Cc1cccc(c1)COc2cccnc2 7a_100000210849_100000211840 [0,1,0,0,1,0|1,0,0]=3 5622 B16R2.252 Cc1cccc(c1)COc2ccncc2 34a_100000212176_100000211840 [0,1,0,0,1,0|1,0,0]=3 5623 B16R2.252 Cc1cccc(c1)COc2ccnnc2 34a_100015204005_100000211840 [0,1,0,0,1,0|2,0,0]=4 5624 B16R2.252 Cc1cccc(c1)COc2cncnc2 7a_100000754086_100000211840 [0,1,0,0,1,0|2,0,0]=4 5625 B16R2.252 Cc1cccc(c1)CSc2ccccc2 62a_100000211840_100000041952 [0,1,0,0,1,0|0,1,0]=3 5626 B16R2.252 Cc1cccc(c1)CSc2ccccc2 62a_100000719477_100000211840 [0,1,0,0,1,0|0,1,0]=3 5627 B16R2.252 Cc1cccc(c1)CSc2ccccn2 62a_100000211840_100011216584 [0,1,0,0,1,0|1,1,0]=4 5628 B16R2.252 Cc1cccc(c1)CSc2ccccn2 62a_100011216584_100000211840 [0,1,0,0,1,0|1,1,0]=4 5629 B16R2.252 Cc1cccc(c1)CSc2cccnc2 62a_100000210063_100000211840 [0,1,0,0,1,0|1,1,0]=4 5630 B16R2.252 Cc1cccc(c1)CSc2cccnc2 62a_100000211840_100000210063 [0,1,0,0,1,0|1,1,0]=4 5631 B16R2.252 Cc1cccc(c1)CSc2ccncc2 62a_100000211840_100000728582 [0,1,0,0,1,0|1,1,0]=4 5632 B16R2.252 Cc1cccc(c1)CSc2ccncc2 62a_100000728582_100000211840 [0,1,0,0,1,0|1,1,0]=4 5633 B16R2.252 Cc1cccc(c1)NCc2ccccc2 207a_100000188690_100015611070 [0,1,0,0,1,0|1,0,0]=3 5634 B16R2.252 Cc1cccc(c1)NCc2ccccc2 2230a_100000188690_100015291786 [0,1,0,0,1,0|1,0,0]=3 5635 B16R2.252 Cc1cccc(c1)NCc2ccccc2 270302a_100000188690_100015611070 [0,1,0,0,1,0|1,0,0]=3 5636 B16R2.252 Cc1cccc(c1)NCc2ccccc2 34a_100000188690_100015291786 [0,1,0,0,1,0|1,0,0]=3 5637 B16R2.252 Cc1cccc(c1)NCc2ccccn2 207a_100000188690_100000209966 [0,1,0,0,1,0|2,0,0]=4 5638 B16R2.252 Cc1cccc(c1)NCc2ccccn2 2230a_100000188690_100000721315 [0,1,0,0,1,0|2,0,0]=4 5639 B16R2.252 Cc1cccc(c1)NCc2ccccn2 270302a_100000188690_100000209966 [0,1,0,0,1,0|2,0,0]=4 5640 B16R2.252 Cc1cccc(c1)NCc2ccccn2 34a_100000188690_100000721315 [0,1,0,0,1,0|2,0,0]=4 5641 B16R2.252 Cc1cccc(c1)NCc2cccnc2 207a_100000188690_100000209961 [0,1,0,0,1,0|2,0,0]=4 5642 B16R2.252 Cc1cccc(c1)NCc2cccnc2 2230a_100000188690_100000741622 [0,1,0,0,1,0|2,0,0]=4 5643 B16R2.252 Cc1cccc(c1)NCc2cccnc2 270302a_100000188690_100000209961 [0,1,0,0,1,0|2,0,0]=4 5644 B16R2.252 Cc1cccc(c1)NCc2cccnc2 34a_100000188690_100000733263 [0,1,0,0,1,0|2,0,0]=4 5645 B16R2.252 Cc1cccc(c1)NCc2ccncc2 207a_100000188690_100000186114 [0,1,0,0,1,0|2,0,0]=4 5646 B16R2.252 Cc1cccc(c1)NCc2ccncc2 2230a_100000188690_100015193705 [0,1,0,0,1,0|2,0,0]=4 5647 B16R2.252 Cc1cccc(c1)OCc2ccccc2 34a_100000210337_100015291786 [0,1,0,0,1,0|0,0,0]=2 5648 B16R2.252 Cc1cccc(c1)OCc2ccccc2 7a_100000210337_100000211182 [0,1,0,0,1,0|0,0,0]=2 5649 B16R2.252 Cc1cccc(c1)OCc2ccccn2 34a_100000210337_100000721315 [0,1,0,0,1,0|1,0,0]=3 5650 B16R2.252 Cc1cccc(c1)OCc2ccccn2 7a_100000210337_100000721315 [0,1,0,0,1,0|1,0,0]=3 5651 B16R2.252 Cc1cccc(c1)OCc2cccnc2 34a_100000210337_100000733263 [0,1,0,0,1,0|1,0,0]=3 5652 B16R2.252 Cc1cccc(c1)OCc2cccnc2 7a_100000210337_100000741622 [0,1,0,0,1,0|1,0,0]=3 5653 B16R2.252 Cc1cccc(c1)OCc2cccnn2 34a_100000210337_100016990269 [0,1,0,0,1,0|2,0,0]=4 5654 B16R2.252 Cc1cccc(c1)OCc2cccnn2 7a_100000210337_100016990269 [0,1,0,0,1,0|2,0,0]=4 5655 B16R2.252 Cc1cccc(c1)OCc2ccncc2 7a_100000210337_100015193705 [0,1,0,0,1,0|1,0,0]=3 5656 B16R2.252 Cc1cccc(c1)OCc2cnccn2 34a_100000210337_100016995436 [0,1,0,0,1,0|2,0,0]=4 5657 B16R2.252 Cc1cccc(c1)OCc2cnccn2 7a_100000210337_100016995436 [0,1,0,0,1,0|2,0,0]=4 5658 B16R2.252 Cc1cccc(c1)OCc2cncnc2 34a_100000210337_100015196519 [0,1,0,0,1,0|2,0,0]=4 5659 B16R2.252 Cc1cccc(c1)OCc2cncnc2 7a_100000210337_100015196519 [0,1,0,0,1,0|2,0,0]=4 5660 B16R2.252 Cc1cccc(c1)OCc2ncccn2 34a_100000210337_100000703007 [0,1,0,0,1,0|2,0,0]=4 5661 B16R2.252 Cc1cccc(c1)OCc2ncccn2 7a_100000210337_100000703007 [0,1,0,0,1,0|2,0,0]=4 5662 B16R2.252 Cc1cccc(c1)SCc2ccccc2 62a_100000211182_100011215228 [0,1,0,0,1,0|0,1,0]=3 5663 B16R2.252 Cc1cccc(c1)SCc2ccccc2 62a_100011215228_100015291786 [0,1,0,0,1,0|0,1,0]=3 5664 B16R2.252 Cc1cccc(c1)SCc2ccccn2 62a_100000721315_100011215228 [0,1,0,0,1,0|1,1,0]=4 5665 B16R2.252 Cc1cccc(c1)SCc2ccccn2 62a_100011215228_100000721315 [0,1,0,0,1,0|1,1,0]=4 5666 B16R2.252 Cc1cccc(c1)SCc2cccnc2 62a_100000741622_100011215228 [0,1,0,0,1,0|1,1,0]=4 5667 B16R2.252 Cc1cccc(c1)SCc2cccnc2 62a_100011215228_100000741622 [0,1,0,0,1,0|1,1,0]=4 5668 B16R2.252 Cc1cccc(c1)SCc2ccncc2 62a_100011215228_100015193705 [0,1,0,0,1,0|1,1,0]=4 5669 B16R2.252 Cc1cccc(c1)SCc2ccncc2 62a_100015193705_100011215228 [0,1,0,0,1,0|1,1,0]=4 5670 B16R2.252 Cc1cccc(n1)CNc2ccccc2 207a_100000106764_100011215050 [0,1,0,0,1,0|2,0,0]=4 5671 B16R2.252 Cc1cccc(n1)CNc2ccccc2 34a_100000106764_100000757606 [0,1,0,0,1,0|2,0,0]=4 5672 B16R2.252 Cc1cccc(n1)COc2ccccc2 34a_100000210340_100000757606 [0,1,0,0,1,0|1,0,0]=3 5673 B16R2.252 Cc1cccc(n1)COc2ccccc2 7a_100000210340_100000757606 [0,1,0,0,1,0|1,0,0]=3 5674 B16R2.252 Cc1cccc(n1)COc2cccnc2 34a_100000210849_100000757606 [0,1,0,0,1,0|2,0,0]=4 5675 B16R2.252 Cc1cccc(n1)COc2cccnc2 7a_100000210849_100000757606 [0,1,0,0,1,0|2,0,0]=4 5676 B16R2.252 Cc1cccc(n1)COc2ccncc2 34a_100000212176_100000757606 [0,1,0,0,1,0|2,0,0]=4 5677 B16R2.252 Cc1cccc(n1)CSc2ccccc2 62a_100000719477_100000757606 [0,1,0,0,1,0|1,1,0]=4 5678 B16R2.252 Cc1cccc(n1)CSc2ccccc2 62a_100000757606_100000041952 [0,1,0,0,1,0|1,1,0]=4 5679 B16R2.252 Cc1cccc(n1)SCc2ccccc2 62a_100000211182_100000742759 [0,1,0,0,1,0|1,1,0]=4 5680 B16R2.252 Cc1cccc(n1)SCc2ccccc2 62a_100000742759_100015291786 [0,1,0,0,1,0|1,1,0]=4 5681 B16R2.252 Cc1ccnc(c1)CNc2ccccc2 207a_100000106764_100011361488 [0,1,0,0,1,0|2,0,0]=4 5682 B16R2.252 Cc1ccnc(c1)CNc2ccccc2 34a_100000106764_100000718516 [0,1,0,0,1,0|2,0,0]=4 5683 B16R2.252 Cc1ccnc(c1)COc2ccccc2 34a_100000210340_100000718516 [0,1,0,0,1,0|1,0,0]=3 5684 B16R2.252 Cc1ccnc(c1)COc2ccccc2 7a_100000210340_100000718516 [0,1,0,0,1,0|1,0,0]=3 5685 B16R2.252 Cc1ccnc(c1)COc2cccnc2 34a_100000210849_100000718516 [0,1,0,0,1,0|2,0,0]=4 5686 B16R2.252 Cc1ccnc(c1)COc2cccnc2 7a_100000210849_100000718516 [0,1,0,0,1,0|2,0,0]=4 5687 B16R2.252 Cc1ccnc(c1)COc2ccncc2 34a_100000212176_100000718516 [0,1,0,0,1,0|2,0,0]=4 5688 B16R2.252 Cc1ccnc(c1)CSc2ccccc2 62a_100000718516_100000041952 [0,1,0,0,1,0|1,1,0]=4 5689 B16R2.252 Cc1ccnc(c1)CSc2ccccc2 62a_100000719477_100000718516 [0,1,0,0,1,0|1,1,0]=4 5690 B16R2.252 Cc1ccnc(c1)SCc2ccccc2 62a_100000211182_100000750283 [0,1,0,0,1,0|1,1,0]=4 5691 B16R2.252 Cc1ccnc(c1)SCc2ccccc2 62a_100000750283_100015291786 [0,1,0,0,1,0|1,1,0]=4 5692 B16R2.252 Cc1cncc(c1)CNc2ccccc2 207a_100000106764_100011998712 [0,1,0,0,1,0|2,0,0]=4 5693 B16R2.252 Cc1cncc(c1)CNc2ccccc2 270302a_100000106764_100011998712 [0,1,0,0,1,0|2,0,0]=4 5694 B16R2.252 Cc1cncc(c1)CNc2ccccc2 34a_100000106764_100000716715 [0,1,0,0,1,0|2,0,0]=4 5695 B16R2.252 Cc1cncc(c1)COc2ccccc2 34a_100000210340_100000716715 [0,1,0,0,1,0|1,0,0]=3 5696 B16R2.252 Cc1cncc(c1)COc2ccccc2 7a_100000210340_100000716715 [0,1,0,0,1,0|1,0,0]=3 5697 B16R2.252 Cc1cncc(c1)COc2cccnc2 34a_100000210849_100000716715 [0,1,0,0,1,0|2,0,0]=4 5698 B16R2.252 Cc1cncc(c1)COc2cccnc2 7a_100000210849_100000716715 [0,1,0,0,1,0|2,0,0]=4 5699 B16R2.252 Cc1cncc(c1)COc2ccncc2 34a_100000212176_100000716715 [0,1,0,0,1,0|2,0,0]=4 5700 B16R2.252 Cc1cncc(c1)CSc2ccccc2 62a_100000716715_100000041952 [0,1,0,0,1,0|1,1,0]=4 5701 B16R2.252 Cc1cncc(c1)CSc2ccccc2 62a_100000719477_100000716715 [0,1,0,0,1,0|1,1,0]=4 5702 B16R2.252 Cc1cncc(c1)OCc2ccccc2 34a_100011830280_100015291786 [0,1,0,0,1,0|1,0,0]=3 5703 B16R2.252 Cc1cncc(c1)OCc2ccccc2 7a_100011830280_100000211182 [0,1,0,0,1,0|1,0,0]=3 5704 B16R2.252 Cc1cncc(c1)OCc2ccccn2 34a_100011830280_100000721315 [0,1,0,0,1,0|2,0,0]=4 5705 B16R2.252 Cc1cncc(c1)OCc2ccccn2 7a_100011830280_100000721315 [0,1,0,0,1,0|2,0,0]=4 5706 B16R2.252 Cc1cncc(c1)OCc2cccnc2 34a_100011830280_100000733263 [0,1,0,0,1,0|2,0,0]=4 5707 B16R2.252 Cc1cncc(c1)OCc2cccnc2 7a_100011830280_100000741622 [0,1,0,0,1,0|2,0,0]=4 5708 B16R2.252 Cc1cncc(c1)OCc2ccncc2 7a_100011830280_100015193705 [0,1,0,0,1,0|2,0,0]=4 5709 B16R2.252 Cc1cncc(c1)SCc2ccccc2 62a_100000211182_100000760492 [0,1,0,0,1,0|1,1,0]=4 5710 B16R2.252 Cc1cncc(c1)SCc2ccccc2 62a_100000760492_100015291786 [0,1,0,0,1,0|1,1,0]=4 5711 B16R2.252 Cc1cnnc(c1)OCc2ccccc2 34a_100000766097_100015291786 [0,1,0,0,1,0|2,0,0]=4 5712 B16R2.252 Clc1cc(ccn1)CNc2ccccc2 34a_100000106764_100000764220 [0,1,0,0,1,0|2,0,0]=4 5713 B16R2.252 Clc1cc(ccn1)COc2ccccc2 34a_100000210340_100000764220 [0,1,0,0,1,0|1,0,0]=3 5714 B16R2.252 Clc1cc(ccn1)COc2ccccc2 7a_100000210340_100000764220 [0,1,0,0,1,0|1,0,0]=3 5715 B16R2.252 Clc1cc(ccn1)COc2cccnc2 34a_100000210849_100000764220 [0,1,0,0,1,0|2,0,0]=4 5716 B16R2.252 Clc1cc(ccn1)COc2cccnc2 7a_100000210849_100000764220 [0,1,0,0,1,0|2,0,0]=4 5717 B16R2.252 Clc1cc(ccn1)COc2ccncc2 34a_100000212176_100000764220 [0,1,0,0,1,0|2,0,0]=4 5718 B16R2.252 Clc1cc(ccn1)CSc2ccccc2 62a_100000719477_100000764220 [0,1,0,0,1,0|1,1,0]=4 5719 B16R2.252 Clc1cc(ccn1)CSc2ccccc2 62a_100000764220_100000041952 [0,1,0,0,1,0|1,1,0]=4 5720 B16R2.252 Clc1cc(ccn1)OCc2ccccc2 34a_100000762945_100015291786 [0,1,0,0,1,0|1,0,0]=3 5721 B16R2.252 Clc1cc(ccn1)OCc2ccccn2 34a_100000762945_100000721315 [0,1,0,0,1,0|2,0,0]=4 5722 B16R2.252 Clc1cc(ccn1)OCc2cccnc2 34a_100000762945_100000733263 [0,1,0,0,1,0|2,0,0]=4 5723 B16R2.252 Clc1cc(ccn1)SCc2ccccc2 62a_100000035001_100015291786 [0,1,0,0,1,0|1,1,0]=4 5724 B16R2.252 Clc1cc(ccn1)SCc2ccccc2 62a_100000211182_100000035001 [0,1,0,0,1,0|1,1,0]=4 5725 B16R2.252 Clc1cc(cnn1)OCc2ccccc2 34a_200010734679_100015291786 [0,1,0,0,1,0|2,0,0]=4 5726 B16R2.252 Clc1cccc(c1)C#Cc2ccccc2 271570a_100000069678_100000699651 [0,1,0,0,1,0|0,0,2]=4 5727 B16R2.252 Clc1cccc(c1)C=Cc2ccccc2 271570a_100102525933_100000210277 [0,1,0,0,1,0|0,0,2]=4 5728 B16R2.252 Clc1cccc(c1)C=Cc2ccccc2 271570a_100102527694_100000699651 [0,1,0,0,1,0|0,0,2]=4 5729 B16R2.252 Clc1cccc(c1)CNc2ccccc2 207a_100000106764_100000210801 [0,1,0,0,1,0|1,0,0]=3 5730 B16R2.252 Clc1cccc(c1)CNc2ccccc2 270302a_100000106764_100000210801 [0,1,0,0,1,0|1,0,0]=3 5731 B16R2.252 Clc1cccc(c1)CNc2ccccc2 34a_100000106764_100000187163 [0,1,0,0,1,0|1,0,0]=3 5732 B16R2.252 Clc1cccc(c1)COc2ccccc2 34a_100000210340_100000187163 [0,1,0,0,1,0|0,0,0]=2 5733 B16R2.252 Clc1cccc(c1)COc2ccccc2 7a_100000210340_100000187163 [0,1,0,0,1,0|0,0,0]=2 5734 B16R2.252 Clc1cccc(c1)COc2cccnc2 34a_100000210849_100000187163 [0,1,0,0,1,0|1,0,0]=3 5735 B16R2.252 Clc1cccc(c1)COc2cccnc2 7a_100000210849_100000187163 [0,1,0,0,1,0|1,0,0]=3 5736 B16R2.252 Clc1cccc(c1)COc2ccncc2 34a_100000212176_100000187163 [0,1,0,0,1,0|1,0,0]=3 5737 B16R2.252 Clc1cccc(c1)COc2ccnnc2 34a_100015204005_100000187163 [0,1,0,0,1,0|2,0,0]=4 5738 B16R2.252 Clc1cccc(c1)COc2cncnc2 7a_100000754086_100000187163 [0,1,0,0,1,0|2,0,0]=4 5739 B16R2.252 Clc1cccc(c1)CSc2ccccc2 62a_100000187163_100000041952 [0,1,0,0,1,0|0,1,0]=3 5740 B16R2.252 Clc1cccc(c1)CSc2ccccc2 62a_100000719477_100000187163 [0,1,0,0,1,0|0,1,0]=3 5741 B16R2.252 Clc1cccc(c1)CSc2ccccn2 62a_100000187163_100011216584 [0,1,0,0,1,0|1,1,0]=4 5742 B16R2.252 Clc1cccc(c1)CSc2ccccn2 62a_100011216584_100000187163 [0,1,0,0,1,0|1,1,0]=4 5743 B16R2.252 Clc1cccc(c1)CSc2cccnc2 62a_100000187163_100000210063 [0,1,0,0,1,0|1,1,0]=4 5744 B16R2.252 Clc1cccc(c1)CSc2cccnc2 62a_100000210063_100000187163 [0,1,0,0,1,0|1,1,0]=4 5745 B16R2.252 Clc1cccc(c1)CSc2ccncc2 62a_100000187163_100000728582 [0,1,0,0,1,0|1,1,0]=4 5746 B16R2.252 Clc1cccc(c1)CSc2ccncc2 62a_100000728582_100000187163 [0,1,0,0,1,0|1,1,0]=4 5747 B16R2.252 Clc1cccc(c1)NCc2ccccc2 207a_100000185859_100015611070 [0,1,0,0,1,0|1,0,0]=3 5748 B16R2.252 Clc1cccc(c1)NCc2ccccc2 270302a_100000185859_100015611070 [0,1,0,0,1,0|1,0,0]=3 5749 B16R2.252 Clc1cccc(c1)NCc2ccccc2 34a_100000185859_100015291786 [0,1,0,0,1,0|1,0,0]=3 5750 B16R2.252 Clc1cccc(c1)NCc2ccccn2 207a_100000185859_100000209966 [0,1,0,0,1,0|2,0,0]=4 5751 B16R2.252 Clc1cccc(c1)NCc2ccccn2 270302a_100000185859_100000209966 [0,1,0,0,1,0|2,0,0]=4 5752 B16R2.252 Clc1cccc(c1)NCc2ccccn2 34a_100000185859_100000721315 [0,1,0,0,1,0|2,0,0]=4 5753 B16R2.252 Clc1cccc(c1)NCc2cccnc2 207a_100000185859_100000209961 [0,1,0,0,1,0|2,0,0]=4 5754 B16R2.252 Clc1cccc(c1)NCc2cccnc2 270302a_100000185859_100000209961 [0,1,0,0,1,0|2,0,0]=4 5755 B16R2.252 Clc1cccc(c1)NCc2cccnc2 34a_100000185859_100000733263 [0,1,0,0,1,0|2,0,0]=4 5756 B16R2.252 Clc1cccc(c1)NCc2ccncc2 207a_100000185859_100000186114 [0,1,0,0,1,0|2,0,0]=4 5757 B16R2.252 Clc1cccc(c1)OCc2ccccc2 34a_100000210295_100015291786 [0,1,0,0,1,0|0,0,0]=2 5758 B16R2.252 Clc1cccc(c1)OCc2ccccc2 7a_100000210295_100000211182 [0,1,0,0,1,0|0,0,0]=2 5759 B16R2.252 Clc1cccc(c1)OCc2ccccn2 34a_100000210295_100000721315 [0,1,0,0,1,0|1,0,0]=3 5760 B16R2.252 Clc1cccc(c1)OCc2ccccn2 7a_100000210295_100000721315 [0,1,0,0,1,0|1,0,0]=3 5761 B16R2.252 Clc1cccc(c1)OCc2cccnc2 34a_100000210295_100000733263 [0,1,0,0,1,0|1,0,0]=3 5762 B16R2.252 Clc1cccc(c1)OCc2cccnc2 7a_100000210295_100000741622 [0,1,0,0,1,0|1,0,0]=3 5763 B16R2.252 Clc1cccc(c1)OCc2cccnn2 34a_100000210295_100016990269 [0,1,0,0,1,0|2,0,0]=4 5764 B16R2.252 Clc1cccc(c1)OCc2cccnn2 7a_100000210295_100016990269 [0,1,0,0,1,0|2,0,0]=4 5765 B16R2.252 Clc1cccc(c1)OCc2ccncc2 7a_100000210295_100015193705 [0,1,0,0,1,0|1,0,0]=3 5766 B16R2.252 Clc1cccc(c1)OCc2cnccn2 34a_100000210295_100016995436 [0,1,0,0,1,0|2,0,0]=4 5767 B16R2.252 Clc1cccc(c1)OCc2cnccn2 7a_100000210295_100016995436 [0,1,0,0,1,0|2,0,0]=4 5768 B16R2.252 Clc1cccc(c1)OCc2cncnc2 34a_100000210295_100015196519 [0,1,0,0,1,0|2,0,0]=4 5769 B16R2.252 Clc1cccc(c1)OCc2cncnc2 7a_100000210295_100015196519 [0,1,0,0,1,0|2,0,0]=4 5770 B16R2.252 Clc1cccc(c1)OCc2ncccn2 34a_100000210295_100000703007 [0,1,0,0,1,0|2,0,0]=4 5771 B16R2.252 Clc1cccc(c1)OCc2ncccn2 7a_100000210295_100000703007 [0,1,0,0,1,0|2,0,0]=4 5772 B16R2.252 Clc1cccc(c1)SCc2ccccc2 62a_100000211182_100000699651 [0,1,0,0,1,0|0,1,0]=3 5773 B16R2.252 Clc1cccc(c1)SCc2ccccc2 62a_100000699651_100015291786 [0,1,0,0,1,0|0,1,0]=3 5774 B16R2.252 Clc1cccc(c1)SCc2ccccn2 62a_100000699651_100000721315 [0,1,0,0,1,0|1,1,0]=4 5775 B16R2.252 Clc1cccc(c1)SCc2ccccn2 62a_100000721315_100000699651 [0,1,0,0,1,0|1,1,0]=4 5776 B16R2.252 Clc1cccc(c1)SCc2cccnc2 62a_100000699651_100000741622 [0,1,0,0,1,0|1,1,0]=4 5777 B16R2.252 Clc1cccc(c1)SCc2cccnc2 62a_100000741622_100000699651 [0,1,0,0,1,0|1,1,0]=4 5778 B16R2.252 Clc1cccc(c1)SCc2ccncc2 62a_100000699651_100015193705 [0,1,0,0,1,0|1,1,0]=4 5779 B16R2.252 Clc1cccc(c1)SCc2ccncc2 62a_100015193705_100000699651 [0,1,0,0,1,0|1,1,0]=4 5780 B16R2.252 Clc1cccc(n1)CNc2ccccc2 34a_100000106764_100000086093 [0,1,0,0,1,0|2,0,0]=4 5781 B16R2.252 Clc1cccc(n1)COc2ccccc2 34a_100000210340_100000086093 [0,1,0,0,1,0|1,0,0]=3 5782 B16R2.252 Clc1cccc(n1)COc2ccccc2 7a_100000210340_100000086093 [0,1,0,0,1,0|1,0,0]=3 5783 B16R2.252 Clc1cccc(n1)COc2cccnc2 34a_100000210849_100000086093 [0,1,0,0,1,0|2,0,0]=4 5784 B16R2.252 Clc1cccc(n1)COc2cccnc2 7a_100000210849_100000086093 [0,1,0,0,1,0|2,0,0]=4 5785 B16R2.252 Clc1cccc(n1)COc2ccncc2 34a_100000212176_100000086093 [0,1,0,0,1,0|2,0,0]=4 5786 B16R2.252 Clc1cccc(n1)CSc2ccccc2 62a_100000086093_100000041952 [0,1,0,0,1,0|1,1,0]=4 5787 B16R2.252 Clc1cccc(n1)CSc2ccccc2 62a_100000719477_100000086093 [0,1,0,0,1,0|1,1,0]=4 5788 B16R2.252 Clc1cccc(n1)SCc2ccccc2 62a_100000051397_100015291786 [0,1,0,0,1,0|1,1,0]=4 5789 B16R2.252 Clc1cccc(n1)SCc2ccccc2 62a_100000211182_100000051397 [0,1,0,0,1,0|1,1,0]=4 5790 B16R2.252 Clc1ccnc(c1)CNc2ccccc2 34a_100000106764_100016988179 [0,1,0,0,1,0|2,0,0]=4 5791 B16R2.252 Clc1ccnc(c1)COc2ccccc2 34a_100000210340_100016988179 [0,1,0,0,1,0|1,0,0]=3 5792 B16R2.252 Clc1ccnc(c1)COc2ccccc2 7a_100000210340_100016988179 [0,1,0,0,1,0|1,0,0]=3 5793 B16R2.252 Clc1ccnc(c1)COc2cccnc2 34a_100000210849_100016988179 [0,1,0,0,1,0|2,0,0]=4 5794 B16R2.252 Clc1ccnc(c1)COc2cccnc2 7a_100000210849_100016988179 [0,1,0,0,1,0|2,0,0]=4 5795 B16R2.252 Clc1ccnc(c1)COc2ccncc2 34a_100000212176_100016988179 [0,1,0,0,1,0|2,0,0]=4 5796 B16R2.252 Clc1ccnc(c1)CSc2ccccc2 62a_100000719477_100016988179 [0,1,0,0,1,0|1,1,0]=4 5797 B16R2.252 Clc1ccnc(c1)CSc2ccccc2 62a_100016988179_100000041952 [0,1,0,0,1,0|1,1,0]=4 5798 B16R2.252 Clc1ccnc(c1)SCc2ccccc2 62a_100000211182_100010167805 [0,1,0,0,1,0|1,1,0]=4 5799 B16R2.252 Clc1ccnc(c1)SCc2ccccc2 62a_100010167805_100015291786 [0,1,0,0,1,0|1,1,0]=4 5800 B16R2.252 Clc1cncc(c1)CNc2ccccc2 207a_100000106764_100000088910 [0,1,0,0,1,0|2,0,0]=4 5801 B16R2.252 Clc1cncc(c1)CNc2ccccc2 270302a_100000106764_100000088910 [0,1,0,0,1,0|2,0,0]=4 5802 B16R2.252 Clc1cncc(c1)CNc2ccccc2 34a_100000106764_100016992070 [0,1,0,0,1,0|2,0,0]=4 5803 B16R2.252 Clc1cncc(c1)COc2ccccc2 34a_100000210340_100016992070 [0,1,0,0,1,0|1,0,0]=3 5804 B16R2.252 Clc1cncc(c1)COc2ccccc2 7a_100000210340_100016992070 [0,1,0,0,1,0|1,0,0]=3 5805 B16R2.252 Clc1cncc(c1)COc2cccnc2 34a_100000210849_100016992070 [0,1,0,0,1,0|2,0,0]=4 5806 B16R2.252 Clc1cncc(c1)COc2cccnc2 7a_100000210849_100016992070 [0,1,0,0,1,0|2,0,0]=4 5807 B16R2.252 Clc1cncc(c1)COc2ccncc2 34a_100000212176_100016992070 [0,1,0,0,1,0|2,0,0]=4 5808 B16R2.252 Clc1cncc(c1)CSc2ccccc2 62a_100000719477_100016992070 [0,1,0,0,1,0|1,1,0]=4 5809 B16R2.252 Clc1cncc(c1)CSc2ccccc2 62a_100016992070_100000041952 [0,1,0,0,1,0|1,1,0]=4 5810 B16R2.252 Clc1cncc(c1)OCc2ccccc2 7a_100000032511_100000211182 [0,1,0,0,1,0|1,0,0]=3 5811 B16R2.252 Clc1cncc(c1)OCc2ccccn2 7a_100000032511_100000721315 [0,1,0,0,1,0|2,0,0]=4 5812 B16R2.252 Clc1cncc(c1)OCc2cccnc2 7a_100000032511_100000741622 [0,1,0,0,1,0|2,0,0]=4 5813 B16R2.252 Clc1cncc(c1)OCc2ccncc2 7a_100000032511_100015193705 [0,1,0,0,1,0|2,0,0]=4 5814 B16R2.252 Clc1cncc(c1)SCc2ccccc2 62a_100000049639_100015291786 [0,1,0,0,1,0|1,1,0]=4 5815 B16R2.252 Clc1cncc(c1)SCc2ccccc2 62a_100000211182_100000049639 [0,1,0,0,1,0|1,1,0]=4 5816 B16R2.252 Clc1nccc(n1)COc2ccccc2 34a_100000210340_100000099655 [0,1,0,0,1,0|2,0,0]=4 5817 B16R2.252 Clc1nccc(n1)COc2ccccc2 7a_100000210340_100000099655 [0,1,0,0,1,0|2,0,0]=4 5818 B16R2.252 Fc1cc(ccn1)NCc2ccccc2 27a_100015324214_100009816116 [0,1,0,0,1,0|2,0,0]=4 5819 B16R2.252 Fc1cc(ccn1)OCc2ccccc2 34a_100000732698_100015291786 [0,1,0,0,1,0|1,0,0]=3 5820 B16R2.252 Fc1cc(ccn1)OCc2ccccn2 34a_100000732698_100000721315 [0,1,0,0,1,0|2,0,0]=4 5821 B16R2.252 Fc1cc(ccn1)OCc2cccnc2 34a_100000732698_100000733263 [0,1,0,0,1,0|2,0,0]=4 5822 B16R2.252 Fc1cc(ccn1)SCc2ccccc2 62a_100000211182_100009816116 [0,1,0,0,1,0|1,1,0]=4 5823 B16R2.252 Fc1cc(ccn1)SCc2ccccc2 62a_100009816116_100015291786 [0,1,0,0,1,0|1,1,0]=4 5824 B16R2.252 Fc1cccc(c1)C#Cc2ccccc2 271570a_100000069678_100000685547 [0,1,0,0,1,0|0,0,2]=4 5825 B16R2.252 Fc1cccc(c1)C=Cc2ccccc2 271570a_100102525537_100000210277 [0,1,0,0,1,0|0,0,2]=4 5826 B16R2.252 Fc1cccc(c1)C=Cc2ccccc2 271570a_100102527694_100000685547 [0,1,0,0,1,0|0,0,2]=4 5827 B16R2.252 Fc1cccc(c1)CNc2ccccc2 207a_100000106764_100000210812 [0,1,0,0,1,0|1,0,0]=3 5828 B16R2.252 Fc1cccc(c1)CNc2ccccc2 270302a_100000106764_100000210812 [0,1,0,0,1,0|1,0,0]=3 5829 B16R2.252 Fc1cccc(c1)CNc2ccccc2 34a_100000106764_100000187166 [0,1,0,0,1,0|1,0,0]=3 5830 B16R2.252 Fc1cccc(c1)COc2ccccc2 34a_100000210340_100000187166 [0,1,0,0,1,0|0,0,0]=2 5831 B16R2.252 Fc1cccc(c1)COc2ccccc2 7a_100000210340_100000230114 [0,1,0,0,1,0|0,0,0]=2 5832 B16R2.252 Fc1cccc(c1)COc2cccnc2 34a_100000210849_100000187166 [0,1,0,0,1,0|1,0,0]=3 5833 B16R2.252 Fc1cccc(c1)COc2cccnc2 7a_100000210849_100000230114 [0,1,0,0,1,0|1,0,0]=3 5834 B16R2.252 Fc1cccc(c1)COc2ccncc2 34a_100000212176_100000187166 [0,1,0,0,1,0|1,0,0]=3 5835 B16R2.252 Fc1cccc(c1)COc2ccnnc2 34a_100015204005_100000187166 [0,1,0,0,1,0|2,0,0]=4 5836 B16R2.252 Fc1cccc(c1)COc2cncnc2 7a_100000754086_100000230114 [0,1,0,0,1,0|2,0,0]=4 5837 B16R2.252 Fc1cccc(c1)CSc2ccccc2 62a_100000230114_100000041952 [0,1,0,0,1,0|0,1,0]=3 5838 B16R2.252 Fc1cccc(c1)CSc2ccccc2 62a_100000719477_100000230114 [0,1,0,0,1,0|0,1,0]=3 5839 B16R2.252 Fc1cccc(c1)CSc2ccccn2 62a_100000230114_100011216584 [0,1,0,0,1,0|1,1,0]=4 5840 B16R2.252 Fc1cccc(c1)CSc2ccccn2 62a_100011216584_100000230114 [0,1,0,0,1,0|1,1,0]=4 5841 B16R2.252 Fc1cccc(c1)CSc2cccnc2 62a_100000210063_100000230114 [0,1,0,0,1,0|1,1,0]=4 5842 B16R2.252 Fc1cccc(c1)CSc2cccnc2 62a_100000230114_100000210063 [0,1,0,0,1,0|1,1,0]=4 5843 B16R2.252 Fc1cccc(c1)CSc2ccncc2 62a_100000230114_100000728582 [0,1,0,0,1,0|1,1,0]=4 5844 B16R2.252 Fc1cccc(c1)CSc2ccncc2 62a_100000728582_100000230114 [0,1,0,0,1,0|1,1,0]=4 5845 B16R2.252 Fc1cccc(c1)NCc2ccccc2 207a_100000210047_100015611070 [0,1,0,0,1,0|1,0,0]=3 5846 B16R2.252 Fc1cccc(c1)NCc2ccccc2 270302a_100000210047_100015611070 [0,1,0,0,1,0|1,0,0]=3 5847 B16R2.252 Fc1cccc(c1)NCc2ccccc2 34a_100000210047_100015291786 [0,1,0,0,1,0|1,0,0]=3 5848 B16R2.252 Fc1cccc(c1)NCc2ccccn2 207a_100000210047_100000209966 [0,1,0,0,1,0|2,0,0]=4 5849 B16R2.252 Fc1cccc(c1)NCc2ccccn2 270302a_100000210047_100000209966 [0,1,0,0,1,0|2,0,0]=4 5850 B16R2.252 Fc1cccc(c1)NCc2ccccn2 34a_100000210047_100000721315 [0,1,0,0,1,0|2,0,0]=4 5851 B16R2.252 Fc1cccc(c1)NCc2cccnc2 207a_100000210047_100000209961 [0,1,0,0,1,0|2,0,0]=4 5852 B16R2.252 Fc1cccc(c1)NCc2cccnc2 270302a_100000210047_100000209961 [0,1,0,0,1,0|2,0,0]=4 5853 B16R2.252 Fc1cccc(c1)NCc2cccnc2 34a_100000210047_100000733263 [0,1,0,0,1,0|2,0,0]=4 5854 B16R2.252 Fc1cccc(c1)NCc2ccncc2 207a_100000210047_100000186114 [0,1,0,0,1,0|2,0,0]=4 5855 B16R2.252 Fc1cccc(c1)OCc2ccccc2 34a_100000210426_100015291786 [0,1,0,0,1,0|0,0,0]=2 5856 B16R2.252 Fc1cccc(c1)OCc2ccccc2 7a_100000210426_100000211182 [0,1,0,0,1,0|0,0,0]=2 5857 B16R2.252 Fc1cccc(c1)OCc2ccccn2 34a_100000210426_100000721315 [0,1,0,0,1,0|1,0,0]=3 5858 B16R2.252 Fc1cccc(c1)OCc2ccccn2 7a_100000210426_100000721315 [0,1,0,0,1,0|1,0,0]=3 5859 B16R2.252 Fc1cccc(c1)OCc2cccnc2 34a_100000210426_100000733263 [0,1,0,0,1,0|1,0,0]=3 5860 B16R2.252 Fc1cccc(c1)OCc2cccnc2 7a_100000210426_100000741622 [0,1,0,0,1,0|1,0,0]=3 5861 B16R2.252 Fc1cccc(c1)OCc2cccnn2 34a_100000210426_100016990269 [0,1,0,0,1,0|2,0,0]=4 5862 B16R2.252 Fc1cccc(c1)OCc2cccnn2 7a_100000210426_100016990269 [0,1,0,0,1,0|2,0,0]=4 5863 B16R2.252 Fc1cccc(c1)OCc2ccncc2 7a_100000210426_100015193705 [0,1,0,0,1,0|1,0,0]=3 5864 B16R2.252 Fc1cccc(c1)OCc2cnccn2 34a_100000210426_100016995436 [0,1,0,0,1,0|2,0,0]=4 5865 B16R2.252 Fc1cccc(c1)OCc2cnccn2 7a_100000210426_100016995436 [0,1,0,0,1,0|2,0,0]=4 5866 B16R2.252 Fc1cccc(c1)OCc2cncnc2 34a_100000210426_100015196519 [0,1,0,0,1,0|2,0,0]=4 5867 B16R2.252 Fc1cccc(c1)OCc2cncnc2 7a_100000210426_100015196519 [0,1,0,0,1,0|2,0,0]=4 5868 B16R2.252 Fc1cccc(c1)OCc2ncccn2 34a_100000210426_100000703007 [0,1,0,0,1,0|2,0,0]=4 5869 B16R2.252 Fc1cccc(c1)OCc2ncccn2 7a_100000210426_100000703007 [0,1,0,0,1,0|2,0,0]=4 5870 B16R2.252 Fc1cccc(c1)SCc2ccccc2 62a_100000211182_100000685547 [0,1,0,0,1,0|0,1,0]=3 5871 B16R2.252 Fc1cccc(c1)SCc2ccccc2 62a_100000685547_100015291786 [0,1,0,0,1,0|0,1,0]=3 5872 B16R2.252 Fc1cccc(c1)SCc2ccccn2 62a_100000685547_100000721315 [0,1,0,0,1,0|1,1,0]=4 5873 B16R2.252 Fc1cccc(c1)SCc2ccccn2 62a_100000721315_100000685547 [0,1,0,0,1,0|1,1,0]=4 5874 B16R2.252 Fc1cccc(c1)SCc2cccnc2 62a_100000685547_100000741622 [0,1,0,0,1,0|1,1,0]=4 5875 B16R2.252 Fc1cccc(c1)SCc2cccnc2 62a_100000741622_100000685547 [0,1,0,0,1,0|1,1,0]=4 5876 B16R2.252 Fc1cccc(c1)SCc2ccncc2 62a_100000685547_100015193705 [0,1,0,0,1,0|1,1,0]=4 5877 B16R2.252 Fc1cccc(c1)SCc2ccncc2 62a_100015193705_100000685547 [0,1,0,0,1,0|1,1,0]=4 5878 B16R2.252 Fc1cccc(n1)CNc2ccccc2 34a_100000106764_100009819644 [0,1,0,0,1,0|2,0,0]=4 5879 B16R2.252 Fc1cccc(n1)COc2ccccc2 34a_100000210340_100009819644 [0,1,0,0,1,0|1,0,0]=3 5880 B16R2.252 Fc1cccc(n1)COc2ccccc2 7a_100000210340_100009819644 [0,1,0,0,1,0|1,0,0]=3 5881 B16R2.252 Fc1cccc(n1)COc2cccnc2 34a_100000210849_100009819644 [0,1,0,0,1,0|2,0,0]=4 5882 B16R2.252 Fc1cccc(n1)COc2cccnc2 7a_100000210849_100009819644 [0,1,0,0,1,0|2,0,0]=4 5883 B16R2.252 Fc1cccc(n1)COc2ccncc2 34a_100000212176_100009819644 [0,1,0,0,1,0|2,0,0]=4 5884 B16R2.252 Fc1cccc(n1)CSc2ccccc2 62a_100000719477_100009819644 [0,1,0,0,1,0|1,1,0]=4 5885 B16R2.252 Fc1cccc(n1)CSc2ccccc2 62a_100009819644_100000041952 [0,1,0,0,1,0|1,1,0]=4 5886 B16R2.252 Fc1cccc(n1)NCc2ccccc2 27a_100015324214_100009815982 [0,1,0,0,1,0|2,0,0]=4 5887 B16R2.252 Fc1cccc(n1)OCc2ccccc2 34a_100011432558_100015291786 [0,1,0,0,1,0|1,0,0]=3 5888 B16R2.252 Fc1cccc(n1)OCc2ccccn2 34a_100011432558_100000721315 [0,1,0,0,1,0|2,0,0]=4 5889 B16R2.252 Fc1cccc(n1)OCc2cccnc2 34a_100011432558_100000733263 [0,1,0,0,1,0|2,0,0]=4 5890 B16R2.252 Fc1cccc(n1)SCc2ccccc2 62a_100000211182_100009815982 [0,1,0,0,1,0|1,1,0]=4 5891 B16R2.252 Fc1cccc(n1)SCc2ccccc2 62a_100009815982_100015291786 [0,1,0,0,1,0|1,1,0]=4 5892 B16R2.252 Fc1ccnc(c1)NCc2ccccc2 27a_100015324214_100000764206 [0,1,0,0,1,0|2,0,0]=4 5893 B16R2.252 Fc1ccnc(c1)SCc2ccccc2 62a_100000211182_100000764206 [0,1,0,0,1,0|1,1,0]=4 5894 B16R2.252 Fc1ccnc(c1)SCc2ccccc2 62a_100000764206_100015291786 [0,1,0,0,1,0|1,1,0]=4 5895 B16R2.252 Fc1cncc(c1)CNc2ccccc2 207a_100000106764_100011361476 [0,1,0,0,1,0|2,0,0]=4 5896 B16R2.252 Fc1cncc(c1)CNc2ccccc2 270302a_100000106764_100011361476 [0,1,0,0,1,0|2,0,0]=4 5897 B16R2.252 Fc1cncc(c1)CNc2ccccc2 34a_100000106764_100000725299 [0,1,0,0,1,0|2,0,0]=4 5898 B16R2.252 Fc1cncc(c1)COc2ccccc2 34a_100000210340_100000725299 [0,1,0,0,1,0|1,0,0]=3 5899 B16R2.252 Fc1cncc(c1)COc2ccccc2 7a_100000210340_100000725299 [0,1,0,0,1,0|1,0,0]=3 5900 B16R2.252 Fc1cncc(c1)COc2cccnc2 34a_100000210849_100000725299 [0,1,0,0,1,0|2,0,0]=4 5901 B16R2.252 Fc1cncc(c1)COc2cccnc2 7a_100000210849_100000725299 [0,1,0,0,1,0|2,0,0]=4 5902 B16R2.252 Fc1cncc(c1)COc2ccncc2 34a_100000212176_100000725299 [0,1,0,0,1,0|2,0,0]=4 5903 B16R2.252 Fc1cncc(c1)CSc2ccccc2 62a_100000719477_100000725299 [0,1,0,0,1,0|1,1,0]=4 5904 B16R2.252 Fc1cncc(c1)CSc2ccccc2 62a_100000725299_100000041952 [0,1,0,0,1,0|1,1,0]=4 5905 B16R2.252 Fc1cncc(c1)OCc2ccccc2 34a_100011830296_100015291786 [0,1,0,0,1,0|1,0,0]=3 5906 B16R2.252 Fc1cncc(c1)OCc2ccccc2 7a_100011830296_100000211182 [0,1,0,0,1,0|1,0,0]=3 5907 B16R2.252 Fc1cncc(c1)OCc2ccccn2 34a_100011830296_100000721315 [0,1,0,0,1,0|2,0,0]=4 5908 B16R2.252 Fc1cncc(c1)OCc2ccccn2 7a_100011830296_100000721315 [0,1,0,0,1,0|2,0,0]=4 5909 B16R2.252 Fc1cncc(c1)OCc2cccnc2 34a_100011830296_100000733263 [0,1,0,0,1,0|2,0,0]=4 5910 B16R2.252 Fc1cncc(c1)OCc2cccnc2 7a_100011830296_100000741622 [0,1,0,0,1,0|2,0,0]=4 5911 B16R2.252 Fc1cncc(c1)OCc2ccncc2 7a_100011830296_100015193705 [0,1,0,0,1,0|2,0,0]=4 5912 B16R2.252 Fc1cncc(c1)SCc2ccccc2 62a_100000211182_100000744099 [0,1,0,0,1,0|1,1,0]=4 5913 B16R2.252 Fc1cncc(c1)SCc2ccccc2 62a_100000744099_100015291786 [0,1,0,0,1,0|1,1,0]=4 5914 B16R2.252 Ic1cccc(c1)CNc2ccccc2 207a_100000106764_100000014684 [0,1,0,0,1,0|1,0,0]=3 5915 B16R2.252 Ic1cccc(c1)CNc2ccccc2 270302a_100000106764_100000014684 [0,1,0,0,1,0|1,0,0]=3 5916 B16R2.252 Ic1cccc(c1)CNc2ccccc2 34a_100000106764_100011218688 [0,1,0,0,1,0|1,0,0]=3 5917 B16R2.252 Ic1cccc(c1)COc2ccccc2 34a_100000210340_100011218688 [0,1,0,0,1,0|0,0,0]=2 5918 B16R2.252 Ic1cccc(c1)COc2ccccc2 7a_100000210340_100011218688 [0,1,0,0,1,0|0,0,0]=2 5919 B16R2.252 Ic1cccc(c1)COc2cccnc2 34a_100000210849_100011218688 [0,1,0,0,1,0|1,0,0]=3 5920 B16R2.252 Ic1cccc(c1)COc2cccnc2 7a_100000210849_100011218688 [0,1,0,0,1,0|1,0,0]=3 5921 B16R2.252 Ic1cccc(c1)COc2ccncc2 34a_100000212176_100011218688 [0,1,0,0,1,0|1,0,0]=3 5922 B16R2.252 Ic1cccc(c1)COc2ccnnc2 34a_100015204005_100011218688 [0,1,0,0,1,0|2,0,0]=4 5923 B16R2.252 Ic1cccc(c1)COc2cncnc2 7a_100000754086_100011218688 [0,1,0,0,1,0|2,0,0]=4 5924 B16R2.252 Ic1cccc(c1)CSc2ccccc2 62a_100000719477_100011218688 [0,1,0,0,1,0|0,1,0]=3 5925 B16R2.252 Ic1cccc(c1)CSc2ccccc2 62a_100011218688_100000041952 [0,1,0,0,1,0|0,1,0]=3 5926 B16R2.252 Ic1cccc(c1)CSc2ccccn2 62a_100011216584_100011218688 [0,1,0,0,1,0|1,1,0]=4 5927 B16R2.252 Ic1cccc(c1)CSc2ccccn2 62a_100011218688_100011216584 [0,1,0,0,1,0|1,1,0]=4 5928 B16R2.252 Ic1cccc(c1)CSc2cccnc2 62a_100000210063_100011218688 [0,1,0,0,1,0|1,1,0]=4 5929 B16R2.252 Ic1cccc(c1)CSc2cccnc2 62a_100011218688_100000210063 [0,1,0,0,1,0|1,1,0]=4 5930 B16R2.252 Ic1cccc(c1)CSc2ccncc2 62a_100000728582_100011218688 [0,1,0,0,1,0|1,1,0]=4 5931 B16R2.252 Ic1cccc(c1)CSc2ccncc2 62a_100011218688_100000728582 [0,1,0,0,1,0|1,1,0]=4 5932 B16R2.252 Ic1cccc(c1)NCc2ccccc2 207a_100000211102_100015611070 [0,1,0,0,1,0|1,0,0]=3 5933 B16R2.252 Ic1cccc(c1)NCc2ccccc2 270302a_100000211102_100015611070 [0,1,0,0,1,0|1,0,0]=3 5934 B16R2.252 Ic1cccc(c1)NCc2ccccc2 34a_100000211102_100015291786 [0,1,0,0,1,0|1,0,0]=3 5935 B16R2.252 Ic1cccc(c1)NCc2ccccn2 207a_100000211102_100000209966 [0,1,0,0,1,0|2,0,0]=4 5936 B16R2.252 Ic1cccc(c1)NCc2ccccn2 270302a_100000211102_100000209966 [0,1,0,0,1,0|2,0,0]=4 5937 B16R2.252 Ic1cccc(c1)NCc2ccccn2 34a_100000211102_100000721315 [0,1,0,0,1,0|2,0,0]=4 5938 B16R2.252 Ic1cccc(c1)NCc2cccnc2 207a_100000211102_100000209961 [0,1,0,0,1,0|2,0,0]=4 5939 B16R2.252 Ic1cccc(c1)NCc2cccnc2 270302a_100000211102_100000209961 [0,1,0,0,1,0|2,0,0]=4 5940 B16R2.252 Ic1cccc(c1)NCc2cccnc2 34a_100000211102_100000733263 [0,1,0,0,1,0|2,0,0]=4 5941 B16R2.252 Ic1cccc(c1)NCc2ccncc2 207a_100000211102_100000186114 [0,1,0,0,1,0|2,0,0]=4 5942 B16R2.252 Ic1cccc(c1)OCc2ccccc2 34a_100000211634_100015291786 [0,1,0,0,1,0|0,0,0]=2 5943 B16R2.252 Ic1cccc(c1)OCc2ccccc2 7a_100000211634_100000211182 [0,1,0,0,1,0|0,0,0]=2 5944 B16R2.252 Ic1cccc(c1)OCc2ccccn2 34a_100000211634_100000721315 [0,1,0,0,1,0|1,0,0]=3 5945 B16R2.252 Ic1cccc(c1)OCc2ccccn2 7a_100000211634_100000721315 [0,1,0,0,1,0|1,0,0]=3 5946 B16R2.252 Ic1cccc(c1)OCc2cccnc2 34a_100000211634_100000733263 [0,1,0,0,1,0|1,0,0]=3 5947 B16R2.252 Ic1cccc(c1)OCc2cccnc2 7a_100000211634_100000741622 [0,1,0,0,1,0|1,0,0]=3 5948 B16R2.252 Ic1cccc(c1)OCc2cccnn2 34a_100000211634_100016990269 [0,1,0,0,1,0|2,0,0]=4 5949 B16R2.252 Ic1cccc(c1)OCc2cccnn2 7a_100000211634_100016990269 [0,1,0,0,1,0|2,0,0]=4 5950 B16R2.252 Ic1cccc(c1)OCc2ccncc2 7a_100000211634_100015193705 [0,1,0,0,1,0|1,0,0]=3 5951 B16R2.252 Ic1cccc(c1)OCc2cnccn2 34a_100000211634_100016995436 [0,1,0,0,1,0|2,0,0]=4 5952 B16R2.252 Ic1cccc(c1)OCc2cnccn2 7a_100000211634_100016995436 [0,1,0,0,1,0|2,0,0]=4 5953 B16R2.252 Ic1cccc(c1)OCc2cncnc2 34a_100000211634_100015196519 [0,1,0,0,1,0|2,0,0]=4 5954 B16R2.252 Ic1cccc(c1)OCc2cncnc2 7a_100000211634_100015196519 [0,1,0,0,1,0|2,0,0]=4 5955 B16R2.252 Ic1cccc(c1)OCc2ncccn2 34a_100000211634_100000703007 [0,1,0,0,1,0|2,0,0]=4 5956 B16R2.252 Ic1cccc(c1)OCc2ncccn2 7a_100000211634_100000703007 [0,1,0,0,1,0|2,0,0]=4 5957 B16R2.252 Nc1cc(ccn1)OCc2ccccc2 34a_100011834064_100015291786 [0,1,0,0,1,0|1,0,0]=3 5958 B16R2.252 Nc1cc(ccn1)OCc2ccccn2 34a_100011834064_100000721315 [0,1,0,0,1,0|2,0,0]=4 5959 B16R2.252 Nc1cc(ccn1)OCc2cccnc2 34a_100011834064_100000733263 [0,1,0,0,1,0|2,0,0]=4 5960 B16R2.252 Nc1cc(ccn1)SCc2ccccc2 62a_100000049665_100015291786 [0,1,0,0,1,0|1,1,0]=4 5961 B16R2.252 Nc1cc(ccn1)SCc2ccccc2 62a_100000211182_100000049665 [0,1,0,0,1,0|1,1,0]=4 5962 B16R2.252 Nc1cc(cnn1)OCc2ccccc2 34a_200015193112_100015291786 [0,1,0,0,1,0|2,0,0]=4 5963 B16R2.252 Nc1cccc(c1)C#Cc2ccccc2 271570a_100000069678_100000210019 [0,1,0,0,1,0|0,0,2]=4 5964 B16R2.252 Nc1cccc(c1)C=Cc2ccccc2 271570a_100102527694_100000210019 [0,1,0,0,1,0|0,0,2]=4 5965 B16R2.252 Nc1cccc(c1)OCc2ccccc2 34a_100000210217_100015291786 [0,1,0,0,1,0|0,0,0]=2 5966 B16R2.252 Nc1cccc(c1)OCc2ccccn2 34a_100000210217_100000721315 [0,1,0,0,1,0|1,0,0]=3 5967 B16R2.252 Nc1cccc(c1)OCc2cccnc2 34a_100000210217_100000733263 [0,1,0,0,1,0|1,0,0]=3 5968 B16R2.252 Nc1cccc(c1)OCc2cccnn2 34a_100000210217_100016990269 [0,1,0,0,1,0|2,0,0]=4 5969 B16R2.252 Nc1cccc(c1)OCc2cnccn2 34a_100000210217_100016995436 [0,1,0,0,1,0|2,0,0]=4 5970 B16R2.252 Nc1cccc(c1)OCc2cncnc2 34a_100000210217_100015196519 [0,1,0,0,1,0|2,0,0]=4 5971 B16R2.252 Nc1cccc(c1)OCc2ncccn2 34a_100000210217_100000703007 [0,1,0,0,1,0|2,0,0]=4 5972 B16R2.252 Nc1cccc(c1)SCc2ccccc2 62a_100000210019_100015291786 [0,1,0,0,1,0|0,1,0]=3 5973 B16R2.252 Nc1cccc(c1)SCc2ccccc2 62a_100000211182_100000210019 [0,1,0,0,1,0|0,1,0]=3 5974 B16R2.252 Nc1cccc(c1)SCc2ccccn2 62a_100000210019_100000721315 [0,1,0,0,1,0|1,1,0]=4 5975 B16R2.252 Nc1cccc(c1)SCc2ccccn2 62a_100000721315_100000210019 [0,1,0,0,1,0|1,1,0]=4 5976 B16R2.252 Nc1cccc(c1)SCc2cccnc2 62a_100000210019_100000741622 [0,1,0,0,1,0|1,1,0]=4 5977 B16R2.252 Nc1cccc(c1)SCc2cccnc2 62a_100000741622_100000210019 [0,1,0,0,1,0|1,1,0]=4 5978 B16R2.252 Nc1cccc(c1)SCc2ccncc2 62a_100000210019_100015193705 [0,1,0,0,1,0|1,1,0]=4 5979 B16R2.252 Nc1cccc(c1)SCc2ccncc2 62a_100015193705_100000210019 [0,1,0,0,1,0|1,1,0]=4 5980 B16R2.252 Nc1cccc(n1)SCc2ccccc2 62a_100000211182_100000740741 [0,1,0,0,1,0|1,1,0]=4 5981 B16R2.252 Nc1cccc(n1)SCc2ccccc2 62a_100000740741_100015291786 [0,1,0,0,1,0|1,1,0]=4 5982 B16R2.252 Nc1ccnc(c1)SCc2ccccc2 62a_100000211182_100009814236 [0,1,0,0,1,0|1,1,0]=4 5983 B16R2.252 Nc1ccnc(c1)SCc2ccccc2 62a_100009814236_100015291786 [0,1,0,0,1,0|1,1,0]=4 5984 B16R2.252 Nc1cncc(c1)OCc2ccccc2 34a_100011997051_100015291786 [0,1,0,0,1,0|1,0,0]=3 5985 B16R2.252 Nc1cncc(c1)OCc2ccccn2 34a_100011997051_100000721315 [0,1,0,0,1,0|2,0,0]=4 5986 B16R2.252 Nc1cncc(c1)OCc2cccnc2 34a_100011997051_100000733263 [0,1,0,0,1,0|2,0,0]=4 5987 B16R2.252 Nc1cncc(c1)SCc2ccccc2 62a_100000211182_100000687067 [0,1,0,0,1,0|1,1,0]=4 5988 B16R2.252 Nc1cncc(c1)SCc2ccccc2 62a_100000687067_100015291786 [0,1,0,0,1,0|1,1,0]=4 5989 B16R2.252 O=c1cc(cc[nH]1)NCc2ccccc2 27a_100015324214_100000061649 [0,1,0,0,1,0|2,0,0]=4 5990 B16R2.252 O=c1cc(cc[nH]1)OCc2ccccc2 34a_100000032262_100015291786 [0,1,0,0,1,0|1,0,0]=3 5991 B16R2.252 O=c1cc(cc[nH]1)OCc2ccccn2 34a_100000032262_100000721315 [0,1,0,0,1,0|2,0,0]=4 5992 B16R2.252 O=c1cc(cc[nH]1)OCc2cccnc2 34a_100000032262_100000733263 [0,1,0,0,1,0|2,0,0]=4 5993 B16R2.252 O=c1cc(cc[nH]1)SCc2ccccc2 62a_100000211182_100009816521 [0,1,0,0,1,0|1,1,0]=4 5994 B16R2.252 O=c1cc(cc[nH]1)SCc2ccccc2 62a_100009816521_100015291786 [0,1,0,0,1,0|1,1,0]=4 5995 B16R2.252 O=c1cc[nH]c(c1)SCc2ccccc2 62a_100009817434_100015291786 [0,1,0,0,1,0|1,1,0]=4 5996 B16R2.252 O=c1cccc([nH]1)CNc2ccccc2 207a_100000106764_100011935257 [0,1,0,0,1,0|2,0,0]=4 5997 B16R2.252 O=c1cccc([nH]1)OCc2ccccc2 34a_100000033347_100015291786 [0,1,0,0,1,0|1,0,0]=3 5998 B16R2.252 O=c1cccc([nH]1)OCc2ccccn2 34a_100000033347_100000721315 [0,1,0,0,1,0|2,0,0]=4 5999 B16R2.252 O=c1cccc([nH]1)OCc2cccnc2 34a_100000033347_100000733263 [0,1,0,0,1,0|2,0,0]=4 6000 B16R2.252 O=c1cccc([nH]1)SCc2ccccc2 62a_100000211182_100000752884 [0,1,0,0,1,0|1,1,0]=4 6001 B16R2.252 Oc1cc(ccn1)CNc2ccccc2 207a_100000106764_100000688113 [0,1,0,0,1,0|2,0,0]=4 6002 B16R2.252 Oc1cc(ccn1)OCc2ccccc2 271570a_203496583355_200000766317 [0,1,0,0,1,0|1,0,0]=3 6003 B16R2.252 Oc1cc(cnn1)OCc2ccccc2 271570a_203496583355_200010116973 [0,1,0,0,1,0|2,0,0]=4 6004 B16R2.252 Oc1cccc(c1)C#Cc2ccccc2 271570a_100000069678_100000211634 [0,1,0,0,1,0|0,0,2]=4 6005 B16R2.252 Oc1cccc(c1)C=Cc2ccccc2 271570a_100102527694_100000211634 [0,1,0,0,1,0|0,0,2]=4 6006 B16R2.252 Oc1cccc(c1)CNc2ccccc2 207a_100000106764_100000188321 [0,1,0,0,1,0|1,0,0]=3 6007 B16R2.252 Oc1cccc(c1)CNc2ccccc2 34a_100000106764_100011660834 [0,1,0,0,1,0|1,0,0]=3 6008 B16R2.252 Oc1cccc(c1)COc2ccccc2 271570a_203496583355_100000173242 [0,1,0,0,1,0|0,0,0]=2 6009 B16R2.252 Oc1cccc(c1)COc2ccccc2 34a_100000210340_100011660834 [0,1,0,0,1,0|0,0,0]=2 6010 B16R2.252 Oc1cccc(c1)COc2ccccc2 7a_100000210340_100000084143 [0,1,0,0,1,0|0,0,0]=2 6011 B16R2.252 Oc1cccc(c1)COc2cccnc2 34a_100000210849_100011660834 [0,1,0,0,1,0|1,0,0]=3 6012 B16R2.252 Oc1cccc(c1)COc2cccnc2 7a_100000210849_100000084143 [0,1,0,0,1,0|1,0,0]=3 6013 B16R2.252 Oc1cccc(c1)COc2ccncc2 34a_100000212176_100011660834 [0,1,0,0,1,0|1,0,0]=3 6014 B16R2.252 Oc1cccc(c1)COc2ccnnc2 34a_100015204005_100011660834 [0,1,0,0,1,0|2,0,0]=4 6015 B16R2.252 Oc1cccc(c1)COc2cncnc2 7a_100000754086_100000084143 [0,1,0,0,1,0|2,0,0]=4 6016 B16R2.252 Oc1cccc(c1)CSc2ccccc2 62a_100000719477_100011660834 [0,1,0,0,1,0|0,1,0]=3 6017 B16R2.252 Oc1cccc(c1)CSc2ccccc2 62a_100011660834_100000041952 [0,1,0,0,1,0|0,1,0]=3 6018 B16R2.252 Oc1cccc(c1)CSc2ccccn2 62a_100011216584_100011660834 [0,1,0,0,1,0|1,1,0]=4 6019 B16R2.252 Oc1cccc(c1)CSc2ccccn2 62a_100011660834_100011216584 [0,1,0,0,1,0|1,1,0]=4 6020 B16R2.252 Oc1cccc(c1)CSc2cccnc2 62a_100000210063_100011660834 [0,1,0,0,1,0|1,1,0]=4 6021 B16R2.252 Oc1cccc(c1)CSc2cccnc2 62a_100011660834_100000210063 [0,1,0,0,1,0|1,1,0]=4 6022 B16R2.252 Oc1cccc(c1)CSc2ccncc2 62a_100000728582_100011660834 [0,1,0,0,1,0|1,1,0]=4 6023 B16R2.252 Oc1cccc(c1)CSc2ccncc2 62a_100011660834_100000728582 [0,1,0,0,1,0|1,1,0]=4 6024 B16R2.252 Oc1cccc(c1)NCc2ccccc2 270302a_100000210217_100015611070 [0,1,0,0,1,0|1,0,0]=3 6025 B16R2.252 Oc1cccc(c1)NCc2ccccc2 271570a_203496583355_100000224063 [0,1,0,0,1,0|1,0,0]=3 6026 B16R2.252 Oc1cccc(c1)NCc2ccccc2 34a_100000210217_100015291786 [0,1,0,0,1,0|1,0,0]=3 6027 B16R2.252 Oc1cccc(c1)NCc2ccccn2 270302a_100000210217_100000209966 [0,1,0,0,1,0|2,0,0]=4 6028 B16R2.252 Oc1cccc(c1)NCc2ccccn2 34a_100000210217_100000721315 [0,1,0,0,1,0|2,0,0]=4 6029 B16R2.252 Oc1cccc(c1)NCc2cccnc2 270302a_100000210217_100000209961 [0,1,0,0,1,0|2,0,0]=4 6030 B16R2.252 Oc1cccc(c1)NCc2cccnc2 34a_100000210217_100000733263 [0,1,0,0,1,0|2,0,0]=4 6031 B16R2.252 Oc1cccc(c1)OCc2ccccc2 271570a_203496583355_100000151840 [0,1,0,0,1,0|0,0,0]=2 6032 B16R2.252 Oc1cccc(c1)OCc2ccccn2 271570a_203496583355_200011214830 [0,1,0,0,1,0|1,0,0]=3 6033 B16R2.252 Oc1cccc(c1)SCc2ccccc2 271570a_203496583355_100103287807 [0,1,0,0,1,0|0,1,0]=3 6034 B16R2.252 Oc1cccc(c1)SCc2ccccc2 62a_100000211182_100000211634 [0,1,0,0,1,0|0,1,0]=3 6035 B16R2.252 Oc1cccc(c1)SCc2ccccn2 62a_100000721315_100000211634 [0,1,0,0,1,0|1,1,0]=4 6036 B16R2.252 Oc1cccc(c1)SCc2cccnc2 62a_100000741622_100000211634 [0,1,0,0,1,0|1,1,0]=4 6037 B16R2.252 Oc1cccc(c1)SCc2ccncc2 62a_100015193705_100000211634 [0,1,0,0,1,0|1,1,0]=4 6038 B16R2.252 Oc1cccc(n1)NCc2ccccc2 271570a_203496583355_200011960457 [0,1,0,0,1,0|2,0,0]=4 6039 B16R2.252 Oc1cccc(n1)OCc2ccccc2 271570a_203496583355_100011960212 [0,1,0,0,1,0|1,0,0]=3 6040 B16R2.252 Oc1ccnc(c1)OCc2ccccc2 271570a_203496583355_200010986176 [0,1,0,0,1,0|1,0,0]=3 6041 B16R2.252 Oc1ccnc(c1)SCc2ccccc2 271570a_203496583355_100042452854 [0,1,0,0,1,0|1,1,0]=4 6042 B16R2.252 Oc1ccnc(c1)SCc2ccccc2 62a_100000211182_100000762945 [0,1,0,0,1,0|1,1,0]=4 6043 B16R2.252 Oc1cncc(c1)CNc2ccccc2 207a_100000106764_100012187055 [0,1,0,0,1,0|2,0,0]=4 6044 B16R2.252 Oc1cncc(c1)OCc2ccccc2 271570a_203496583355_100012029532 [0,1,0,0,1,0|1,0,0]=3 6045 B16R2.252 Oc1cncc(c1)SCc2ccccc2 62a_100000211182_100000754920 [0,1,0,0,1,0|1,1,0]=4 6046 B16R2.252 Oc1cncc(c1)SCc2ccccc2 62a_100000754920_100015291786 [0,1,0,0,1,0|1,1,0]=4 6047 B16R2.252 Oc1cncc(n1)OCc2ccccc2 271570a_203496583355_100000243162 [0,1,0,0,1,0|2,0,0]=4 6048 B16R2.252 Oc1nccc(n1)OCc2ccccc2 271570a_203496583355_100000694416 [0,1,0,0,1,0|2,0,0]=4 6049 B16R2.252 [O-][n+]1cccc(c1)OCc2ccccc2 34a_100000039713_100015291786 [0,1,0,0,1,0|1,0,0]=3 6050 B16R2.252 [O-][n+]1cccc(c1)OCc2ccccc2 7a_100000039713_100000211182 [0,1,0,0,1,0|1,0,0]=3 6051 B16R2.252 [O-][n+]1cccc(c1)OCc2ccccn2 34a_100000039713_100000721315 [0,1,0,0,1,0|2,0,0]=4 6052 B16R2.252 [O-][n+]1cccc(c1)OCc2ccccn2 7a_100000039713_100000721315 [0,1,0,0,1,0|2,0,0]=4 6053 B16R2.252 [O-][n+]1cccc(c1)OCc2cccnc2 34a_100000039713_100000733263 [0,1,0,0,1,0|2,0,0]=4 6054 B16R2.252 [O-][n+]1cccc(c1)OCc2cccnc2 7a_100000039713_100000741622 [0,1,0,0,1,0|2,0,0]=4 6055 B16R2.252 [O-][n+]1cccc(c1)OCc2ccncc2 7a_100000039713_100015193705 [0,1,0,0,1,0|2,0,0]=4 6056 B16R2.252 [O-][n+]1cccc(c1)SCc2ccccc2 62a_100000211182_100009815978 [0,1,0,0,1,0|1,1,0]=4 6057 B16R2.252 [S]c1cccc(c1)C#Cc2ccccc2 271570a_100000069678_114929384022 [0,1,0,0,1,0|0,0,2]=4 6058 B16R2.252 [S]c1cccc(c1)C=Cc2ccccc2 271570a_100102527694_114929384022 [0,1,0,0,1,0|0,0,2]=4 6059 B16R2.252 [S]c1cccc(c1)SCc2ccccc2 62a_100000211182_114929384022 [0,1,0,0,1,0|0,1,0]=3 6060 B16R2.252 [S]c1cccc(c1)SCc2ccccc2 62a_114929384022_100015291786 [0,1,0,0,1,0|0,1,0]=3 6061 B16R2.252 [S]c1cccc(c1)SCc2ccccn2 62a_100000721315_114929384022 [0,1,0,0,1,0|1,1,0]=4 6062 B16R2.252 [S]c1cccc(c1)SCc2ccccn2 62a_114929384022_100000721315 [0,1,0,0,1,0|1,1,0]=4 6063 B16R2.252 [S]c1cccc(c1)SCc2cccnc2 62a_100000741622_114929384022 [0,1,0,0,1,0|1,1,0]=4 6064 B16R2.252 [S]c1cccc(c1)SCc2cccnc2 62a_114929384022_100000741622 [0,1,0,0,1,0|1,1,0]=4 6065 B16R2.252 [S]c1cccc(c1)SCc2ccncc2 62a_100015193705_114929384022 [0,1,0,0,1,0|1,1,0]=4 6066 B16R2.252 [S]c1cccc(c1)SCc2ccncc2 62a_114929384022_100015193705 [0,1,0,0,1,0|1,1,0]=4 6067 B16R2.135 Brc1ccc(cc1)CNCc2ccco2 207a_100000174875_100000186105 [0,1,0,0,1,0|2,0,0]=4 6068 B16R2.135 Brc1ccc(cc1)CNCc2ccco2 207a_100000185738_100000186029 [0,1,0,0,1,0|2,0,0]=4 6069 B16R2.135 Brc1ccc(cc1)CNCc2ccco2 2230a_100000185738_100011217064 [0,1,0,0,1,0|2,0,0]=4 6070 B16R2.135 Brc1ccc(cc1)CNCc2ccco2 270004a_100000174875_100000186105 [0,1,0,0,1,0|2,0,0]=4 6071 B16R2.135 Brc1ccc(cc1)CNCc2ccco2 270004a_100000185738_100000186029 [0,1,0,0,1,0|2,0,0]=4 6072 B16R2.135 Brc1ccc(cc1)CNCc2ccco2 34a_100000185738_100000189115 [0,1,0,0,1,0|2,0,0]=4 6073 B16R2.135 Brc1ccc(cc1)CNCc2cccs2 207a_100000174875_100000209959 [0,1,0,0,1,0|2,0,0]=4 6074 B16R2.135 Brc1ccc(cc1)CNCc2cccs2 207a_100000211653_100000186029 [0,1,0,0,1,0|2,0,0]=4 6075 B16R2.135 Brc1ccc(cc1)CNCc2cccs2 2230a_100000211653_100011217064 [0,1,0,0,1,0|2,0,0]=4 6076 B16R2.135 Brc1ccc(cc1)CNCc2cccs2 270004a_100000174875_100000209959 [0,1,0,0,1,0|2,0,0]=4 6077 B16R2.135 Brc1ccc(cc1)CNCc2cccs2 270004a_100000211653_100000186029 [0,1,0,0,1,0|2,0,0]=4 6078 B16R2.135 Brc1ccc(cc1)CNCc2ccoc2 207a_100000174875_100011215517 [0,1,0,0,1,0|2,0,0]=4 6079 B16R2.135 Brc1ccc(cc1)CNCc2ccoc2 207a_100015206860_100000186029 [0,1,0,0,1,0|2,0,0]=4 6080 B16R2.135 Brc1ccc(cc1)CNCc2ccoc2 2230a_100015206860_100011217064 [0,1,0,0,1,0|2,0,0]=4 6081 B16R2.135 Brc1ccc(cc1)CNCc2ccoc2 270004a_100000174875_100011215517 [0,1,0,0,1,0|2,0,0]=4 6082 B16R2.135 Brc1ccc(cc1)CNCc2ccoc2 270004a_100015206860_100000186029 [0,1,0,0,1,0|2,0,0]=4 6083 B16R2.135 Brc1ccc(cc1)CNCc2ccoc2 34a_100015206860_100000189115 [0,1,0,0,1,0|2,0,0]=4 6084 B16R2.135 Brc1ccc(cc1)CNCc2ccsc2 207a_100000174875_100000188534 [0,1,0,0,1,0|2,0,0]=4 6085 B16R2.135 Brc1ccc(cc1)CNCc2ccsc2 207a_100000186416_100000186029 [0,1,0,0,1,0|2,0,0]=4 6086 B16R2.135 Brc1ccc(cc1)CNCc2ccsc2 2230a_100000174875_100011261437 [0,1,0,0,1,0|2,0,0]=4 6087 B16R2.135 Brc1ccc(cc1)CNCc2ccsc2 2230a_100000186416_100011217064 [0,1,0,0,1,0|2,0,0]=4 6088 B16R2.135 Brc1ccc(cc1)CNCc2ccsc2 270004a_100000174875_100000188534 [0,1,0,0,1,0|2,0,0]=4 6089 B16R2.135 Brc1ccc(cc1)CNCc2ccsc2 270004a_100000186416_100000186029 [0,1,0,0,1,0|2,0,0]=4 6090 B16R2.135 Brc1ccc(cc1)CNCc2ccsc2 34a_100000174875_100011261437 [0,1,0,0,1,0|2,0,0]=4 6091 B16R2.135 Brc1ccc(cc1)CNCc2ccsc2 34a_100000186416_100000189115 [0,1,0,0,1,0|2,0,0]=4 6092 B16R2.135 Brc1ccc(cc1)COCc2c[nH]cn2 34a_100000695286_100000707719 [0,1,0,0,1,0|2,0,0]=4 6093 B16R2.135 Brc1ccc(cc1)COCc2ccco2 34a_100000210059_100000189115 [0,1,0,0,1,0|1,0,0]=3 6094 B16R2.135 Brc1ccc(cc1)COCc2cccs2 34a_100000211240_100000189115 [0,1,0,0,1,0|1,0,0]=3 6095 B16R2.135 Brc1ccc(cc1)COCc2ccn[nH]2 34a_100000695286_100000728653 [0,1,0,0,1,0|2,0,0]=4 6096 B16R2.135 Brc1ccc(cc1)COCc2ccno2 34a_100000740478_100000189115 [0,1,0,0,1,0|2,0,0]=4 6097 B16R2.135 Brc1ccc(cc1)COCc2ccoc2 34a_100011215357_100000189115 [0,1,0,0,1,0|1,0,0]=3 6098 B16R2.135 Brc1ccc(cc1)COCc2ccon2 34a_100000695286_100000234950 [0,1,0,0,1,0|2,0,0]=4 6099 B16R2.135 Brc1ccc(cc1)COCc2ccsc2 34a_100000695286_100011261437 [0,1,0,0,1,0|1,0,0]=3 6100 B16R2.135 Brc1ccc(cc1)COCc2ccsc2 34a_100011215551_100000189115 [0,1,0,0,1,0|1,0,0]=3 6101 B16R2.135 Brc1ccc(cc1)COCc2cncs2 34a_100000695286_100015185245 [0,1,0,0,1,0|2,0,0]=4 6102 B16R2.135 Brc1ccc(cc1)COCc2cscn2 34a_100000695286_100000205941 [0,1,0,0,1,0|2,0,0]=4 6103 B16R2.135 Brc1ccc(cc1)COCc2ncc[nH]2 34a_100000695286_100016991755 [0,1,0,0,1,0|2,0,0]=4 6104 B16R2.135 Brc1ccc(cc1)COCc2ncco2 34a_100000062594_100000189115 [0,1,0,0,1,0|2,0,0]=4 6105 B16R2.135 Brc1ccc(cc1)COCc2ncco2 34a_100000695286_103436540062 [0,1,0,0,1,0|2,0,0]=4 6106 B16R2.135 Brc1ccc(cc1)COCc2nccs2 34a_100000695286_100015184050 [0,1,0,0,1,0|2,0,0]=4 6107 B16R2.135 Brc1ccc(cc1)COCn2cccn2 34a_100000731028_100000189115 [0,1,0,0,1,0|2,0,0]=4 6108 B16R2.135 Brc1ccc(cc1)CSCc2ccsc2 62a_100000189115_100011233845 [0,1,0,0,1,0|1,1,0]=4 6109 B16R2.135 Brc1ccc(cc1)CSCc2ccsc2 62a_100011261437_100000189115 [0,1,0,0,1,0|1,1,0]=4 6110 B16R2.135 Brc1ccc(cn1)COCc2ccco2 34a_100000210059_100009831999 [0,1,0,0,1,0|2,0,0]=4 6111 B16R2.135 Brc1ccc(cn1)COCc2cccs2 34a_100000211240_100009831999 [0,1,0,0,1,0|2,0,0]=4 6112 B16R2.135 Brc1ccc(cn1)COCc2ccoc2 34a_100011215357_100009831999 [0,1,0,0,1,0|2,0,0]=4 6113 B16R2.135 Brc1ccc(cn1)COCc2ccsc2 34a_100009816760_100011261437 [0,1,0,0,1,0|2,0,0]=4 6114 B16R2.135 Brc1ccc(cn1)COCc2ccsc2 34a_100011215551_100009831999 [0,1,0,0,1,0|2,0,0]=4 6115 B16R2.135 Brc1ccc(cn1)COCc2ccsc2 7a_100009816760_100011261437 [0,1,0,0,1,0|2,0,0]=4 6116 B16R2.135 Brc1ccc(nc1)COCc2ccco2 34a_100000210059_100000702658 [0,1,0,0,1,0|2,0,0]=4 6117 B16R2.135 Brc1ccc(nc1)COCc2cccs2 34a_100000211240_100000702658 [0,1,0,0,1,0|2,0,0]=4 6118 B16R2.135 Brc1ccc(nc1)COCc2ccoc2 34a_100011215357_100000702658 [0,1,0,0,1,0|2,0,0]=4 6119 B16R2.135 Brc1ccc(nc1)COCc2ccsc2 34a_100000754261_100011261437 [0,1,0,0,1,0|2,0,0]=4 6120 B16R2.135 Brc1ccc(nc1)COCc2ccsc2 34a_100011215551_100000702658 [0,1,0,0,1,0|2,0,0]=4 6121 B16R2.135 C[n+]1ccc(cc1)COCc2ccsc2 34a_100009831711_100011261437 [0,1,0,0,1,0|2,0,0]=4 6122 B16R2.135 Cc1ccc(cc1)CNCc2ccco2 207a_100000174908_100000186105 [0,1,0,0,1,0|2,0,0]=4 6123 B16R2.135 Cc1ccc(cc1)CNCc2ccco2 207a_100000185738_100000211033 [0,1,0,0,1,0|2,0,0]=4 6124 B16R2.135 Cc1ccc(cc1)CNCc2ccco2 2230a_100000185738_100000210814 [0,1,0,0,1,0|2,0,0]=4 6125 B16R2.135 Cc1ccc(cc1)CNCc2ccco2 270004a_100000174908_100000186105 [0,1,0,0,1,0|2,0,0]=4 6126 B16R2.135 Cc1ccc(cc1)CNCc2ccco2 270004a_100000185738_100000211033 [0,1,0,0,1,0|2,0,0]=4 6127 B16R2.135 Cc1ccc(cc1)CNCc2ccco2 34a_100000185738_100000210814 [0,1,0,0,1,0|2,0,0]=4 6128 B16R2.135 Cc1ccc(cc1)CNCc2cccs2 207a_100000174908_100000209959 [0,1,0,0,1,0|2,0,0]=4 6129 B16R2.135 Cc1ccc(cc1)CNCc2cccs2 207a_100000211653_100000211033 [0,1,0,0,1,0|2,0,0]=4 6130 B16R2.135 Cc1ccc(cc1)CNCc2cccs2 2230a_100000211653_100000210814 [0,1,0,0,1,0|2,0,0]=4 6131 B16R2.135 Cc1ccc(cc1)CNCc2cccs2 270004a_100000174908_100000209959 [0,1,0,0,1,0|2,0,0]=4 6132 B16R2.135 Cc1ccc(cc1)CNCc2cccs2 270004a_100000211653_100000211033 [0,1,0,0,1,0|2,0,0]=4 6133 B16R2.135 Cc1ccc(cc1)CNCc2ccoc2 207a_100000174908_100011215517 [0,1,0,0,1,0|2,0,0]=4 6134 B16R2.135 Cc1ccc(cc1)CNCc2ccoc2 207a_100015206860_100000211033 [0,1,0,0,1,0|2,0,0]=4 6135 B16R2.135 Cc1ccc(cc1)CNCc2ccoc2 2230a_100015206860_100000210814 [0,1,0,0,1,0|2,0,0]=4 6136 B16R2.135 Cc1ccc(cc1)CNCc2ccoc2 270004a_100000174908_100011215517 [0,1,0,0,1,0|2,0,0]=4 6137 B16R2.135 Cc1ccc(cc1)CNCc2ccoc2 270004a_100015206860_100000211033 [0,1,0,0,1,0|2,0,0]=4 6138 B16R2.135 Cc1ccc(cc1)CNCc2ccoc2 34a_100015206860_100000210814 [0,1,0,0,1,0|2,0,0]=4 6139 B16R2.135 Cc1ccc(cc1)CNCc2ccsc2 207a_100000174908_100000188534 [0,1,0,0,1,0|2,0,0]=4 6140 B16R2.135 Cc1ccc(cc1)CNCc2ccsc2 207a_100000186416_100000211033 [0,1,0,0,1,0|2,0,0]=4 6141 B16R2.135 Cc1ccc(cc1)CNCc2ccsc2 2230a_100000174908_100011261437 [0,1,0,0,1,0|2,0,0]=4 6142 B16R2.135 Cc1ccc(cc1)CNCc2ccsc2 2230a_100000186416_100000210814 [0,1,0,0,1,0|2,0,0]=4 6143 B16R2.135 Cc1ccc(cc1)CNCc2ccsc2 270004a_100000174908_100000188534 [0,1,0,0,1,0|2,0,0]=4 6144 B16R2.135 Cc1ccc(cc1)CNCc2ccsc2 270004a_100000186416_100000211033 [0,1,0,0,1,0|2,0,0]=4 6145 B16R2.135 Cc1ccc(cc1)CNCc2ccsc2 34a_100000174908_100011261437 [0,1,0,0,1,0|2,0,0]=4 6146 B16R2.135 Cc1ccc(cc1)CNCc2ccsc2 34a_100000186416_100000210814 [0,1,0,0,1,0|2,0,0]=4 6147 B16R2.135 Cc1ccc(cc1)COCc2c[nH]cn2 34a_100011215236_100000707719 [0,1,0,0,1,0|2,0,0]=4 6148 B16R2.135 Cc1ccc(cc1)COCc2ccco2 34a_100000210059_100000210814 [0,1,0,0,1,0|1,0,0]=3 6149 B16R2.135 Cc1ccc(cc1)COCc2cccs2 34a_100000211240_100000210814 [0,1,0,0,1,0|1,0,0]=3 6150 B16R2.135 Cc1ccc(cc1)COCc2ccn[nH]2 34a_100011215236_100000728653 [0,1,0,0,1,0|2,0,0]=4 6151 B16R2.135 Cc1ccc(cc1)COCc2ccn[nH]2 7a_100011215236_100000728653 [0,1,0,0,1,0|2,0,0]=4 6152 B16R2.135 Cc1ccc(cc1)COCc2ccno2 34a_100000740478_100000210814 [0,1,0,0,1,0|2,0,0]=4 6153 B16R2.135 Cc1ccc(cc1)COCc2ccoc2 34a_100011215357_100000210814 [0,1,0,0,1,0|1,0,0]=3 6154 B16R2.135 Cc1ccc(cc1)COCc2ccon2 34a_100011215236_100000234950 [0,1,0,0,1,0|2,0,0]=4 6155 B16R2.135 Cc1ccc(cc1)COCc2ccon2 7a_100011215236_100000234950 [0,1,0,0,1,0|2,0,0]=4 6156 B16R2.135 Cc1ccc(cc1)COCc2ccsc2 34a_100011215236_100011261437 [0,1,0,0,1,0|1,0,0]=3 6157 B16R2.135 Cc1ccc(cc1)COCc2ccsc2 34a_100011215551_100000210814 [0,1,0,0,1,0|1,0,0]=3 6158 B16R2.135 Cc1ccc(cc1)COCc2ccsc2 7a_100011215236_100011261437 [0,1,0,0,1,0|1,0,0]=3 6159 B16R2.135 Cc1ccc(cc1)COCc2cncs2 34a_100011215236_100015185245 [0,1,0,0,1,0|2,0,0]=4 6160 B16R2.135 Cc1ccc(cc1)COCc2cncs2 7a_100011215236_100015185245 [0,1,0,0,1,0|2,0,0]=4 6161 B16R2.135 Cc1ccc(cc1)COCc2cscn2 34a_100011215236_100000205941 [0,1,0,0,1,0|2,0,0]=4 6162 B16R2.135 Cc1ccc(cc1)COCc2cscn2 7a_100011215236_100000205941 [0,1,0,0,1,0|2,0,0]=4 6163 B16R2.135 Cc1ccc(cc1)COCc2ncc[nH]2 34a_100011215236_100016991755 [0,1,0,0,1,0|2,0,0]=4 6164 B16R2.135 Cc1ccc(cc1)COCc2ncc[nH]2 7a_100011215236_100000753453 [0,1,0,0,1,0|2,0,0]=4 6165 B16R2.135 Cc1ccc(cc1)COCc2ncco2 34a_100000062594_100000210814 [0,1,0,0,1,0|2,0,0]=4 6166 B16R2.135 Cc1ccc(cc1)COCc2ncco2 34a_100011215236_103436540062 [0,1,0,0,1,0|2,0,0]=4 6167 B16R2.135 Cc1ccc(cc1)COCc2ncco2 7a_100011215236_103436540062 [0,1,0,0,1,0|2,0,0]=4 6168 B16R2.135 Cc1ccc(cc1)COCc2nccs2 34a_100011215236_100015184050 [0,1,0,0,1,0|2,0,0]=4 6169 B16R2.135 Cc1ccc(cc1)COCc2nccs2 7a_100011215236_100015184050 [0,1,0,0,1,0|2,0,0]=4 6170 B16R2.135 Cc1ccc(cc1)COCn2cccn2 34a_100000731028_100000210814 [0,1,0,0,1,0|2,0,0]=4 6171 B16R2.135 Cc1ccc(cc1)CSCc2ccsc2 62a_100000210814_100011233845 [0,1,0,0,1,0|1,1,0]=4 6172 B16R2.135 Cc1ccc(cc1)CSCc2ccsc2 62a_100011261437_100000210814 [0,1,0,0,1,0|1,1,0]=4 6173 B16R2.135 Cc1ccc(cn1)COCc2ccco2 34a_100000210059_100016987292 [0,1,0,0,1,0|2,0,0]=4 6174 B16R2.135 Cc1ccc(cn1)COCc2cccs2 34a_100000211240_100016987292 [0,1,0,0,1,0|2,0,0]=4 6175 B16R2.135 Cc1ccc(cn1)COCc2ccoc2 34a_100011215357_100016987292 [0,1,0,0,1,0|2,0,0]=4 6176 B16R2.135 Cc1ccc(cn1)COCc2ccsc2 34a_100011215551_100016987292 [0,1,0,0,1,0|2,0,0]=4 6177 B16R2.135 Cc1ccc(cn1)COCc2ccsc2 34a_100011248133_100011261437 [0,1,0,0,1,0|2,0,0]=4 6178 B16R2.135 Cc1ccc(nc1)COCc2ccco2 34a_100000210059_100000691093 [0,1,0,0,1,0|2,0,0]=4 6179 B16R2.135 Cc1ccc(nc1)COCc2cccs2 34a_100000211240_100000691093 [0,1,0,0,1,0|2,0,0]=4 6180 B16R2.135 Cc1ccc(nc1)COCc2ccoc2 34a_100011215357_100000691093 [0,1,0,0,1,0|2,0,0]=4 6181 B16R2.135 Cc1ccc(nc1)COCc2ccsc2 34a_100011215551_100000691093 [0,1,0,0,1,0|2,0,0]=4 6182 B16R2.135 Cc1ccc(nc1)COCc2ccsc2 34a_100012001401_100011261437 [0,1,0,0,1,0|2,0,0]=4 6183 B16R2.135 Clc1ccc(cc1)CNCc2ccco2 207a_100000174871_100000186105 [0,1,0,0,1,0|2,0,0]=4 6184 B16R2.135 Clc1ccc(cc1)CNCc2ccco2 207a_100000185738_100000189385 [0,1,0,0,1,0|2,0,0]=4 6185 B16R2.135 Clc1ccc(cc1)CNCc2ccco2 2230a_100000185738_100000694040 [0,1,0,0,1,0|2,0,0]=4 6186 B16R2.135 Clc1ccc(cc1)CNCc2ccco2 270004a_100000174871_100000186105 [0,1,0,0,1,0|2,0,0]=4 6187 B16R2.135 Clc1ccc(cc1)CNCc2ccco2 270004a_100000185738_100000189385 [0,1,0,0,1,0|2,0,0]=4 6188 B16R2.135 Clc1ccc(cc1)CNCc2ccco2 34a_100000185738_100000694040 [0,1,0,0,1,0|2,0,0]=4 6189 B16R2.135 Clc1ccc(cc1)CNCc2cccs2 207a_100000174871_100000209959 [0,1,0,0,1,0|2,0,0]=4 6190 B16R2.135 Clc1ccc(cc1)CNCc2cccs2 207a_100000211653_100000189385 [0,1,0,0,1,0|2,0,0]=4 6191 B16R2.135 Clc1ccc(cc1)CNCc2cccs2 2230a_100000211653_100000694040 [0,1,0,0,1,0|2,0,0]=4 6192 B16R2.135 Clc1ccc(cc1)CNCc2cccs2 270004a_100000174871_100000209959 [0,1,0,0,1,0|2,0,0]=4 6193 B16R2.135 Clc1ccc(cc1)CNCc2cccs2 270004a_100000211653_100000189385 [0,1,0,0,1,0|2,0,0]=4 6194 B16R2.135 Clc1ccc(cc1)CNCc2ccoc2 207a_100000174871_100011215517 [0,1,0,0,1,0|2,0,0]=4 6195 B16R2.135 Clc1ccc(cc1)CNCc2ccoc2 207a_100015206860_100000189385 [0,1,0,0,1,0|2,0,0]=4 6196 B16R2.135 Clc1ccc(cc1)CNCc2ccoc2 2230a_100015206860_100000694040 [0,1,0,0,1,0|2,0,0]=4 6197 B16R2.135 Clc1ccc(cc1)CNCc2ccoc2 270004a_100000174871_100011215517 [0,1,0,0,1,0|2,0,0]=4 6198 B16R2.135 Clc1ccc(cc1)CNCc2ccoc2 270004a_100015206860_100000189385 [0,1,0,0,1,0|2,0,0]=4 6199 B16R2.135 Clc1ccc(cc1)CNCc2ccoc2 34a_100015206860_100000694040 [0,1,0,0,1,0|2,0,0]=4 6200 B16R2.135 Clc1ccc(cc1)CNCc2ccsc2 207a_100000174871_100000188534 [0,1,0,0,1,0|2,0,0]=4 6201 B16R2.135 Clc1ccc(cc1)CNCc2ccsc2 207a_100000186416_100000189385 [0,1,0,0,1,0|2,0,0]=4 6202 B16R2.135 Clc1ccc(cc1)CNCc2ccsc2 2230a_100000174871_100011261437 [0,1,0,0,1,0|2,0,0]=4 6203 B16R2.135 Clc1ccc(cc1)CNCc2ccsc2 2230a_100000186416_100000694040 [0,1,0,0,1,0|2,0,0]=4 6204 B16R2.135 Clc1ccc(cc1)CNCc2ccsc2 270004a_100000174871_100000188534 [0,1,0,0,1,0|2,0,0]=4 6205 B16R2.135 Clc1ccc(cc1)CNCc2ccsc2 270004a_100000186416_100000189385 [0,1,0,0,1,0|2,0,0]=4 6206 B16R2.135 Clc1ccc(cc1)CNCc2ccsc2 34a_100000174871_100011261437 [0,1,0,0,1,0|2,0,0]=4 6207 B16R2.135 Clc1ccc(cc1)CNCc2ccsc2 34a_100000186416_100000694040 [0,1,0,0,1,0|2,0,0]=4 6208 B16R2.135 Clc1ccc(cc1)COCc2c[nH]cn2 34a_100000211118_100000707719 [0,1,0,0,1,0|2,0,0]=4 6209 B16R2.135 Clc1ccc(cc1)COCc2ccco2 34a_100000210059_100000694040 [0,1,0,0,1,0|1,0,0]=3 6210 B16R2.135 Clc1ccc(cc1)COCc2cccs2 34a_100000211240_100000694040 [0,1,0,0,1,0|1,0,0]=3 6211 B16R2.135 Clc1ccc(cc1)COCc2ccn[nH]2 34a_100000211118_100000728653 [0,1,0,0,1,0|2,0,0]=4 6212 B16R2.135 Clc1ccc(cc1)COCc2ccn[nH]2 7a_100000211118_100000728653 [0,1,0,0,1,0|2,0,0]=4 6213 B16R2.135 Clc1ccc(cc1)COCc2ccno2 34a_100000740478_100000694040 [0,1,0,0,1,0|2,0,0]=4 6214 B16R2.135 Clc1ccc(cc1)COCc2ccoc2 34a_100011215357_100000694040 [0,1,0,0,1,0|1,0,0]=3 6215 B16R2.135 Clc1ccc(cc1)COCc2ccon2 34a_100000211118_100000234950 [0,1,0,0,1,0|2,0,0]=4 6216 B16R2.135 Clc1ccc(cc1)COCc2ccon2 7a_100000211118_100000234950 [0,1,0,0,1,0|2,0,0]=4 6217 B16R2.135 Clc1ccc(cc1)COCc2ccsc2 34a_100000211118_100011261437 [0,1,0,0,1,0|1,0,0]=3 6218 B16R2.135 Clc1ccc(cc1)COCc2ccsc2 34a_100011215551_100000694040 [0,1,0,0,1,0|1,0,0]=3 6219 B16R2.135 Clc1ccc(cc1)COCc2ccsc2 7a_100000211118_100011261437 [0,1,0,0,1,0|1,0,0]=3 6220 B16R2.135 Clc1ccc(cc1)COCc2cncs2 34a_100000211118_100015185245 [0,1,0,0,1,0|2,0,0]=4 6221 B16R2.135 Clc1ccc(cc1)COCc2cncs2 7a_100000211118_100015185245 [0,1,0,0,1,0|2,0,0]=4 6222 B16R2.135 Clc1ccc(cc1)COCc2cscn2 34a_100000211118_100000205941 [0,1,0,0,1,0|2,0,0]=4 6223 B16R2.135 Clc1ccc(cc1)COCc2cscn2 7a_100000211118_100000205941 [0,1,0,0,1,0|2,0,0]=4 6224 B16R2.135 Clc1ccc(cc1)COCc2ncc[nH]2 34a_100000211118_100016991755 [0,1,0,0,1,0|2,0,0]=4 6225 B16R2.135 Clc1ccc(cc1)COCc2ncc[nH]2 7a_100000211118_100000753453 [0,1,0,0,1,0|2,0,0]=4 6226 B16R2.135 Clc1ccc(cc1)COCc2ncco2 34a_100000062594_100000694040 [0,1,0,0,1,0|2,0,0]=4 6227 B16R2.135 Clc1ccc(cc1)COCc2ncco2 34a_100000211118_103436540062 [0,1,0,0,1,0|2,0,0]=4 6228 B16R2.135 Clc1ccc(cc1)COCc2ncco2 7a_100000211118_103436540062 [0,1,0,0,1,0|2,0,0]=4 6229 B16R2.135 Clc1ccc(cc1)COCc2nccs2 34a_100000211118_100015184050 [0,1,0,0,1,0|2,0,0]=4 6230 B16R2.135 Clc1ccc(cc1)COCc2nccs2 7a_100000211118_100015184050 [0,1,0,0,1,0|2,0,0]=4 6231 B16R2.135 Clc1ccc(cc1)COCn2cccn2 34a_100000731028_100000694040 [0,1,0,0,1,0|2,0,0]=4 6232 B16R2.135 Clc1ccc(cc1)CSCc2ccsc2 62a_100000187161_100011233845 [0,1,0,0,1,0|1,1,0]=4 6233 B16R2.135 Clc1ccc(cc1)CSCc2ccsc2 62a_100011261437_100000187161 [0,1,0,0,1,0|1,1,0]=4 6234 B16R2.135 Clc1ccc(cn1)COCc2ccco2 34a_100000210059_100000735431 [0,1,0,0,1,0|2,0,0]=4 6235 B16R2.135 Clc1ccc(cn1)COCc2cccs2 34a_100000211240_100000735431 [0,1,0,0,1,0|2,0,0]=4 6236 B16R2.135 Clc1ccc(cn1)COCc2ccoc2 34a_100011215357_100000735431 [0,1,0,0,1,0|2,0,0]=4 6237 B16R2.135 Clc1ccc(cn1)COCc2ccsc2 34a_100000755211_100011261437 [0,1,0,0,1,0|2,0,0]=4 6238 B16R2.135 Clc1ccc(cn1)COCc2ccsc2 34a_100011215551_100000735431 [0,1,0,0,1,0|2,0,0]=4 6239 B16R2.135 Clc1ccc(cn1)COCc2ccsc2 7a_100000755211_100011261437 [0,1,0,0,1,0|2,0,0]=4 6240 B16R2.135 Clc1ccc(nc1)COCc2ccco2 34a_100000210059_100012066911 [0,1,0,0,1,0|2,0,0]=4 6241 B16R2.135 Clc1ccc(nc1)COCc2cccs2 34a_100000211240_100012066911 [0,1,0,0,1,0|2,0,0]=4 6242 B16R2.135 Clc1ccc(nc1)COCc2ccoc2 34a_100011215357_100012066911 [0,1,0,0,1,0|2,0,0]=4 6243 B16R2.135 Clc1ccc(nc1)COCc2ccsc2 34a_100000703999_100011261437 [0,1,0,0,1,0|2,0,0]=4 6244 B16R2.135 Clc1ccc(nc1)COCc2ccsc2 34a_100011215551_100012066911 [0,1,0,0,1,0|2,0,0]=4 6245 B16R2.135 Fc1ccc(cc1)CNCc2ccco2 207a_100000174882_100000186105 [0,1,0,0,1,0|2,0,0]=4 6246 B16R2.135 Fc1ccc(cc1)CNCc2ccco2 207a_100000185738_100000210084 [0,1,0,0,1,0|2,0,0]=4 6247 B16R2.135 Fc1ccc(cc1)CNCc2ccco2 2230a_100000185738_100000198546 [0,1,0,0,1,0|2,0,0]=4 6248 B16R2.135 Fc1ccc(cc1)CNCc2ccco2 270004a_100000174882_100000186105 [0,1,0,0,1,0|2,0,0]=4 6249 B16R2.135 Fc1ccc(cc1)CNCc2ccco2 270004a_100000185738_100000210084 [0,1,0,0,1,0|2,0,0]=4 6250 B16R2.135 Fc1ccc(cc1)CNCc2ccco2 34a_100000185738_100000198546 [0,1,0,0,1,0|2,0,0]=4 6251 B16R2.135 Fc1ccc(cc1)CNCc2cccs2 207a_100000174882_100000209959 [0,1,0,0,1,0|2,0,0]=4 6252 B16R2.135 Fc1ccc(cc1)CNCc2cccs2 207a_100000211653_100000210084 [0,1,0,0,1,0|2,0,0]=4 6253 B16R2.135 Fc1ccc(cc1)CNCc2cccs2 2230a_100000211653_100000198546 [0,1,0,0,1,0|2,0,0]=4 6254 B16R2.135 Fc1ccc(cc1)CNCc2cccs2 270004a_100000174882_100000209959 [0,1,0,0,1,0|2,0,0]=4 6255 B16R2.135 Fc1ccc(cc1)CNCc2cccs2 270004a_100000211653_100000210084 [0,1,0,0,1,0|2,0,0]=4 6256 B16R2.135 Fc1ccc(cc1)CNCc2ccoc2 207a_100000174882_100011215517 [0,1,0,0,1,0|2,0,0]=4 6257 B16R2.135 Fc1ccc(cc1)CNCc2ccoc2 207a_100015206860_100000210084 [0,1,0,0,1,0|2,0,0]=4 6258 B16R2.135 Fc1ccc(cc1)CNCc2ccoc2 2230a_100015206860_100000198546 [0,1,0,0,1,0|2,0,0]=4 6259 B16R2.135 Fc1ccc(cc1)CNCc2ccoc2 270004a_100000174882_100011215517 [0,1,0,0,1,0|2,0,0]=4 6260 B16R2.135 Fc1ccc(cc1)CNCc2ccoc2 270004a_100015206860_100000210084 [0,1,0,0,1,0|2,0,0]=4 6261 B16R2.135 Fc1ccc(cc1)CNCc2ccoc2 34a_100015206860_100000198546 [0,1,0,0,1,0|2,0,0]=4 6262 B16R2.135 Fc1ccc(cc1)CNCc2ccsc2 207a_100000174882_100000188534 [0,1,0,0,1,0|2,0,0]=4 6263 B16R2.135 Fc1ccc(cc1)CNCc2ccsc2 207a_100000186416_100000210084 [0,1,0,0,1,0|2,0,0]=4 6264 B16R2.135 Fc1ccc(cc1)CNCc2ccsc2 2230a_100000174882_100011261437 [0,1,0,0,1,0|2,0,0]=4 6265 B16R2.135 Fc1ccc(cc1)CNCc2ccsc2 2230a_100000186416_100000198546 [0,1,0,0,1,0|2,0,0]=4 6266 B16R2.135 Fc1ccc(cc1)CNCc2ccsc2 270004a_100000174882_100000188534 [0,1,0,0,1,0|2,0,0]=4 6267 B16R2.135 Fc1ccc(cc1)CNCc2ccsc2 270004a_100000186416_100000210084 [0,1,0,0,1,0|2,0,0]=4 6268 B16R2.135 Fc1ccc(cc1)CNCc2ccsc2 34a_100000174882_100011261437 [0,1,0,0,1,0|2,0,0]=4 6269 B16R2.135 Fc1ccc(cc1)CNCc2ccsc2 34a_100000186416_100000198546 [0,1,0,0,1,0|2,0,0]=4 6270 B16R2.135 Fc1ccc(cc1)COCc2c[nH]cn2 34a_100000210977_100000707719 [0,1,0,0,1,0|2,0,0]=4 6271 B16R2.135 Fc1ccc(cc1)COCc2ccco2 34a_100000210059_100000198546 [0,1,0,0,1,0|1,0,0]=3 6272 B16R2.135 Fc1ccc(cc1)COCc2cccs2 34a_100000211240_100000198546 [0,1,0,0,1,0|1,0,0]=3 6273 B16R2.135 Fc1ccc(cc1)COCc2ccn[nH]2 34a_100000210977_100000728653 [0,1,0,0,1,0|2,0,0]=4 6274 B16R2.135 Fc1ccc(cc1)COCc2ccn[nH]2 7a_100000210977_100000728653 [0,1,0,0,1,0|2,0,0]=4 6275 B16R2.135 Fc1ccc(cc1)COCc2ccno2 34a_100000740478_100000198546 [0,1,0,0,1,0|2,0,0]=4 6276 B16R2.135 Fc1ccc(cc1)COCc2ccoc2 34a_100011215357_100000198546 [0,1,0,0,1,0|1,0,0]=3 6277 B16R2.135 Fc1ccc(cc1)COCc2ccon2 34a_100000210977_100000234950 [0,1,0,0,1,0|2,0,0]=4 6278 B16R2.135 Fc1ccc(cc1)COCc2ccon2 7a_100000210977_100000234950 [0,1,0,0,1,0|2,0,0]=4 6279 B16R2.135 Fc1ccc(cc1)COCc2ccsc2 34a_100000210977_100011261437 [0,1,0,0,1,0|1,0,0]=3 6280 B16R2.135 Fc1ccc(cc1)COCc2ccsc2 34a_100011215551_100000198546 [0,1,0,0,1,0|1,0,0]=3 6281 B16R2.135 Fc1ccc(cc1)COCc2ccsc2 7a_100000210977_100011261437 [0,1,0,0,1,0|1,0,0]=3 6282 B16R2.135 Fc1ccc(cc1)COCc2cncs2 34a_100000210977_100015185245 [0,1,0,0,1,0|2,0,0]=4 6283 B16R2.135 Fc1ccc(cc1)COCc2cncs2 7a_100000210977_100015185245 [0,1,0,0,1,0|2,0,0]=4 6284 B16R2.135 Fc1ccc(cc1)COCc2cscn2 34a_100000210977_100000205941 [0,1,0,0,1,0|2,0,0]=4 6285 B16R2.135 Fc1ccc(cc1)COCc2cscn2 7a_100000210977_100000205941 [0,1,0,0,1,0|2,0,0]=4 6286 B16R2.135 Fc1ccc(cc1)COCc2ncc[nH]2 34a_100000210977_100016991755 [0,1,0,0,1,0|2,0,0]=4 6287 B16R2.135 Fc1ccc(cc1)COCc2ncc[nH]2 7a_100000210977_100000753453 [0,1,0,0,1,0|2,0,0]=4 6288 B16R2.135 Fc1ccc(cc1)COCc2ncco2 34a_100000062594_100000198546 [0,1,0,0,1,0|2,0,0]=4 6289 B16R2.135 Fc1ccc(cc1)COCc2ncco2 34a_100000210977_103436540062 [0,1,0,0,1,0|2,0,0]=4 6290 B16R2.135 Fc1ccc(cc1)COCc2ncco2 7a_100000210977_103436540062 [0,1,0,0,1,0|2,0,0]=4 6291 B16R2.135 Fc1ccc(cc1)COCc2nccs2 34a_100000210977_100015184050 [0,1,0,0,1,0|2,0,0]=4 6292 B16R2.135 Fc1ccc(cc1)COCc2nccs2 7a_100000210977_100015184050 [0,1,0,0,1,0|2,0,0]=4 6293 B16R2.135 Fc1ccc(cc1)COCn2cccn2 34a_100000731028_100000198546 [0,1,0,0,1,0|2,0,0]=4 6294 B16R2.135 Fc1ccc(cc1)CSCc2ccsc2 62a_100000198546_100011233845 [0,1,0,0,1,0|1,1,0]=4 6295 B16R2.135 Fc1ccc(cc1)CSCc2ccsc2 62a_100011261437_100000187164 [0,1,0,0,1,0|1,1,0]=4 6296 B16R2.135 Fc1ccc(cn1)COCc2ccco2 34a_100000210059_100000099788 [0,1,0,0,1,0|2,0,0]=4 6297 B16R2.135 Fc1ccc(cn1)COCc2cccs2 34a_100000211240_100000099788 [0,1,0,0,1,0|2,0,0]=4 6298 B16R2.135 Fc1ccc(cn1)COCc2ccoc2 34a_100011215357_100000099788 [0,1,0,0,1,0|2,0,0]=4 6299 B16R2.135 Fc1ccc(cn1)COCc2ccsc2 34a_100000079959_100011261437 [0,1,0,0,1,0|2,0,0]=4 6300 B16R2.135 Fc1ccc(cn1)COCc2ccsc2 34a_100011215551_100000099788 [0,1,0,0,1,0|2,0,0]=4 6301 B16R2.135 Fc1ccc(nc1)COCc2ccco2 34a_100000210059_100000703193 [0,1,0,0,1,0|2,0,0]=4 6302 B16R2.135 Fc1ccc(nc1)COCc2cccs2 34a_100000211240_100000703193 [0,1,0,0,1,0|2,0,0]=4 6303 B16R2.135 Fc1ccc(nc1)COCc2ccoc2 34a_100011215357_100000703193 [0,1,0,0,1,0|2,0,0]=4 6304 B16R2.135 Fc1ccc(nc1)COCc2ccsc2 34a_100011215551_100000703193 [0,1,0,0,1,0|2,0,0]=4 6305 B16R2.135 Fc1ccc(nc1)COCc2ccsc2 34a_100011999454_100011261437 [0,1,0,0,1,0|2,0,0]=4 6306 B16R2.135 Ic1ccc(cc1)CNCc2ccco2 207a_100000185738_100000188517 [0,1,0,0,1,0|2,0,0]=4 6307 B16R2.135 Ic1ccc(cc1)CNCc2ccco2 207a_100016989417_100000186105 [0,1,0,0,1,0|2,0,0]=4 6308 B16R2.135 Ic1ccc(cc1)CNCc2ccco2 2230a_100000185738_100000189116 [0,1,0,0,1,0|2,0,0]=4 6309 B16R2.135 Ic1ccc(cc1)CNCc2ccco2 270004a_100016989417_100000186105 [0,1,0,0,1,0|2,0,0]=4 6310 B16R2.135 Ic1ccc(cc1)CNCc2ccco2 34a_100000185738_100000189116 [0,1,0,0,1,0|2,0,0]=4 6311 B16R2.135 Ic1ccc(cc1)CNCc2cccs2 207a_100000211653_100000188517 [0,1,0,0,1,0|2,0,0]=4 6312 B16R2.135 Ic1ccc(cc1)CNCc2cccs2 207a_100016989417_100000209959 [0,1,0,0,1,0|2,0,0]=4 6313 B16R2.135 Ic1ccc(cc1)CNCc2cccs2 2230a_100000211653_100000189116 [0,1,0,0,1,0|2,0,0]=4 6314 B16R2.135 Ic1ccc(cc1)CNCc2cccs2 270004a_100016989417_100000209959 [0,1,0,0,1,0|2,0,0]=4 6315 B16R2.135 Ic1ccc(cc1)CNCc2ccoc2 207a_100015206860_100000188517 [0,1,0,0,1,0|2,0,0]=4 6316 B16R2.135 Ic1ccc(cc1)CNCc2ccoc2 207a_100016989417_100011215517 [0,1,0,0,1,0|2,0,0]=4 6317 B16R2.135 Ic1ccc(cc1)CNCc2ccoc2 2230a_100015206860_100000189116 [0,1,0,0,1,0|2,0,0]=4 6318 B16R2.135 Ic1ccc(cc1)CNCc2ccoc2 270004a_100016989417_100011215517 [0,1,0,0,1,0|2,0,0]=4 6319 B16R2.135 Ic1ccc(cc1)CNCc2ccoc2 34a_100015206860_100000189116 [0,1,0,0,1,0|2,0,0]=4 6320 B16R2.135 Ic1ccc(cc1)CNCc2ccsc2 207a_100000186416_100000188517 [0,1,0,0,1,0|2,0,0]=4 6321 B16R2.135 Ic1ccc(cc1)CNCc2ccsc2 207a_100016989417_100000188534 [0,1,0,0,1,0|2,0,0]=4 6322 B16R2.135 Ic1ccc(cc1)CNCc2ccsc2 2230a_100000186416_100000189116 [0,1,0,0,1,0|2,0,0]=4 6323 B16R2.135 Ic1ccc(cc1)CNCc2ccsc2 2230a_100016989417_100011261437 [0,1,0,0,1,0|2,0,0]=4 6324 B16R2.135 Ic1ccc(cc1)CNCc2ccsc2 270004a_100016989417_100000188534 [0,1,0,0,1,0|2,0,0]=4 6325 B16R2.135 Ic1ccc(cc1)CNCc2ccsc2 34a_100000186416_100000189116 [0,1,0,0,1,0|2,0,0]=4 6326 B16R2.135 Ic1ccc(cc1)CNCc2ccsc2 34a_100016989417_100011261437 [0,1,0,0,1,0|2,0,0]=4 6327 B16R2.135 Ic1ccc(cc1)COCc2c[nH]cn2 34a_100000690907_100000707719 [0,1,0,0,1,0|2,0,0]=4 6328 B16R2.135 Ic1ccc(cc1)COCc2ccco2 34a_100000210059_100000189116 [0,1,0,0,1,0|1,0,0]=3 6329 B16R2.135 Ic1ccc(cc1)COCc2cccs2 34a_100000211240_100000189116 [0,1,0,0,1,0|1,0,0]=3 6330 B16R2.135 Ic1ccc(cc1)COCc2ccn[nH]2 34a_100000690907_100000728653 [0,1,0,0,1,0|2,0,0]=4 6331 B16R2.135 Ic1ccc(cc1)COCc2ccn[nH]2 7a_100000690907_100000728653 [0,1,0,0,1,0|2,0,0]=4 6332 B16R2.135 Ic1ccc(cc1)COCc2ccno2 34a_100000740478_100000189116 [0,1,0,0,1,0|2,0,0]=4 6333 B16R2.135 Ic1ccc(cc1)COCc2ccoc2 34a_100011215357_100000189116 [0,1,0,0,1,0|1,0,0]=3 6334 B16R2.135 Ic1ccc(cc1)COCc2ccon2 34a_100000690907_100000234950 [0,1,0,0,1,0|2,0,0]=4 6335 B16R2.135 Ic1ccc(cc1)COCc2ccon2 7a_100000690907_100000234950 [0,1,0,0,1,0|2,0,0]=4 6336 B16R2.135 Ic1ccc(cc1)COCc2ccsc2 34a_100000690907_100011261437 [0,1,0,0,1,0|1,0,0]=3 6337 B16R2.135 Ic1ccc(cc1)COCc2ccsc2 34a_100011215551_100000189116 [0,1,0,0,1,0|1,0,0]=3 6338 B16R2.135 Ic1ccc(cc1)COCc2ccsc2 7a_100000690907_100011261437 [0,1,0,0,1,0|1,0,0]=3 6339 B16R2.135 Ic1ccc(cc1)COCc2cncs2 34a_100000690907_100015185245 [0,1,0,0,1,0|2,0,0]=4 6340 B16R2.135 Ic1ccc(cc1)COCc2cncs2 7a_100000690907_100015185245 [0,1,0,0,1,0|2,0,0]=4 6341 B16R2.135 Ic1ccc(cc1)COCc2cscn2 34a_100000690907_100000205941 [0,1,0,0,1,0|2,0,0]=4 6342 B16R2.135 Ic1ccc(cc1)COCc2cscn2 7a_100000690907_100000205941 [0,1,0,0,1,0|2,0,0]=4 6343 B16R2.135 Ic1ccc(cc1)COCc2ncc[nH]2 34a_100000690907_100016991755 [0,1,0,0,1,0|2,0,0]=4 6344 B16R2.135 Ic1ccc(cc1)COCc2ncc[nH]2 7a_100000690907_100000753453 [0,1,0,0,1,0|2,0,0]=4 6345 B16R2.135 Ic1ccc(cc1)COCc2ncco2 34a_100000062594_100000189116 [0,1,0,0,1,0|2,0,0]=4 6346 B16R2.135 Ic1ccc(cc1)COCc2ncco2 34a_100000690907_103436540062 [0,1,0,0,1,0|2,0,0]=4 6347 B16R2.135 Ic1ccc(cc1)COCc2ncco2 7a_100000690907_103436540062 [0,1,0,0,1,0|2,0,0]=4 6348 B16R2.135 Ic1ccc(cc1)COCc2nccs2 34a_100000690907_100015184050 [0,1,0,0,1,0|2,0,0]=4 6349 B16R2.135 Ic1ccc(cc1)COCc2nccs2 7a_100000690907_100015184050 [0,1,0,0,1,0|2,0,0]=4 6350 B16R2.135 Ic1ccc(cc1)COCn2cccn2 34a_100000731028_100000189116 [0,1,0,0,1,0|2,0,0]=4 6351 B16R2.135 Ic1ccc(cc1)CSCc2ccsc2 62a_100000189116_100011233845 [0,1,0,0,1,0|1,1,0]=4 6352 B16R2.135 Ic1ccc(cc1)CSCc2ccsc2 62a_100011261437_100000189116 [0,1,0,0,1,0|1,1,0]=4 6353 B16R2.135 Nc1ccc(cc1)COCc2c[nH]cn2 34a_100011215238_100000707719 [0,1,0,0,1,0|2,0,0]=4 6354 B16R2.135 Nc1ccc(cc1)COCc2ccn[nH]2 34a_100011215238_100000728653 [0,1,0,0,1,0|2,0,0]=4 6355 B16R2.135 Nc1ccc(cc1)COCc2ccon2 34a_100011215238_100000234950 [0,1,0,0,1,0|2,0,0]=4 6356 B16R2.135 Nc1ccc(cc1)COCc2ccsc2 34a_100011215238_100011261437 [0,1,0,0,1,0|1,0,0]=3 6357 B16R2.135 Nc1ccc(cc1)COCc2cncs2 34a_100011215238_100015185245 [0,1,0,0,1,0|2,0,0]=4 6358 B16R2.135 Nc1ccc(cc1)COCc2cscn2 34a_100011215238_100000205941 [0,1,0,0,1,0|2,0,0]=4 6359 B16R2.135 Nc1ccc(cc1)COCc2ncc[nH]2 34a_100011215238_100016991755 [0,1,0,0,1,0|2,0,0]=4 6360 B16R2.135 Nc1ccc(cc1)COCc2ncco2 34a_100011215238_103436540062 [0,1,0,0,1,0|2,0,0]=4 6361 B16R2.135 Nc1ccc(cc1)COCc2nccs2 34a_100011215238_100015184050 [0,1,0,0,1,0|2,0,0]=4 6362 B16R2.135 Nc1ccc(cn1)COCc2ccsc2 34a_100000704267_100011261437 [0,1,0,0,1,0|2,0,0]=4 6363 B16R2.135 Nc1ccc(nc1)COCc2ccsc2 34a_100011998161_100011261437 [0,1,0,0,1,0|2,0,0]=4 6364 B16R2.135 O=c1ccc(c[nH]1)COCc2ccsc2 34a_100011999846_100011261437 [0,1,0,0,1,0|2,0,0]=4 6365 B16R2.135 Oc1ccc(cc1)CNCc2ccsc2 34a_100000185549_100011261437 [0,1,0,0,1,0|2,0,0]=4 6366 B16R2.135 [O-][n+]1ccc(cc1)COCc2ccsc2 34a_100000031831_100011261437 [0,1,0,0,1,0|2,0,0]=4 6367 B16R2.135 [O-][n+]1ccc(cc1)COCc2ccsc2 7a_100000031831_100011261437 [0,1,0,0,1,0|2,0,0]=4 6368 B16R2.255 Brc1cc(ccn1)COCc2ccco2 34a_100000210059_100010243470 [0,1,0,0,1,0|2,0,0]=4 6369 B16R2.255 Brc1cc(ccn1)COCc2cccs2 34a_100000211240_100010243470 [0,1,0,0,1,0|2,0,0]=4 6370 B16R2.255 Brc1cc(ccn1)COCc2ccoc2 34a_100011215357_100010243470 [0,1,0,0,1,0|2,0,0]=4 6371 B16R2.255 Brc1cc(ccn1)COCc2ccsc2 34a_100009814636_100011261437 [0,1,0,0,1,0|2,0,0]=4 6372 B16R2.255 Brc1cc(ccn1)COCc2ccsc2 34a_100011215551_100010243470 [0,1,0,0,1,0|2,0,0]=4 6373 B16R2.255 Brc1cc(ccn1)COCc2ccsc2 7a_100009814636_100011261437 [0,1,0,0,1,0|2,0,0]=4 6374 B16R2.255 Brc1cccc(c1)CNCc2ccco2 207a_100000174977_100000186105 [0,1,0,0,1,0|2,0,0]=4 6375 B16R2.255 Brc1cccc(c1)CNCc2ccco2 207a_100000185738_100000210085 [0,1,0,0,1,0|2,0,0]=4 6376 B16R2.255 Brc1cccc(c1)CNCc2ccco2 2230a_100000185738_100000698116 [0,1,0,0,1,0|2,0,0]=4 6377 B16R2.255 Brc1cccc(c1)CNCc2ccco2 270004a_100000174977_100000186105 [0,1,0,0,1,0|2,0,0]=4 6378 B16R2.255 Brc1cccc(c1)CNCc2ccco2 270004a_100000185738_100000210085 [0,1,0,0,1,0|2,0,0]=4 6379 B16R2.255 Brc1cccc(c1)CNCc2ccco2 34a_100000185738_100000698116 [0,1,0,0,1,0|2,0,0]=4 6380 B16R2.255 Brc1cccc(c1)CNCc2cccs2 207a_100000174977_100000209959 [0,1,0,0,1,0|2,0,0]=4 6381 B16R2.255 Brc1cccc(c1)CNCc2cccs2 207a_100000211653_100000210085 [0,1,0,0,1,0|2,0,0]=4 6382 B16R2.255 Brc1cccc(c1)CNCc2cccs2 2230a_100000211653_100000698116 [0,1,0,0,1,0|2,0,0]=4 6383 B16R2.255 Brc1cccc(c1)CNCc2cccs2 270004a_100000174977_100000209959 [0,1,0,0,1,0|2,0,0]=4 6384 B16R2.255 Brc1cccc(c1)CNCc2cccs2 270004a_100000211653_100000210085 [0,1,0,0,1,0|2,0,0]=4 6385 B16R2.255 Brc1cccc(c1)CNCc2ccoc2 207a_100000174977_100011215517 [0,1,0,0,1,0|2,0,0]=4 6386 B16R2.255 Brc1cccc(c1)CNCc2ccoc2 207a_100015206860_100000210085 [0,1,0,0,1,0|2,0,0]=4 6387 B16R2.255 Brc1cccc(c1)CNCc2ccoc2 2230a_100015206860_100000698116 [0,1,0,0,1,0|2,0,0]=4 6388 B16R2.255 Brc1cccc(c1)CNCc2ccoc2 270004a_100000174977_100011215517 [0,1,0,0,1,0|2,0,0]=4 6389 B16R2.255 Brc1cccc(c1)CNCc2ccoc2 270004a_100015206860_100000210085 [0,1,0,0,1,0|2,0,0]=4 6390 B16R2.255 Brc1cccc(c1)CNCc2ccoc2 34a_100015206860_100000698116 [0,1,0,0,1,0|2,0,0]=4 6391 B16R2.255 Brc1cccc(c1)CNCc2ccsc2 207a_100000174977_100000188534 [0,1,0,0,1,0|2,0,0]=4 6392 B16R2.255 Brc1cccc(c1)CNCc2ccsc2 207a_100000186416_100000210085 [0,1,0,0,1,0|2,0,0]=4 6393 B16R2.255 Brc1cccc(c1)CNCc2ccsc2 2230a_100000174977_100011261437 [0,1,0,0,1,0|2,0,0]=4 6394 B16R2.255 Brc1cccc(c1)CNCc2ccsc2 2230a_100000186416_100000698116 [0,1,0,0,1,0|2,0,0]=4 6395 B16R2.255 Brc1cccc(c1)CNCc2ccsc2 270004a_100000174977_100000188534 [0,1,0,0,1,0|2,0,0]=4 6396 B16R2.255 Brc1cccc(c1)CNCc2ccsc2 270004a_100000186416_100000210085 [0,1,0,0,1,0|2,0,0]=4 6397 B16R2.255 Brc1cccc(c1)CNCc2ccsc2 34a_100000174977_100011261437 [0,1,0,0,1,0|2,0,0]=4 6398 B16R2.255 Brc1cccc(c1)CNCc2ccsc2 34a_100000186416_100000698116 [0,1,0,0,1,0|2,0,0]=4 6399 B16R2.255 Brc1cccc(c1)COCc2c[nH]cn2 34a_100000687537_100000707719 [0,1,0,0,1,0|2,0,0]=4 6400 B16R2.255 Brc1cccc(c1)COCc2ccco2 34a_100000210059_100000698116 [0,1,0,0,1,0|1,0,0]=3 6401 B16R2.255 Brc1cccc(c1)COCc2cccs2 34a_100000211240_100000698116 [0,1,0,0,1,0|1,0,0]=3 6402 B16R2.255 Brc1cccc(c1)COCc2ccn[nH]2 34a_100000687537_100000728653 [0,1,0,0,1,0|2,0,0]=4 6403 B16R2.255 Brc1cccc(c1)COCc2ccn[nH]2 7a_100000687537_100000728653 [0,1,0,0,1,0|2,0,0]=4 6404 B16R2.255 Brc1cccc(c1)COCc2ccno2 34a_100000740478_100000698116 [0,1,0,0,1,0|2,0,0]=4 6405 B16R2.255 Brc1cccc(c1)COCc2ccoc2 34a_100011215357_100000698116 [0,1,0,0,1,0|1,0,0]=3 6406 B16R2.255 Brc1cccc(c1)COCc2ccon2 34a_100000687537_100000234950 [0,1,0,0,1,0|2,0,0]=4 6407 B16R2.255 Brc1cccc(c1)COCc2ccon2 7a_100000687537_100000234950 [0,1,0,0,1,0|2,0,0]=4 6408 B16R2.255 Brc1cccc(c1)COCc2ccsc2 34a_100000687537_100011261437 [0,1,0,0,1,0|1,0,0]=3 6409 B16R2.255 Brc1cccc(c1)COCc2ccsc2 34a_100011215551_100000698116 [0,1,0,0,1,0|1,0,0]=3 6410 B16R2.255 Brc1cccc(c1)COCc2ccsc2 7a_100000687537_100011261437 [0,1,0,0,1,0|1,0,0]=3 6411 B16R2.255 Brc1cccc(c1)COCc2cncs2 34a_100000687537_100015185245 [0,1,0,0,1,0|2,0,0]=4 6412 B16R2.255 Brc1cccc(c1)COCc2cncs2 7a_100000687537_100015185245 [0,1,0,0,1,0|2,0,0]=4 6413 B16R2.255 Brc1cccc(c1)COCc2cscn2 34a_100000687537_100000205941 [0,1,0,0,1,0|2,0,0]=4 6414 B16R2.255 Brc1cccc(c1)COCc2cscn2 7a_100000687537_100000205941 [0,1,0,0,1,0|2,0,0]=4 6415 B16R2.255 Brc1cccc(c1)COCc2ncc[nH]2 34a_100000687537_100016991755 [0,1,0,0,1,0|2,0,0]=4 6416 B16R2.255 Brc1cccc(c1)COCc2ncc[nH]2 7a_100000687537_100000753453 [0,1,0,0,1,0|2,0,0]=4 6417 B16R2.255 Brc1cccc(c1)COCc2ncco2 34a_100000062594_100000698116 [0,1,0,0,1,0|2,0,0]=4 6418 B16R2.255 Brc1cccc(c1)COCc2ncco2 34a_100000687537_103436540062 [0,1,0,0,1,0|2,0,0]=4 6419 B16R2.255 Brc1cccc(c1)COCc2ncco2 7a_100000687537_103436540062 [0,1,0,0,1,0|2,0,0]=4 6420 B16R2.255 Brc1cccc(c1)COCc2nccs2 34a_100000687537_100015184050 [0,1,0,0,1,0|2,0,0]=4 6421 B16R2.255 Brc1cccc(c1)COCc2nccs2 7a_100000687537_100015184050 [0,1,0,0,1,0|2,0,0]=4 6422 B16R2.255 Brc1cccc(c1)COCn2cccn2 34a_100000731028_100000698116 [0,1,0,0,1,0|2,0,0]=4 6423 B16R2.255 Brc1cccc(c1)CSCc2ccsc2 62a_100000211773_100011233845 [0,1,0,0,1,0|1,1,0]=4 6424 B16R2.255 Brc1cccc(c1)CSCc2ccsc2 62a_100011261437_100000211773 [0,1,0,0,1,0|1,1,0]=4 6425 B16R2.255 Brc1cccc(n1)COCc2ccco2 34a_100000210059_100009889011 [0,1,0,0,1,0|2,0,0]=4 6426 B16R2.255 Brc1cccc(n1)COCc2cccs2 34a_100000211240_100009889011 [0,1,0,0,1,0|2,0,0]=4 6427 B16R2.255 Brc1cccc(n1)COCc2ccoc2 34a_100011215357_100009889011 [0,1,0,0,1,0|2,0,0]=4 6428 B16R2.255 Brc1cccc(n1)COCc2ccsc2 34a_100000694195_100011261437 [0,1,0,0,1,0|2,0,0]=4 6429 B16R2.255 Brc1cccc(n1)COCc2ccsc2 34a_100011215551_100009889011 [0,1,0,0,1,0|2,0,0]=4 6430 B16R2.255 Brc1ccnc(c1)COCc2ccco2 34a_100000210059_100010173614 [0,1,0,0,1,0|2,0,0]=4 6431 B16R2.255 Brc1ccnc(c1)COCc2cccs2 34a_100000211240_100010173614 [0,1,0,0,1,0|2,0,0]=4 6432 B16R2.255 Brc1ccnc(c1)COCc2ccoc2 34a_100011215357_100010173614 [0,1,0,0,1,0|2,0,0]=4 6433 B16R2.255 Brc1ccnc(c1)COCc2ccsc2 34a_100011215551_100010173614 [0,1,0,0,1,0|2,0,0]=4 6434 B16R2.255 Brc1cncc(c1)COCc2ccco2 34a_100000210059_100000738771 [0,1,0,0,1,0|2,0,0]=4 6435 B16R2.255 Brc1cncc(c1)COCc2cccs2 34a_100000211240_100000738771 [0,1,0,0,1,0|2,0,0]=4 6436 B16R2.255 Brc1cncc(c1)COCc2ccoc2 34a_100011215357_100000738771 [0,1,0,0,1,0|2,0,0]=4 6437 B16R2.255 Brc1cncc(c1)COCc2ccsc2 34a_100011215551_100000738771 [0,1,0,0,1,0|2,0,0]=4 6438 B16R2.255 Brc1cncc(c1)COCc2ccsc2 34a_100011259137_100011261437 [0,1,0,0,1,0|2,0,0]=4 6439 B16R2.255 Brc1cncc(c1)COCc2ccsc2 7a_100011259137_100011261437 [0,1,0,0,1,0|2,0,0]=4 6440 B16R2.255 Cc1cc(ccn1)COCc2ccco2 34a_100000210059_200020672517 [0,1,0,0,1,0|2,0,0]=4 6441 B16R2.255 Cc1cc(ccn1)COCc2cccs2 34a_100000211240_200020672517 [0,1,0,0,1,0|2,0,0]=4 6442 B16R2.255 Cc1cc(ccn1)COCc2ccoc2 34a_100011215357_200020672517 [0,1,0,0,1,0|2,0,0]=4 6443 B16R2.255 Cc1cc(ccn1)COCc2ccsc2 34a_100011215551_200020672517 [0,1,0,0,1,0|2,0,0]=4 6444 B16R2.255 Cc1cc(ccn1)COCc2ccsc2 34a_100011998630_100011261437 [0,1,0,0,1,0|2,0,0]=4 6445 B16R2.255 Cc1cccc(c1)CNCc2ccco2 207a_100000185548_100000186105 [0,1,0,0,1,0|2,0,0]=4 6446 B16R2.255 Cc1cccc(c1)CNCc2ccco2 207a_100000185738_100000211157 [0,1,0,0,1,0|2,0,0]=4 6447 B16R2.255 Cc1cccc(c1)CNCc2ccco2 2230a_100000185738_100000211840 [0,1,0,0,1,0|2,0,0]=4 6448 B16R2.255 Cc1cccc(c1)CNCc2ccco2 270004a_100000185548_100000186105 [0,1,0,0,1,0|2,0,0]=4 6449 B16R2.255 Cc1cccc(c1)CNCc2ccco2 270004a_100000185738_100000211157 [0,1,0,0,1,0|2,0,0]=4 6450 B16R2.255 Cc1cccc(c1)CNCc2ccco2 34a_100000185738_100000211840 [0,1,0,0,1,0|2,0,0]=4 6451 B16R2.255 Cc1cccc(c1)CNCc2cccs2 207a_100000185548_100000209959 [0,1,0,0,1,0|2,0,0]=4 6452 B16R2.255 Cc1cccc(c1)CNCc2cccs2 207a_100000211653_100000211157 [0,1,0,0,1,0|2,0,0]=4 6453 B16R2.255 Cc1cccc(c1)CNCc2cccs2 2230a_100000211653_100000211840 [0,1,0,0,1,0|2,0,0]=4 6454 B16R2.255 Cc1cccc(c1)CNCc2cccs2 270004a_100000185548_100000209959 [0,1,0,0,1,0|2,0,0]=4 6455 B16R2.255 Cc1cccc(c1)CNCc2cccs2 270004a_100000211653_100000211157 [0,1,0,0,1,0|2,0,0]=4 6456 B16R2.255 Cc1cccc(c1)CNCc2ccoc2 207a_100000185548_100011215517 [0,1,0,0,1,0|2,0,0]=4 6457 B16R2.255 Cc1cccc(c1)CNCc2ccoc2 207a_100015206860_100000211157 [0,1,0,0,1,0|2,0,0]=4 6458 B16R2.255 Cc1cccc(c1)CNCc2ccoc2 2230a_100015206860_100000211840 [0,1,0,0,1,0|2,0,0]=4 6459 B16R2.255 Cc1cccc(c1)CNCc2ccoc2 270004a_100000185548_100011215517 [0,1,0,0,1,0|2,0,0]=4 6460 B16R2.255 Cc1cccc(c1)CNCc2ccoc2 270004a_100015206860_100000211157 [0,1,0,0,1,0|2,0,0]=4 6461 B16R2.255 Cc1cccc(c1)CNCc2ccoc2 34a_100015206860_100000211840 [0,1,0,0,1,0|2,0,0]=4 6462 B16R2.255 Cc1cccc(c1)CNCc2ccsc2 207a_100000185548_100000188534 [0,1,0,0,1,0|2,0,0]=4 6463 B16R2.255 Cc1cccc(c1)CNCc2ccsc2 207a_100000186416_100000211157 [0,1,0,0,1,0|2,0,0]=4 6464 B16R2.255 Cc1cccc(c1)CNCc2ccsc2 2230a_100000185548_100011261437 [0,1,0,0,1,0|2,0,0]=4 6465 B16R2.255 Cc1cccc(c1)CNCc2ccsc2 2230a_100000186416_100000211840 [0,1,0,0,1,0|2,0,0]=4 6466 B16R2.255 Cc1cccc(c1)CNCc2ccsc2 270004a_100000185548_100000188534 [0,1,0,0,1,0|2,0,0]=4 6467 B16R2.255 Cc1cccc(c1)CNCc2ccsc2 270004a_100000186416_100000211157 [0,1,0,0,1,0|2,0,0]=4 6468 B16R2.255 Cc1cccc(c1)CNCc2ccsc2 34a_100000185548_100011261437 [0,1,0,0,1,0|2,0,0]=4 6469 B16R2.255 Cc1cccc(c1)CNCc2ccsc2 34a_100000186416_100000211840 [0,1,0,0,1,0|2,0,0]=4 6470 B16R2.255 Cc1cccc(c1)COCc2c[nH]cn2 34a_100011217746_100000707719 [0,1,0,0,1,0|2,0,0]=4 6471 B16R2.255 Cc1cccc(c1)COCc2ccco2 34a_100000210059_100000211840 [0,1,0,0,1,0|1,0,0]=3 6472 B16R2.255 Cc1cccc(c1)COCc2cccs2 34a_100000211240_100000211840 [0,1,0,0,1,0|1,0,0]=3 6473 B16R2.255 Cc1cccc(c1)COCc2ccn[nH]2 34a_100011217746_100000728653 [0,1,0,0,1,0|2,0,0]=4 6474 B16R2.255 Cc1cccc(c1)COCc2ccn[nH]2 7a_100011217746_100000728653 [0,1,0,0,1,0|2,0,0]=4 6475 B16R2.255 Cc1cccc(c1)COCc2ccno2 34a_100000740478_100000211840 [0,1,0,0,1,0|2,0,0]=4 6476 B16R2.255 Cc1cccc(c1)COCc2ccoc2 34a_100011215357_100000211840 [0,1,0,0,1,0|1,0,0]=3 6477 B16R2.255 Cc1cccc(c1)COCc2ccon2 34a_100011217746_100000234950 [0,1,0,0,1,0|2,0,0]=4 6478 B16R2.255 Cc1cccc(c1)COCc2ccon2 7a_100011217746_100000234950 [0,1,0,0,1,0|2,0,0]=4 6479 B16R2.255 Cc1cccc(c1)COCc2ccsc2 34a_100011215551_100000211840 [0,1,0,0,1,0|1,0,0]=3 6480 B16R2.255 Cc1cccc(c1)COCc2ccsc2 34a_100011217746_100011261437 [0,1,0,0,1,0|1,0,0]=3 6481 B16R2.255 Cc1cccc(c1)COCc2ccsc2 7a_100011217746_100011261437 [0,1,0,0,1,0|1,0,0]=3 6482 B16R2.255 Cc1cccc(c1)COCc2cncs2 34a_100011217746_100015185245 [0,1,0,0,1,0|2,0,0]=4 6483 B16R2.255 Cc1cccc(c1)COCc2cncs2 7a_100011217746_100015185245 [0,1,0,0,1,0|2,0,0]=4 6484 B16R2.255 Cc1cccc(c1)COCc2cscn2 34a_100011217746_100000205941 [0,1,0,0,1,0|2,0,0]=4 6485 B16R2.255 Cc1cccc(c1)COCc2cscn2 7a_100011217746_100000205941 [0,1,0,0,1,0|2,0,0]=4 6486 B16R2.255 Cc1cccc(c1)COCc2ncc[nH]2 34a_100011217746_100016991755 [0,1,0,0,1,0|2,0,0]=4 6487 B16R2.255 Cc1cccc(c1)COCc2ncc[nH]2 7a_100011217746_100000753453 [0,1,0,0,1,0|2,0,0]=4 6488 B16R2.255 Cc1cccc(c1)COCc2ncco2 34a_100000062594_100000211840 [0,1,0,0,1,0|2,0,0]=4 6489 B16R2.255 Cc1cccc(c1)COCc2ncco2 34a_100011217746_103436540062 [0,1,0,0,1,0|2,0,0]=4 6490 B16R2.255 Cc1cccc(c1)COCc2ncco2 7a_100011217746_103436540062 [0,1,0,0,1,0|2,0,0]=4 6491 B16R2.255 Cc1cccc(c1)COCc2nccs2 34a_100011217746_100015184050 [0,1,0,0,1,0|2,0,0]=4 6492 B16R2.255 Cc1cccc(c1)COCc2nccs2 7a_100011217746_100015184050 [0,1,0,0,1,0|2,0,0]=4 6493 B16R2.255 Cc1cccc(c1)COCn2cccn2 34a_100000731028_100000211840 [0,1,0,0,1,0|2,0,0]=4 6494 B16R2.255 Cc1cccc(c1)CSCc2ccsc2 62a_100000211840_100011233845 [0,1,0,0,1,0|1,1,0]=4 6495 B16R2.255 Cc1cccc(c1)CSCc2ccsc2 62a_100011261437_100000211840 [0,1,0,0,1,0|1,1,0]=4 6496 B16R2.255 Cc1cccc(n1)COCc2ccco2 34a_100000210059_100000757606 [0,1,0,0,1,0|2,0,0]=4 6497 B16R2.255 Cc1cccc(n1)COCc2cccs2 34a_100000211240_100000757606 [0,1,0,0,1,0|2,0,0]=4 6498 B16R2.255 Cc1cccc(n1)COCc2ccoc2 34a_100011215357_100000757606 [0,1,0,0,1,0|2,0,0]=4 6499 B16R2.255 Cc1cccc(n1)COCc2ccsc2 34a_100000690600_100011261437 [0,1,0,0,1,0|2,0,0]=4 6500 B16R2.255 Cc1cccc(n1)COCc2ccsc2 34a_100011215551_100000757606 [0,1,0,0,1,0|2,0,0]=4 6501 B16R2.255 Cc1ccnc(c1)COCc2ccco2 34a_100000210059_100000718516 [0,1,0,0,1,0|2,0,0]=4 6502 B16R2.255 Cc1ccnc(c1)COCc2cccs2 34a_100000211240_100000718516 [0,1,0,0,1,0|2,0,0]=4 6503 B16R2.255 Cc1ccnc(c1)COCc2ccoc2 34a_100011215357_100000718516 [0,1,0,0,1,0|2,0,0]=4 6504 B16R2.255 Cc1ccnc(c1)COCc2ccsc2 34a_100011215551_100000718516 [0,1,0,0,1,0|2,0,0]=4 6505 B16R2.255 Cc1ccnc(c1)COCc2ccsc2 34a_100011998357_100011261437 [0,1,0,0,1,0|2,0,0]=4 6506 B16R2.255 Cc1cncc(c1)COCc2ccco2 34a_100000210059_100000716715 [0,1,0,0,1,0|2,0,0]=4 6507 B16R2.255 Cc1cncc(c1)COCc2cccs2 34a_100000211240_100000716715 [0,1,0,0,1,0|2,0,0]=4 6508 B16R2.255 Cc1cncc(c1)COCc2ccoc2 34a_100011215357_100000716715 [0,1,0,0,1,0|2,0,0]=4 6509 B16R2.255 Cc1cncc(c1)COCc2ccsc2 34a_100011215551_100000716715 [0,1,0,0,1,0|2,0,0]=4 6510 B16R2.255 Cc1cncc(c1)COCc2ccsc2 34a_100011998709_100011261437 [0,1,0,0,1,0|2,0,0]=4 6511 B16R2.255 Cc1cncc(c1)COCc2ccsc2 7a_100011998709_100011261437 [0,1,0,0,1,0|2,0,0]=4 6512 B16R2.255 Clc1cc(ccn1)COCc2ccco2 34a_100000210059_100000764220 [0,1,0,0,1,0|2,0,0]=4 6513 B16R2.255 Clc1cc(ccn1)COCc2cccs2 34a_100000211240_100000764220 [0,1,0,0,1,0|2,0,0]=4 6514 B16R2.255 Clc1cc(ccn1)COCc2ccoc2 34a_100011215357_100000764220 [0,1,0,0,1,0|2,0,0]=4 6515 B16R2.255 Clc1cc(ccn1)COCc2ccsc2 34a_100000748751_100011261437 [0,1,0,0,1,0|2,0,0]=4 6516 B16R2.255 Clc1cc(ccn1)COCc2ccsc2 34a_100011215551_100000764220 [0,1,0,0,1,0|2,0,0]=4 6517 B16R2.255 Clc1cccc(c1)CNCc2ccco2 207a_100000174878_100000186105 [0,1,0,0,1,0|2,0,0]=4 6518 B16R2.255 Clc1cccc(c1)CNCc2ccco2 207a_100000185738_100000210801 [0,1,0,0,1,0|2,0,0]=4 6519 B16R2.255 Clc1cccc(c1)CNCc2ccco2 2230a_100000185738_100000181238 [0,1,0,0,1,0|2,0,0]=4 6520 B16R2.255 Clc1cccc(c1)CNCc2ccco2 270004a_100000174878_100000186105 [0,1,0,0,1,0|2,0,0]=4 6521 B16R2.255 Clc1cccc(c1)CNCc2ccco2 270004a_100000185738_100000210801 [0,1,0,0,1,0|2,0,0]=4 6522 B16R2.255 Clc1cccc(c1)CNCc2ccco2 34a_100000185738_100000187163 [0,1,0,0,1,0|2,0,0]=4 6523 B16R2.255 Clc1cccc(c1)CNCc2cccs2 207a_100000174878_100000209959 [0,1,0,0,1,0|2,0,0]=4 6524 B16R2.255 Clc1cccc(c1)CNCc2cccs2 207a_100000211653_100000210801 [0,1,0,0,1,0|2,0,0]=4 6525 B16R2.255 Clc1cccc(c1)CNCc2cccs2 2230a_100000211653_100000181238 [0,1,0,0,1,0|2,0,0]=4 6526 B16R2.255 Clc1cccc(c1)CNCc2cccs2 270004a_100000174878_100000209959 [0,1,0,0,1,0|2,0,0]=4 6527 B16R2.255 Clc1cccc(c1)CNCc2cccs2 270004a_100000211653_100000210801 [0,1,0,0,1,0|2,0,0]=4 6528 B16R2.255 Clc1cccc(c1)CNCc2ccoc2 207a_100000174878_100011215517 [0,1,0,0,1,0|2,0,0]=4 6529 B16R2.255 Clc1cccc(c1)CNCc2ccoc2 207a_100015206860_100000210801 [0,1,0,0,1,0|2,0,0]=4 6530 B16R2.255 Clc1cccc(c1)CNCc2ccoc2 2230a_100015206860_100000181238 [0,1,0,0,1,0|2,0,0]=4 6531 B16R2.255 Clc1cccc(c1)CNCc2ccoc2 270004a_100000174878_100011215517 [0,1,0,0,1,0|2,0,0]=4 6532 B16R2.255 Clc1cccc(c1)CNCc2ccoc2 270004a_100015206860_100000210801 [0,1,0,0,1,0|2,0,0]=4 6533 B16R2.255 Clc1cccc(c1)CNCc2ccoc2 34a_100015206860_100000187163 [0,1,0,0,1,0|2,0,0]=4 6534 B16R2.255 Clc1cccc(c1)CNCc2ccsc2 207a_100000174878_100000188534 [0,1,0,0,1,0|2,0,0]=4 6535 B16R2.255 Clc1cccc(c1)CNCc2ccsc2 207a_100000186416_100000210801 [0,1,0,0,1,0|2,0,0]=4 6536 B16R2.255 Clc1cccc(c1)CNCc2ccsc2 2230a_100000174878_100011261437 [0,1,0,0,1,0|2,0,0]=4 6537 B16R2.255 Clc1cccc(c1)CNCc2ccsc2 2230a_100000186416_100000181238 [0,1,0,0,1,0|2,0,0]=4 6538 B16R2.255 Clc1cccc(c1)CNCc2ccsc2 270004a_100000174878_100000188534 [0,1,0,0,1,0|2,0,0]=4 6539 B16R2.255 Clc1cccc(c1)CNCc2ccsc2 270004a_100000186416_100000210801 [0,1,0,0,1,0|2,0,0]=4 6540 B16R2.255 Clc1cccc(c1)CNCc2ccsc2 34a_100000174878_100011261437 [0,1,0,0,1,0|2,0,0]=4 6541 B16R2.255 Clc1cccc(c1)CNCc2ccsc2 34a_100000186416_100000187163 [0,1,0,0,1,0|2,0,0]=4 6542 B16R2.255 Clc1cccc(c1)COCc2c[nH]cn2 34a_100000241301_100000707719 [0,1,0,0,1,0|2,0,0]=4 6543 B16R2.255 Clc1cccc(c1)COCc2ccco2 34a_100000210059_100000187163 [0,1,0,0,1,0|1,0,0]=3 6544 B16R2.255 Clc1cccc(c1)COCc2cccs2 34a_100000211240_100000187163 [0,1,0,0,1,0|1,0,0]=3 6545 B16R2.255 Clc1cccc(c1)COCc2ccn[nH]2 34a_100000241301_100000728653 [0,1,0,0,1,0|2,0,0]=4 6546 B16R2.255 Clc1cccc(c1)COCc2ccn[nH]2 7a_100000241301_100000728653 [0,1,0,0,1,0|2,0,0]=4 6547 B16R2.255 Clc1cccc(c1)COCc2ccno2 34a_100000740478_100000187163 [0,1,0,0,1,0|2,0,0]=4 6548 B16R2.255 Clc1cccc(c1)COCc2ccoc2 34a_100011215357_100000187163 [0,1,0,0,1,0|1,0,0]=3 6549 B16R2.255 Clc1cccc(c1)COCc2ccon2 34a_100000241301_100000234950 [0,1,0,0,1,0|2,0,0]=4 6550 B16R2.255 Clc1cccc(c1)COCc2ccon2 7a_100000241301_100000234950 [0,1,0,0,1,0|2,0,0]=4 6551 B16R2.255 Clc1cccc(c1)COCc2ccsc2 34a_100000241301_100011261437 [0,1,0,0,1,0|1,0,0]=3 6552 B16R2.255 Clc1cccc(c1)COCc2ccsc2 34a_100011215551_100000187163 [0,1,0,0,1,0|1,0,0]=3 6553 B16R2.255 Clc1cccc(c1)COCc2ccsc2 7a_100000241301_100011261437 [0,1,0,0,1,0|1,0,0]=3 6554 B16R2.255 Clc1cccc(c1)COCc2cncs2 34a_100000241301_100015185245 [0,1,0,0,1,0|2,0,0]=4 6555 B16R2.255 Clc1cccc(c1)COCc2cncs2 7a_100000241301_100015185245 [0,1,0,0,1,0|2,0,0]=4 6556 B16R2.255 Clc1cccc(c1)COCc2cscn2 34a_100000241301_100000205941 [0,1,0,0,1,0|2,0,0]=4 6557 B16R2.255 Clc1cccc(c1)COCc2cscn2 7a_100000241301_100000205941 [0,1,0,0,1,0|2,0,0]=4 6558 B16R2.255 Clc1cccc(c1)COCc2ncc[nH]2 34a_100000241301_100016991755 [0,1,0,0,1,0|2,0,0]=4 6559 B16R2.255 Clc1cccc(c1)COCc2ncc[nH]2 7a_100000241301_100000753453 [0,1,0,0,1,0|2,0,0]=4 6560 B16R2.255 Clc1cccc(c1)COCc2ncco2 34a_100000062594_100000187163 [0,1,0,0,1,0|2,0,0]=4 6561 B16R2.255 Clc1cccc(c1)COCc2ncco2 34a_100000241301_103436540062 [0,1,0,0,1,0|2,0,0]=4 6562 B16R2.255 Clc1cccc(c1)COCc2ncco2 7a_100000241301_103436540062 [0,1,0,0,1,0|2,0,0]=4 6563 B16R2.255 Clc1cccc(c1)COCc2nccs2 34a_100000241301_100015184050 [0,1,0,0,1,0|2,0,0]=4 6564 B16R2.255 Clc1cccc(c1)COCc2nccs2 7a_100000241301_100015184050 [0,1,0,0,1,0|2,0,0]=4 6565 B16R2.255 Clc1cccc(c1)COCn2cccn2 34a_100000731028_100000187163 [0,1,0,0,1,0|2,0,0]=4 6566 B16R2.255 Clc1cccc(c1)CSCc2ccsc2 62a_100000187163_100011233845 [0,1,0,0,1,0|1,1,0]=4 6567 B16R2.255 Clc1cccc(c1)CSCc2ccsc2 62a_100011261437_100000187163 [0,1,0,0,1,0|1,1,0]=4 6568 B16R2.255 Clc1cccc(n1)COCc2ccco2 34a_100000210059_100000086093 [0,1,0,0,1,0|2,0,0]=4 6569 B16R2.255 Clc1cccc(n1)COCc2cccs2 34a_100000211240_100000086093 [0,1,0,0,1,0|2,0,0]=4 6570 B16R2.255 Clc1cccc(n1)COCc2ccoc2 34a_100011215357_100000086093 [0,1,0,0,1,0|2,0,0]=4 6571 B16R2.255 Clc1cccc(n1)COCc2ccsc2 34a_100011215551_100000086093 [0,1,0,0,1,0|2,0,0]=4 6572 B16R2.255 Clc1cccc(n1)COCc2ccsc2 34a_100011998359_100011261437 [0,1,0,0,1,0|2,0,0]=4 6573 B16R2.255 Clc1ccnc(c1)COCc2ccco2 34a_100000210059_100016988179 [0,1,0,0,1,0|2,0,0]=4 6574 B16R2.255 Clc1ccnc(c1)COCc2cccs2 34a_100000211240_100016988179 [0,1,0,0,1,0|2,0,0]=4 6575 B16R2.255 Clc1ccnc(c1)COCc2ccoc2 34a_100011215357_100016988179 [0,1,0,0,1,0|2,0,0]=4 6576 B16R2.255 Clc1ccnc(c1)COCc2ccsc2 34a_100000748867_100011261437 [0,1,0,0,1,0|2,0,0]=4 6577 B16R2.255 Clc1ccnc(c1)COCc2ccsc2 34a_100011215551_100016988179 [0,1,0,0,1,0|2,0,0]=4 6578 B16R2.255 Clc1cncc(c1)COCc2ccco2 34a_100000210059_100016992070 [0,1,0,0,1,0|2,0,0]=4 6579 B16R2.255 Clc1cncc(c1)COCc2cccs2 34a_100000211240_100016992070 [0,1,0,0,1,0|2,0,0]=4 6580 B16R2.255 Clc1cncc(c1)COCc2ccoc2 34a_100011215357_100016992070 [0,1,0,0,1,0|2,0,0]=4 6581 B16R2.255 Clc1cncc(c1)COCc2ccsc2 34a_100000092867_100011261437 [0,1,0,0,1,0|2,0,0]=4 6582 B16R2.255 Clc1cncc(c1)COCc2ccsc2 34a_100011215551_100016992070 [0,1,0,0,1,0|2,0,0]=4 6583 B16R2.255 Clc1cncc(c1)COCc2ccsc2 7a_100000092867_100011261437 [0,1,0,0,1,0|2,0,0]=4 6584 B16R2.255 Fc1cc(ccn1)COCc2ccsc2 34a_100000082451_100011261437 [0,1,0,0,1,0|2,0,0]=4 6585 B16R2.255 Fc1cccc(c1)CNCc2ccco2 207a_100000174948_100000186105 [0,1,0,0,1,0|2,0,0]=4 6586 B16R2.255 Fc1cccc(c1)CNCc2ccco2 207a_100000185738_100000210812 [0,1,0,0,1,0|2,0,0]=4 6587 B16R2.255 Fc1cccc(c1)CNCc2ccco2 2230a_100000185738_100000230114 [0,1,0,0,1,0|2,0,0]=4 6588 B16R2.255 Fc1cccc(c1)CNCc2ccco2 270004a_100000174948_100000186105 [0,1,0,0,1,0|2,0,0]=4 6589 B16R2.255 Fc1cccc(c1)CNCc2ccco2 270004a_100000185738_100000210812 [0,1,0,0,1,0|2,0,0]=4 6590 B16R2.255 Fc1cccc(c1)CNCc2ccco2 34a_100000185738_100000187166 [0,1,0,0,1,0|2,0,0]=4 6591 B16R2.255 Fc1cccc(c1)CNCc2cccs2 207a_100000174948_100000209959 [0,1,0,0,1,0|2,0,0]=4 6592 B16R2.255 Fc1cccc(c1)CNCc2cccs2 207a_100000211653_100000210812 [0,1,0,0,1,0|2,0,0]=4 6593 B16R2.255 Fc1cccc(c1)CNCc2cccs2 2230a_100000211653_100000230114 [0,1,0,0,1,0|2,0,0]=4 6594 B16R2.255 Fc1cccc(c1)CNCc2cccs2 270004a_100000174948_100000209959 [0,1,0,0,1,0|2,0,0]=4 6595 B16R2.255 Fc1cccc(c1)CNCc2cccs2 270004a_100000211653_100000210812 [0,1,0,0,1,0|2,0,0]=4 6596 B16R2.255 Fc1cccc(c1)CNCc2ccoc2 207a_100000174948_100011215517 [0,1,0,0,1,0|2,0,0]=4 6597 B16R2.255 Fc1cccc(c1)CNCc2ccoc2 207a_100015206860_100000210812 [0,1,0,0,1,0|2,0,0]=4 6598 B16R2.255 Fc1cccc(c1)CNCc2ccoc2 2230a_100015206860_100000230114 [0,1,0,0,1,0|2,0,0]=4 6599 B16R2.255 Fc1cccc(c1)CNCc2ccoc2 270004a_100000174948_100011215517 [0,1,0,0,1,0|2,0,0]=4 6600 B16R2.255 Fc1cccc(c1)CNCc2ccoc2 270004a_100015206860_100000210812 [0,1,0,0,1,0|2,0,0]=4 6601 B16R2.255 Fc1cccc(c1)CNCc2ccoc2 34a_100015206860_100000187166 [0,1,0,0,1,0|2,0,0]=4 6602 B16R2.255 Fc1cccc(c1)CNCc2ccsc2 207a_100000174948_100000188534 [0,1,0,0,1,0|2,0,0]=4 6603 B16R2.255 Fc1cccc(c1)CNCc2ccsc2 207a_100000186416_100000210812 [0,1,0,0,1,0|2,0,0]=4 6604 B16R2.255 Fc1cccc(c1)CNCc2ccsc2 2230a_100000174948_100011261437 [0,1,0,0,1,0|2,0,0]=4 6605 B16R2.255 Fc1cccc(c1)CNCc2ccsc2 2230a_100000186416_100000230114 [0,1,0,0,1,0|2,0,0]=4 6606 B16R2.255 Fc1cccc(c1)CNCc2ccsc2 270004a_100000174948_100000188534 [0,1,0,0,1,0|2,0,0]=4 6607 B16R2.255 Fc1cccc(c1)CNCc2ccsc2 270004a_100000186416_100000210812 [0,1,0,0,1,0|2,0,0]=4 6608 B16R2.255 Fc1cccc(c1)CNCc2ccsc2 34a_100000174948_100011261437 [0,1,0,0,1,0|2,0,0]=4 6609 B16R2.255 Fc1cccc(c1)CNCc2ccsc2 34a_100000186416_100000187166 [0,1,0,0,1,0|2,0,0]=4 6610 B16R2.255 Fc1cccc(c1)COCc2c[nH]cn2 34a_100000210976_100000707719 [0,1,0,0,1,0|2,0,0]=4 6611 B16R2.255 Fc1cccc(c1)COCc2ccco2 34a_100000210059_100000187166 [0,1,0,0,1,0|1,0,0]=3 6612 B16R2.255 Fc1cccc(c1)COCc2cccs2 34a_100000211240_100000187166 [0,1,0,0,1,0|1,0,0]=3 6613 B16R2.255 Fc1cccc(c1)COCc2ccn[nH]2 34a_100000210976_100000728653 [0,1,0,0,1,0|2,0,0]=4 6614 B16R2.255 Fc1cccc(c1)COCc2ccn[nH]2 7a_100000210976_100000728653 [0,1,0,0,1,0|2,0,0]=4 6615 B16R2.255 Fc1cccc(c1)COCc2ccno2 34a_100000740478_100000187166 [0,1,0,0,1,0|2,0,0]=4 6616 B16R2.255 Fc1cccc(c1)COCc2ccoc2 34a_100011215357_100000187166 [0,1,0,0,1,0|1,0,0]=3 6617 B16R2.255 Fc1cccc(c1)COCc2ccon2 34a_100000210976_100000234950 [0,1,0,0,1,0|2,0,0]=4 6618 B16R2.255 Fc1cccc(c1)COCc2ccon2 7a_100000210976_100000234950 [0,1,0,0,1,0|2,0,0]=4 6619 B16R2.255 Fc1cccc(c1)COCc2ccsc2 34a_100000210976_100011261437 [0,1,0,0,1,0|1,0,0]=3 6620 B16R2.255 Fc1cccc(c1)COCc2ccsc2 34a_100011215551_100000187166 [0,1,0,0,1,0|1,0,0]=3 6621 B16R2.255 Fc1cccc(c1)COCc2ccsc2 7a_100000210976_100011261437 [0,1,0,0,1,0|1,0,0]=3 6622 B16R2.255 Fc1cccc(c1)COCc2cncs2 34a_100000210976_100015185245 [0,1,0,0,1,0|2,0,0]=4 6623 B16R2.255 Fc1cccc(c1)COCc2cncs2 7a_100000210976_100015185245 [0,1,0,0,1,0|2,0,0]=4 6624 B16R2.255 Fc1cccc(c1)COCc2cscn2 34a_100000210976_100000205941 [0,1,0,0,1,0|2,0,0]=4 6625 B16R2.255 Fc1cccc(c1)COCc2cscn2 7a_100000210976_100000205941 [0,1,0,0,1,0|2,0,0]=4 6626 B16R2.255 Fc1cccc(c1)COCc2ncc[nH]2 34a_100000210976_100016991755 [0,1,0,0,1,0|2,0,0]=4 6627 B16R2.255 Fc1cccc(c1)COCc2ncc[nH]2 7a_100000210976_100000753453 [0,1,0,0,1,0|2,0,0]=4 6628 B16R2.255 Fc1cccc(c1)COCc2ncco2 34a_100000062594_100000187166 [0,1,0,0,1,0|2,0,0]=4 6629 B16R2.255 Fc1cccc(c1)COCc2ncco2 34a_100000210976_103436540062 [0,1,0,0,1,0|2,0,0]=4 6630 B16R2.255 Fc1cccc(c1)COCc2ncco2 7a_100000210976_103436540062 [0,1,0,0,1,0|2,0,0]=4 6631 B16R2.255 Fc1cccc(c1)COCc2nccs2 34a_100000210976_100015184050 [0,1,0,0,1,0|2,0,0]=4 6632 B16R2.255 Fc1cccc(c1)COCc2nccs2 7a_100000210976_100015184050 [0,1,0,0,1,0|2,0,0]=4 6633 B16R2.255 Fc1cccc(c1)COCn2cccn2 34a_100000731028_100000187166 [0,1,0,0,1,0|2,0,0]=4 6634 B16R2.255 Fc1cccc(c1)CSCc2ccsc2 62a_100000230114_100011233845 [0,1,0,0,1,0|1,1,0]=4 6635 B16R2.255 Fc1cccc(c1)CSCc2ccsc2 62a_100011261437_100000230114 [0,1,0,0,1,0|1,1,0]=4 6636 B16R2.255 Fc1cccc(n1)COCc2ccco2 34a_100000210059_100009819644 [0,1,0,0,1,0|2,0,0]=4 6637 B16R2.255 Fc1cccc(n1)COCc2cccs2 34a_100000211240_100009819644 [0,1,0,0,1,0|2,0,0]=4 6638 B16R2.255 Fc1cccc(n1)COCc2ccoc2 34a_100011215357_100009819644 [0,1,0,0,1,0|2,0,0]=4 6639 B16R2.255 Fc1cccc(n1)COCc2ccsc2 34a_100000086748_100011261437 [0,1,0,0,1,0|2,0,0]=4 6640 B16R2.255 Fc1cccc(n1)COCc2ccsc2 34a_100011215551_100009819644 [0,1,0,0,1,0|2,0,0]=4 6641 B16R2.255 Fc1cncc(c1)COCc2ccco2 34a_100000210059_100000725299 [0,1,0,0,1,0|2,0,0]=4 6642 B16R2.255 Fc1cncc(c1)COCc2cccs2 34a_100000211240_100000725299 [0,1,0,0,1,0|2,0,0]=4 6643 B16R2.255 Fc1cncc(c1)COCc2ccoc2 34a_100011215357_100000725299 [0,1,0,0,1,0|2,0,0]=4 6644 B16R2.255 Fc1cncc(c1)COCc2ccsc2 34a_100011215551_100000725299 [0,1,0,0,1,0|2,0,0]=4 6645 B16R2.255 Fc1cncc(c1)COCc2ccsc2 34a_100011962875_100011261437 [0,1,0,0,1,0|2,0,0]=4 6646 B16R2.255 Fc1cncc(c1)COCc2ccsc2 7a_100011962875_100011261437 [0,1,0,0,1,0|2,0,0]=4 6647 B16R2.255 Ic1cccc(c1)CNCc2ccco2 207a_100000106179_100000186105 [0,1,0,0,1,0|2,0,0]=4 6648 B16R2.255 Ic1cccc(c1)CNCc2ccco2 207a_100000185738_100000014684 [0,1,0,0,1,0|2,0,0]=4 6649 B16R2.255 Ic1cccc(c1)CNCc2ccco2 2230a_100000185738_100011218688 [0,1,0,0,1,0|2,0,0]=4 6650 B16R2.255 Ic1cccc(c1)CNCc2ccco2 270004a_100000106179_100000186105 [0,1,0,0,1,0|2,0,0]=4 6651 B16R2.255 Ic1cccc(c1)CNCc2ccco2 270004a_100000185738_100000014684 [0,1,0,0,1,0|2,0,0]=4 6652 B16R2.255 Ic1cccc(c1)CNCc2ccco2 34a_100000185738_100011218688 [0,1,0,0,1,0|2,0,0]=4 6653 B16R2.255 Ic1cccc(c1)CNCc2cccs2 207a_100000106179_100000209959 [0,1,0,0,1,0|2,0,0]=4 6654 B16R2.255 Ic1cccc(c1)CNCc2cccs2 207a_100000211653_100000014684 [0,1,0,0,1,0|2,0,0]=4 6655 B16R2.255 Ic1cccc(c1)CNCc2cccs2 2230a_100000211653_100011218688 [0,1,0,0,1,0|2,0,0]=4 6656 B16R2.255 Ic1cccc(c1)CNCc2cccs2 270004a_100000106179_100000209959 [0,1,0,0,1,0|2,0,0]=4 6657 B16R2.255 Ic1cccc(c1)CNCc2cccs2 270004a_100000211653_100000014684 [0,1,0,0,1,0|2,0,0]=4 6658 B16R2.255 Ic1cccc(c1)CNCc2ccoc2 207a_100000106179_100011215517 [0,1,0,0,1,0|2,0,0]=4 6659 B16R2.255 Ic1cccc(c1)CNCc2ccoc2 207a_100015206860_100000014684 [0,1,0,0,1,0|2,0,0]=4 6660 B16R2.255 Ic1cccc(c1)CNCc2ccoc2 2230a_100015206860_100011218688 [0,1,0,0,1,0|2,0,0]=4 6661 B16R2.255 Ic1cccc(c1)CNCc2ccoc2 270004a_100000106179_100011215517 [0,1,0,0,1,0|2,0,0]=4 6662 B16R2.255 Ic1cccc(c1)CNCc2ccoc2 270004a_100015206860_100000014684 [0,1,0,0,1,0|2,0,0]=4 6663 B16R2.255 Ic1cccc(c1)CNCc2ccoc2 34a_100015206860_100011218688 [0,1,0,0,1,0|2,0,0]=4 6664 B16R2.255 Ic1cccc(c1)CNCc2ccsc2 207a_100000106179_100000188534 [0,1,0,0,1,0|2,0,0]=4 6665 B16R2.255 Ic1cccc(c1)CNCc2ccsc2 207a_100000186416_100000014684 [0,1,0,0,1,0|2,0,0]=4 6666 B16R2.255 Ic1cccc(c1)CNCc2ccsc2 2230a_100000106179_100011261437 [0,1,0,0,1,0|2,0,0]=4 6667 B16R2.255 Ic1cccc(c1)CNCc2ccsc2 2230a_100000186416_100011218688 [0,1,0,0,1,0|2,0,0]=4 6668 B16R2.255 Ic1cccc(c1)CNCc2ccsc2 270004a_100000106179_100000188534 [0,1,0,0,1,0|2,0,0]=4 6669 B16R2.255 Ic1cccc(c1)CNCc2ccsc2 270004a_100000186416_100000014684 [0,1,0,0,1,0|2,0,0]=4 6670 B16R2.255 Ic1cccc(c1)CNCc2ccsc2 34a_100000106179_100011261437 [0,1,0,0,1,0|2,0,0]=4 6671 B16R2.255 Ic1cccc(c1)CNCc2ccsc2 34a_100000186416_100011218688 [0,1,0,0,1,0|2,0,0]=4 6672 B16R2.255 Ic1cccc(c1)COCc2c[nH]cn2 34a_100011215336_100000707719 [0,1,0,0,1,0|2,0,0]=4 6673 B16R2.255 Ic1cccc(c1)COCc2ccco2 34a_100000210059_100011218688 [0,1,0,0,1,0|1,0,0]=3 6674 B16R2.255 Ic1cccc(c1)COCc2cccs2 34a_100000211240_100011218688 [0,1,0,0,1,0|1,0,0]=3 6675 B16R2.255 Ic1cccc(c1)COCc2ccn[nH]2 34a_100011215336_100000728653 [0,1,0,0,1,0|2,0,0]=4 6676 B16R2.255 Ic1cccc(c1)COCc2ccn[nH]2 7a_100011215336_100000728653 [0,1,0,0,1,0|2,0,0]=4 6677 B16R2.255 Ic1cccc(c1)COCc2ccno2 34a_100000740478_100011218688 [0,1,0,0,1,0|2,0,0]=4 6678 B16R2.255 Ic1cccc(c1)COCc2ccoc2 34a_100011215357_100011218688 [0,1,0,0,1,0|1,0,0]=3 6679 B16R2.255 Ic1cccc(c1)COCc2ccon2 34a_100011215336_100000234950 [0,1,0,0,1,0|2,0,0]=4 6680 B16R2.255 Ic1cccc(c1)COCc2ccon2 7a_100011215336_100000234950 [0,1,0,0,1,0|2,0,0]=4 6681 B16R2.255 Ic1cccc(c1)COCc2ccsc2 34a_100011215336_100011261437 [0,1,0,0,1,0|1,0,0]=3 6682 B16R2.255 Ic1cccc(c1)COCc2ccsc2 34a_100011215551_100011218688 [0,1,0,0,1,0|1,0,0]=3 6683 B16R2.255 Ic1cccc(c1)COCc2ccsc2 7a_100011215336_100011261437 [0,1,0,0,1,0|1,0,0]=3 6684 B16R2.255 Ic1cccc(c1)COCc2cncs2 34a_100011215336_100015185245 [0,1,0,0,1,0|2,0,0]=4 6685 B16R2.255 Ic1cccc(c1)COCc2cncs2 7a_100011215336_100015185245 [0,1,0,0,1,0|2,0,0]=4 6686 B16R2.255 Ic1cccc(c1)COCc2cscn2 34a_100011215336_100000205941 [0,1,0,0,1,0|2,0,0]=4 6687 B16R2.255 Ic1cccc(c1)COCc2cscn2 7a_100011215336_100000205941 [0,1,0,0,1,0|2,0,0]=4 6688 B16R2.255 Ic1cccc(c1)COCc2ncc[nH]2 34a_100011215336_100016991755 [0,1,0,0,1,0|2,0,0]=4 6689 B16R2.255 Ic1cccc(c1)COCc2ncc[nH]2 7a_100011215336_100000753453 [0,1,0,0,1,0|2,0,0]=4 6690 B16R2.255 Ic1cccc(c1)COCc2ncco2 34a_100000062594_100011218688 [0,1,0,0,1,0|2,0,0]=4 6691 B16R2.255 Ic1cccc(c1)COCc2ncco2 34a_100011215336_103436540062 [0,1,0,0,1,0|2,0,0]=4 6692 B16R2.255 Ic1cccc(c1)COCc2ncco2 7a_100011215336_103436540062 [0,1,0,0,1,0|2,0,0]=4 6693 B16R2.255 Ic1cccc(c1)COCc2nccs2 34a_100011215336_100015184050 [0,1,0,0,1,0|2,0,0]=4 6694 B16R2.255 Ic1cccc(c1)COCc2nccs2 7a_100011215336_100015184050 [0,1,0,0,1,0|2,0,0]=4 6695 B16R2.255 Ic1cccc(c1)COCn2cccn2 34a_100000731028_100011218688 [0,1,0,0,1,0|2,0,0]=4 6696 B16R2.255 Ic1cccc(c1)CSCc2ccsc2 62a_100011218688_100011233845 [0,1,0,0,1,0|1,1,0]=4 6697 B16R2.255 Ic1cccc(c1)CSCc2ccsc2 62a_100011261437_100011218688 [0,1,0,0,1,0|1,1,0]=4 6698 B16R2.255 Nc1cccc(c1)COCc2c[nH]cn2 34a_100000211919_100000707719 [0,1,0,0,1,0|2,0,0]=4 6699 B16R2.255 Nc1cccc(c1)COCc2ccn[nH]2 34a_100000211919_100000728653 [0,1,0,0,1,0|2,0,0]=4 6700 B16R2.255 Nc1cccc(c1)COCc2ccon2 34a_100000211919_100000234950 [0,1,0,0,1,0|2,0,0]=4 6701 B16R2.255 Nc1cccc(c1)COCc2ccsc2 34a_100000211919_100011261437 [0,1,0,0,1,0|1,0,0]=3 6702 B16R2.255 Nc1cccc(c1)COCc2cncs2 34a_100000211919_100015185245 [0,1,0,0,1,0|2,0,0]=4 6703 B16R2.255 Nc1cccc(c1)COCc2cscn2 34a_100000211919_100000205941 [0,1,0,0,1,0|2,0,0]=4 6704 B16R2.255 Nc1cccc(c1)COCc2ncc[nH]2 34a_100000211919_100016991755 [0,1,0,0,1,0|2,0,0]=4 6705 B16R2.255 Nc1cccc(c1)COCc2ncco2 34a_100000211919_103436540062 [0,1,0,0,1,0|2,0,0]=4 6706 B16R2.255 Nc1cccc(c1)COCc2nccs2 34a_100000211919_100015184050 [0,1,0,0,1,0|2,0,0]=4 6707 B16R2.255 Nc1ccnc(c1)COCc2ccsc2 34a_100000692640_100011261437 [0,1,0,0,1,0|2,0,0]=4 6708 B16R2.255 Nc1cncc(c1)COCc2ccsc2 34a_100000085308_100011261437 [0,1,0,0,1,0|2,0,0]=4 6709 B16R2.255 Oc1cccc(c1)CNCc2ccco2 207a_100000185738_100000188321 [0,1,0,0,1,0|2,0,0]=4 6710 B16R2.255 Oc1cccc(c1)CNCc2ccco2 207a_100000743036_100000186105 [0,1,0,0,1,0|2,0,0]=4 6711 B16R2.255 Oc1cccc(c1)CNCc2ccco2 2230a_100000185738_100011660834 [0,1,0,0,1,0|2,0,0]=4 6712 B16R2.255 Oc1cccc(c1)CNCc2ccco2 270004a_100000185738_100000188321 [0,1,0,0,1,0|2,0,0]=4 6713 B16R2.255 Oc1cccc(c1)CNCc2ccco2 270004a_100000743036_100000186105 [0,1,0,0,1,0|2,0,0]=4 6714 B16R2.255 Oc1cccc(c1)CNCc2ccco2 34a_100000185738_100011660834 [0,1,0,0,1,0|2,0,0]=4 6715 B16R2.255 Oc1cccc(c1)CNCc2cccs2 207a_100000211653_100000188321 [0,1,0,0,1,0|2,0,0]=4 6716 B16R2.255 Oc1cccc(c1)CNCc2cccs2 207a_100000743036_100000209959 [0,1,0,0,1,0|2,0,0]=4 6717 B16R2.255 Oc1cccc(c1)CNCc2cccs2 2230a_100000211653_100011660834 [0,1,0,0,1,0|2,0,0]=4 6718 B16R2.255 Oc1cccc(c1)CNCc2cccs2 270004a_100000211653_100000188321 [0,1,0,0,1,0|2,0,0]=4 6719 B16R2.255 Oc1cccc(c1)CNCc2cccs2 270004a_100000743036_100000209959 [0,1,0,0,1,0|2,0,0]=4 6720 B16R2.255 Oc1cccc(c1)CNCc2ccoc2 207a_100000743036_100011215517 [0,1,0,0,1,0|2,0,0]=4 6721 B16R2.255 Oc1cccc(c1)CNCc2ccoc2 207a_100015206860_100000188321 [0,1,0,0,1,0|2,0,0]=4 6722 B16R2.255 Oc1cccc(c1)CNCc2ccoc2 2230a_100015206860_100011660834 [0,1,0,0,1,0|2,0,0]=4 6723 B16R2.255 Oc1cccc(c1)CNCc2ccoc2 270004a_100000743036_100011215517 [0,1,0,0,1,0|2,0,0]=4 6724 B16R2.255 Oc1cccc(c1)CNCc2ccoc2 270004a_100015206860_100000188321 [0,1,0,0,1,0|2,0,0]=4 6725 B16R2.255 Oc1cccc(c1)CNCc2ccoc2 34a_100015206860_100011660834 [0,1,0,0,1,0|2,0,0]=4 6726 B16R2.255 Oc1cccc(c1)CNCc2ccsc2 207a_100000186416_100000188321 [0,1,0,0,1,0|2,0,0]=4 6727 B16R2.255 Oc1cccc(c1)CNCc2ccsc2 207a_100000743036_100000188534 [0,1,0,0,1,0|2,0,0]=4 6728 B16R2.255 Oc1cccc(c1)CNCc2ccsc2 2230a_100000186416_100011660834 [0,1,0,0,1,0|2,0,0]=4 6729 B16R2.255 Oc1cccc(c1)CNCc2ccsc2 2230a_100000743036_100011261437 [0,1,0,0,1,0|2,0,0]=4 6730 B16R2.255 Oc1cccc(c1)CNCc2ccsc2 270004a_100000186416_100000188321 [0,1,0,0,1,0|2,0,0]=4 6731 B16R2.255 Oc1cccc(c1)CNCc2ccsc2 270004a_100000743036_100000188534 [0,1,0,0,1,0|2,0,0]=4 6732 B16R2.255 Oc1cccc(c1)CNCc2ccsc2 34a_100000186416_100011660834 [0,1,0,0,1,0|2,0,0]=4 6733 B16R2.255 Oc1cccc(c1)CNCc2ccsc2 34a_100000743036_100011261437 [0,1,0,0,1,0|2,0,0]=4 6734 B16R2.255 Oc1cccc(c1)COCc2ccco2 34a_100000210059_100011660834 [0,1,0,0,1,0|1,0,0]=3 6735 B16R2.255 Oc1cccc(c1)COCc2cccs2 34a_100000211240_100011660834 [0,1,0,0,1,0|1,0,0]=3 6736 B16R2.255 Oc1cccc(c1)COCc2ccno2 34a_100000740478_100011660834 [0,1,0,0,1,0|2,0,0]=4 6737 B16R2.255 Oc1cccc(c1)COCc2ccoc2 34a_100011215357_100011660834 [0,1,0,0,1,0|1,0,0]=3 6738 B16R2.255 Oc1cccc(c1)COCc2ccsc2 34a_100011215551_100011660834 [0,1,0,0,1,0|1,0,0]=3 6739 B16R2.255 Oc1cccc(c1)COCc2ncco2 34a_100000062594_100011660834 [0,1,0,0,1,0|2,0,0]=4 6740 B16R2.255 Oc1cccc(c1)COCn2cccn2 34a_100000731028_100011660834 [0,1,0,0,1,0|2,0,0]=4 6741 B16R2.255 Oc1cccc(c1)CSCc2ccsc2 62a_100011261437_100011660834 [0,1,0,0,1,0|1,1,0]=4 6742 B16R2.255 Oc1cccc(c1)CSCc2ccsc2 62a_100011660834_100011233845 [0,1,0,0,1,0|1,1,0]=4 6743 B16R2.255 [O-][n+]1cccc(c1)COCc2ccsc2 34a_100000037817_100011261437 [0,1,0,0,1,0|2,0,0]=4 6744 B16R2.255 [O-][n+]1cccc(c1)COCc2ccsc2 7a_100000037817_100011261437 [0,1,0,0,1,0|2,0,0]=4 6745 B16R2.524 CN(Cc1ccccc1)Cc2ccco2 2230a_100000184096_200000210301 [0,1,0,0,1,0|2,0,0]=4 6746 B16R2.524 CN(Cc1ccccc1)Cc2ccco2 2230a_100000185268_100015291786 [0,1,0,0,1,0|2,0,0]=4 6747 B16R2.524 CN(Cc1ccccc1)Cc2ccco2 269982a_100000184096_200000210301 [0,1,0,0,1,0|2,0,0]=4 6748 B16R2.524 CN(Cc1ccccc1)Cc2ccco2 269982a_100000185268_100000211182 [0,1,0,0,1,0|2,0,0]=4 6749 B16R2.524 CN(Cc1ccccc1)Cc2ccco2 270004a_100000185268_100015611070 [0,1,0,0,1,0|2,0,0]=4 6750 B16R2.524 CN(Cc1ccccc1)Cc2ccco2 270004a_100000186898_100000186105 [0,1,0,0,1,0|2,0,0]=4 6751 B16R2.524 CN(Cc1ccccc1)Cc2cccs2 2230a_100000184426_100015291786 [0,1,0,0,1,0|2,0,0]=4 6752 B16R2.524 CN(Cc1ccccc1)Cc2cccs2 269982a_100000184426_100000211182 [0,1,0,0,1,0|2,0,0]=4 6753 B16R2.524 CN(Cc1ccccc1)Cc2cccs2 270004a_100000184426_100015611070 [0,1,0,0,1,0|2,0,0]=4 6754 B16R2.524 CN(Cc1ccccc1)Cc2cccs2 270004a_100000186898_100000209959 [0,1,0,0,1,0|2,0,0]=4 6755 B16R2.524 CN(Cc1ccccc1)Cc2ccoc2 270004a_100000186898_100011215517 [0,1,0,0,1,0|2,0,0]=4 6756 B16R2.524 CN(Cc1ccccc1)Cc2ccsc2 2230a_100000186898_100011261437 [0,1,0,0,1,0|2,0,0]=4 6757 B16R2.524 CN(Cc1ccccc1)Cc2ccsc2 2230a_100020654213_100015291786 [0,1,0,0,1,0|2,0,0]=4 6758 B16R2.524 CN(Cc1ccccc1)Cc2ccsc2 269982a_100000186898_100011233845 [0,1,0,0,1,0|2,0,0]=4 6759 B16R2.524 CN(Cc1ccccc1)Cc2ccsc2 269982a_100020654213_100000211182 [0,1,0,0,1,0|2,0,0]=4 6760 B16R2.524 CN(Cc1ccccc1)Cc2ccsc2 270004a_100000186898_100000188534 [0,1,0,0,1,0|2,0,0]=4 6761 B16R2.524 CN(Cc1ccccc1)Cc2ccsc2 270004a_100020654213_100015611070 [0,1,0,0,1,0|2,0,0]=4 6762 B16R2.524 O=C(Cc1ccccc1)Cc2ccc[nH]2 1458a_100000238377_100015291786 [0,1,0,0,1,0|2,0,0]=4 6763 B16R2.524 O=C(Cc1ccccc1)Cc2ccco2 1458a_100011217309_100015291786 [0,1,0,0,1,0|2,0,0]=4 6764 B16R2.524 O=C(Cc1ccccc1)Cc2cccs2 1458a_100000210189_100015291786 [0,1,0,0,1,0|2,0,0]=4 6765 B16R2.524 O=C(Cc1ccccc1)Cc2ccoc2 1458a_100000684892_100015291786 [0,1,0,0,1,0|2,0,0]=4 6766 B16R2.524 O=C(Cc1ccccc1)Cc2ccsc2 1458a_100000184062_100015291786 [0,1,0,0,1,0|2,0,0]=4 6767 B16R2.524 O=C(Cc1ccccc1)Cn2cccc2 1458a_100011196272_100015291786 [0,1,0,0,1,0|2,0,0]=4 6768 B16R2.524 [13CH3]N(Cc1ccccc1)Cc2ccco2 2230a_100000184096_200025704644 [0,1,0,0,1,0|2,0,0]=4 6769 B16R2.524 [13CH3]N(Cc1ccccc1)Cc2ccco2 269982a_100000184096_200025704644 [0,1,0,0,1,0|2,0,0]=4 6770 B16R2.2238 CC(NCc1ccccc1)c2cc[nH]c2 269862a_100015324214_100000753940 [0,1,0,0,1,0|2,0,0]=4 6771 B16R2.2238 CC(NCc1ccccc1)c2ccc[nH]2 269862a_100015324214_100000183661 [0,1,0,0,1,0|2,0,0]=4 6772 B16R2.2238 CC(NCc1ccccc1)c2cccs2 207a_100000703493_100015611070 [0,1,0,0,1,0|2,0,0]=4 6773 B16R2.2238 CC(NCc1ccccc1)c2cccs2 2230a_100000703493_100015291786 [0,1,0,0,1,0|2,0,0]=4 6774 B16R2.2238 CC(NCc1ccccc1)c2cccs2 269862a_100015324214_100000185736 [0,1,0,0,1,0|2,0,0]=4 6775 B16R2.2238 CC(NCc1ccccc1)c2cccs2 270004a_100000703493_100015611070 [0,1,0,0,1,0|2,0,0]=4 6776 B16R2.2238 CC(NCc1ccccc1)c2ccoc2 207a_100000690049_100015611070 [0,1,0,0,1,0|2,0,0]=4 6777 B16R2.2238 CC(NCc1ccccc1)c2ccoc2 2230a_100000690049_100015291786 [0,1,0,0,1,0|2,0,0]=4 6778 B16R2.2238 CC(NCc1ccccc1)c2ccoc2 270004a_100000690049_100015611070 [0,1,0,0,1,0|2,0,0]=4 6779 B16R2.2238 CC(NCc1ccccc1)c2ccsc2 207a_100000748604_100015611070 [0,1,0,0,1,0|2,0,0]=4 6780 B16R2.2238 CC(NCc1ccccc1)c2ccsc2 2230a_100000748604_100015291786 [0,1,0,0,1,0|2,0,0]=4 6781 B16R2.2238 CC(NCc1ccccc1)c2ccsc2 269862a_100015324214_100000747891 [0,1,0,0,1,0|2,0,0]=4 6782 B16R2.2238 CC(NCc1ccccc1)c2ccsc2 270004a_100000748604_100015611070 [0,1,0,0,1,0|2,0,0]=4 6783 B16R2.2238 CC(OCc1ccccc1)c2ccsc2 34a_100011350980_100015291786 [0,1,0,0,1,0|1,0,0]=3 6784 B16R2.2238 CC(OCc1ccccc1)c2ccsc2 7a_100011350980_100000211182 [0,1,0,0,1,0|1,0,0]=3 6785 B16R2.2238 CC(OCc1ccccc1)c2nccs2 7a_100000751044_100000211182 [0,1,0,0,1,0|2,0,0]=4 6786 B16R2.2238 CC(OCc1ccccn1)c2ccsc2 34a_100011350980_100000721315 [0,1,0,0,1,0|2,0,0]=4 6787 B16R2.2238 CC(OCc1ccccn1)c2ccsc2 7a_100011350980_100000721315 [0,1,0,0,1,0|2,0,0]=4 6788 B16R2.2238 CC(OCc1cccnc1)c2ccsc2 34a_100011350980_100000733263 [0,1,0,0,1,0|2,0,0]=4 6789 B16R2.2238 CC(OCc1cccnc1)c2ccsc2 7a_100011350980_100000741622 [0,1,0,0,1,0|2,0,0]=4 6790 B16R2.2238 CC(OCc1ccncc1)c2ccsc2 7a_100011350980_100015193705 [0,1,0,0,1,0|2,0,0]=4 6791 B16R2.2238 C[C@@H](NCc1ccccc1)c2ccco2 207a_100160469435_100015611070 [0,1,0,0,1,0|2,0,0]=4 6792 B16R2.2238 C[C@@H](NCc1ccccc1)c2ccco2 2230a_100160469435_100015291786 [0,1,0,0,1,0|2,0,0]=4 6793 B16R2.2238 C[C@@H](NCc1ccccc1)c2ccco2 270004a_100160469435_100015611070 [0,1,0,0,1,0|2,0,0]=4 6794 B16R2.2238 C[C@@H](OCc1ccccc1)c2cccs2 7a_100000750433_100000211182 [0,1,0,0,1,0|1,0,0]=3 6795 B16R2.2238 C[C@@H](OCc1ccccn1)c2cccs2 7a_100000750433_100000721315 [0,1,0,0,1,0|2,0,0]=4 6796 B16R2.2238 C[C@@H](OCc1cccnc1)c2cccs2 7a_100000750433_100000741622 [0,1,0,0,1,0|2,0,0]=4 6797 B16R2.2238 C[C@@H](OCc1ccncc1)c2cccs2 7a_100000750433_100015193705 [0,1,0,0,1,0|2,0,0]=4 6798 B16R2.2238 C[C@H](OCc1ccccc1)c2ccco2 34a_100000755270_100015291786 [0,1,0,0,1,0|1,0,0]=3 6799 B16R2.2238 C[C@H](OCc1ccccc1)c2ccco2 7a_100000755270_100000211182 [0,1,0,0,1,0|1,0,0]=3 6800 B16R2.2238 C[C@H](OCc1ccccn1)c2ccco2 34a_100000755270_100000721315 [0,1,0,0,1,0|2,0,0]=4 6801 B16R2.2238 C[C@H](OCc1ccccn1)c2ccco2 7a_100000755270_100000721315 [0,1,0,0,1,0|2,0,0]=4 6802 B16R2.2238 C[C@H](OCc1cccnc1)c2ccco2 34a_100000755270_100000733263 [0,1,0,0,1,0|2,0,0]=4 6803 B16R2.2238 C[C@H](OCc1cccnc1)c2ccco2 7a_100000755270_100000741622 [0,1,0,0,1,0|2,0,0]=4 6804 B16R2.2238 C[C@H](OCc1ccncc1)c2ccco2 7a_100000755270_100015193705 [0,1,0,0,1,0|2,0,0]=4 6805 B16R2.2832 Brc1c[nH]c(c1)CNCc2ccccc2 270004a_100015324214_100000720742 [0,1,0,0,1,0|2,0,0]=4 6806 B16R2.2832 Brc1cc(cs1)CNCc2ccccc2 207a_100015324214_100000737087 [0,1,0,0,1,0|2,0,0]=4 6807 B16R2.2832 Brc1cc(cs1)CNCc2ccccc2 270004a_100015324214_100000737087 [0,1,0,0,1,0|2,0,0]=4 6808 B16R2.2832 Brc1cc(on1)COCc2ccccc2 34a_100009816691_100015291786 [0,1,0,0,1,0|2,0,0]=4 6809 B16R2.2832 Brc1cc(on1)COCc2ccccc2 7a_100000210790_100000709089 [0,1,0,0,1,0|2,0,0]=4 6810 B16R2.2832 Brc1ccc(o1)CNCc2ccccc2 207a_100000708654_100015611070 [0,1,0,0,1,0|2,0,0]=4 6811 B16R2.2832 Brc1ccc(o1)CNCc2ccccc2 207a_100015324214_100000185145 [0,1,0,0,1,0|2,0,0]=4 6812 B16R2.2832 Brc1ccc(o1)CNCc2ccccc2 270004a_100000708654_100015611070 [0,1,0,0,1,0|2,0,0]=4 6813 B16R2.2832 Brc1ccc(o1)CNCc2ccccc2 270004a_100015324214_100000185145 [0,1,0,0,1,0|2,0,0]=4 6814 B16R2.2832 Brc1ccc(o1)CNCc2ccccc2 34a_100000708654_100015291786 [0,1,0,0,1,0|2,0,0]=4 6815 B16R2.2832 Brc1ccc(o1)COCc2ccccc2 34a_100000246276_100015291786 [0,1,0,0,1,0|1,0,0]=3 6816 B16R2.2832 Brc1ccc(o1)COCc2ccccc2 7a_100000246276_100000211182 [0,1,0,0,1,0|1,0,0]=3 6817 B16R2.2832 Brc1ccc(o1)COCc2ccccn2 34a_100000246276_100000721315 [0,1,0,0,1,0|2,0,0]=4 6818 B16R2.2832 Brc1ccc(o1)COCc2ccccn2 7a_100000246276_100000721315 [0,1,0,0,1,0|2,0,0]=4 6819 B16R2.2832 Brc1ccc(o1)COCc2cccnc2 34a_100000246276_100000733263 [0,1,0,0,1,0|2,0,0]=4 6820 B16R2.2832 Brc1ccc(o1)COCc2cccnc2 7a_100000246276_100000741622 [0,1,0,0,1,0|2,0,0]=4 6821 B16R2.2832 Brc1ccc(o1)COCc2ccncc2 7a_100000246276_100015193705 [0,1,0,0,1,0|2,0,0]=4 6822 B16R2.2832 Brc1ccc(s1)CNCc2ccccc2 207a_100000737305_100015611070 [0,1,0,0,1,0|2,0,0]=4 6823 B16R2.2832 Brc1ccc(s1)CNCc2ccccc2 207a_100015324214_100000179771 [0,1,0,0,1,0|2,0,0]=4 6824 B16R2.2832 Brc1ccc(s1)CNCc2ccccc2 2230a_100015324214_100000708592 [0,1,0,0,1,0|2,0,0]=4 6825 B16R2.2832 Brc1ccc(s1)CNCc2ccccc2 270004a_100000737305_100015611070 [0,1,0,0,1,0|2,0,0]=4 6826 B16R2.2832 Brc1ccc(s1)CNCc2ccccc2 270004a_100015324214_100000179771 [0,1,0,0,1,0|2,0,0]=4 6827 B16R2.2832 Brc1ccc(s1)CNCc2ccccc2 34a_100015324214_100000708592 [0,1,0,0,1,0|2,0,0]=4 6828 B16R2.2832 Brc1ccc(s1)COCc2ccccc2 34a_100000210790_100000708592 [0,1,0,0,1,0|1,0,0]=3 6829 B16R2.2832 Brc1ccc(s1)COCc2ccccc2 7a_100000210790_100000708592 [0,1,0,0,1,0|1,0,0]=3 6830 B16R2.2832 Brc1ccc(s1)CSCc2ccccc2 62a_100000211182_100000708592 [0,1,0,0,1,0|1,1,0]=4 6831 B16R2.2832 Brc1ccc(s1)CSCc2ccccc2 62a_100000708592_100015291786 [0,1,0,0,1,0|1,1,0]=4 6832 B16R2.2832 Brc1coc(c1)CNCc2ccccc2 270004a_100015324214_100000747035 [0,1,0,0,1,0|2,0,0]=4 6833 B16R2.2832 Brc1csc(c1)CNCc2ccccc2 207a_100000741024_100015611070 [0,1,0,0,1,0|2,0,0]=4 6834 B16R2.2832 Brc1csc(c1)CNCc2ccccc2 207a_100015324214_100000211722 [0,1,0,0,1,0|2,0,0]=4 6835 B16R2.2832 Brc1csc(c1)CNCc2ccccc2 2230a_100000741024_100015291786 [0,1,0,0,1,0|2,0,0]=4 6836 B16R2.2832 Brc1csc(c1)CNCc2ccccc2 2230a_100015324214_100000746031 [0,1,0,0,1,0|2,0,0]=4 6837 B16R2.2832 Brc1csc(c1)CNCc2ccccc2 270004a_100000741024_100015611070 [0,1,0,0,1,0|2,0,0]=4 6838 B16R2.2832 Brc1csc(c1)CNCc2ccccc2 270004a_100015324214_100000211722 [0,1,0,0,1,0|2,0,0]=4 6839 B16R2.2832 Brc1csc(c1)CNCc2ccccc2 34a_100000741024_100015291786 [0,1,0,0,1,0|2,0,0]=4 6840 B16R2.2832 Brc1csc(c1)CNCc2ccccc2 34a_100015324214_100000746031 [0,1,0,0,1,0|2,0,0]=4 6841 B16R2.2832 Brc1csc(c1)COCc2ccccc2 34a_100000210790_100000746031 [0,1,0,0,1,0|1,0,0]=3 6842 B16R2.2832 Brc1csc(c1)COCc2ccccc2 34a_100000238369_100015291786 [0,1,0,0,1,0|1,0,0]=3 6843 B16R2.2832 Brc1csc(c1)COCc2ccccc2 7a_100000210790_100000746031 [0,1,0,0,1,0|1,0,0]=3 6844 B16R2.2832 Brc1csc(c1)COCc2ccccc2 7a_100000238369_100000211182 [0,1,0,0,1,0|1,0,0]=3 6845 B16R2.2832 Brc1csc(c1)COCc2ccccn2 34a_100000238369_100000721315 [0,1,0,0,1,0|2,0,0]=4 6846 B16R2.2832 Brc1csc(c1)COCc2ccccn2 7a_100000238369_100000721315 [0,1,0,0,1,0|2,0,0]=4 6847 B16R2.2832 Brc1csc(c1)COCc2cccnc2 34a_100000238369_100000733263 [0,1,0,0,1,0|2,0,0]=4 6848 B16R2.2832 Brc1csc(c1)COCc2cccnc2 7a_100000238369_100000741622 [0,1,0,0,1,0|2,0,0]=4 6849 B16R2.2832 Brc1csc(c1)COCc2ccncc2 7a_100000238369_100015193705 [0,1,0,0,1,0|2,0,0]=4 6850 B16R2.2832 Brc1csc(c1)CSCc2ccccc2 62a_100000211182_100000746031 [0,1,0,0,1,0|1,1,0]=4 6851 B16R2.2832 Brc1csc(c1)CSCc2ccccc2 62a_100000746031_100015291786 [0,1,0,0,1,0|1,1,0]=4 6852 B16R2.2832 Brc1csc(n1)COCc2ccccc2 7a_100012000107_100000211182 [0,1,0,0,1,0|2,0,0]=4 6853 B16R2.2832 Brc1ncc(s1)COCc2ccccc2 34a_100000210790_100000717027 [0,1,0,0,1,0|2,0,0]=4 6854 B16R2.2832 Brc1ncc(s1)COCc2ccccc2 7a_100000210790_100000717027 [0,1,0,0,1,0|2,0,0]=4 6855 B16R2.2832 Brc1ncc(s1)COCc2ccccc2 7a_100009816753_100000211182 [0,1,0,0,1,0|2,0,0]=4 6856 B16R2.2832 Cc1cc(cs1)CNCc2ccccc2 207a_100015324214_100011998532 [0,1,0,0,1,0|2,0,0]=4 6857 B16R2.2832 Cc1cc(cs1)CNCc2ccccc2 270004a_100015324214_100011998532 [0,1,0,0,1,0|2,0,0]=4 6858 B16R2.2832 Cc1cc(no1)COCc2ccccc2 34a_100000210790_100000199038 [0,1,0,0,1,0|2,0,0]=4 6859 B16R2.2832 Cc1cc(no1)COCc2ccccc2 34a_100011216401_100015291786 [0,1,0,0,1,0|2,0,0]=4 6860 B16R2.2832 Cc1cc(no1)COCc2ccccc2 7a_100000210790_100000199038 [0,1,0,0,1,0|2,0,0]=4 6861 B16R2.2832 Cc1cc(on1)COCc2ccccc2 34a_100000210790_100000707947 [0,1,0,0,1,0|2,0,0]=4 6862 B16R2.2832 Cc1cc(on1)COCc2ccccc2 34a_100000684692_100015291786 [0,1,0,0,1,0|2,0,0]=4 6863 B16R2.2832 Cc1cc(on1)COCc2ccccc2 7a_100000210790_100000707947 [0,1,0,0,1,0|2,0,0]=4 6864 B16R2.2832 Cc1ccc(o1)CNCc2ccccc2 207a_100011194323_100015611070 [0,1,0,0,1,0|2,0,0]=4 6865 B16R2.2832 Cc1ccc(o1)CNCc2ccccc2 207a_100015324214_100000183696 [0,1,0,0,1,0|2,0,0]=4 6866 B16R2.2832 Cc1ccc(o1)CNCc2ccccc2 270004a_100011194323_100015611070 [0,1,0,0,1,0|2,0,0]=4 6867 B16R2.2832 Cc1ccc(o1)CNCc2ccccc2 270004a_100015324214_100000183696 [0,1,0,0,1,0|2,0,0]=4 6868 B16R2.2832 Cc1ccc(o1)CNCc2ccccc2 34a_100011194323_100015291786 [0,1,0,0,1,0|2,0,0]=4 6869 B16R2.2832 Cc1ccc(o1)COCc2ccccc2 34a_100011232665_100015291786 [0,1,0,0,1,0|1,0,0]=3 6870 B16R2.2832 Cc1ccc(o1)COCc2ccccc2 7a_100011232665_100000211182 [0,1,0,0,1,0|1,0,0]=3 6871 B16R2.2832 Cc1ccc(o1)COCc2ccccn2 34a_100011232665_100000721315 [0,1,0,0,1,0|2,0,0]=4 6872 B16R2.2832 Cc1ccc(o1)COCc2ccccn2 7a_100011232665_100000721315 [0,1,0,0,1,0|2,0,0]=4 6873 B16R2.2832 Cc1ccc(o1)COCc2cccnc2 34a_100011232665_100000733263 [0,1,0,0,1,0|2,0,0]=4 6874 B16R2.2832 Cc1ccc(o1)COCc2cccnc2 7a_100011232665_100000741622 [0,1,0,0,1,0|2,0,0]=4 6875 B16R2.2832 Cc1ccc(o1)COCc2ccncc2 7a_100011232665_100015193705 [0,1,0,0,1,0|2,0,0]=4 6876 B16R2.2832 Cc1ccc(s1)CNCc2ccccc2 207a_100000238518_100015611070 [0,1,0,0,1,0|2,0,0]=4 6877 B16R2.2832 Cc1ccc(s1)CNCc2ccccc2 207a_100015324214_100000211121 [0,1,0,0,1,0|2,0,0]=4 6878 B16R2.2832 Cc1ccc(s1)CNCc2ccccc2 2230a_100000238518_100015291786 [0,1,0,0,1,0|2,0,0]=4 6879 B16R2.2832 Cc1ccc(s1)CNCc2ccccc2 270004a_100000238518_100015611070 [0,1,0,0,1,0|2,0,0]=4 6880 B16R2.2832 Cc1ccc(s1)CNCc2ccccc2 270004a_100015324214_100000211121 [0,1,0,0,1,0|2,0,0]=4 6881 B16R2.2832 Cc1ccc(s1)COCc2ccccc2 34a_100000238367_100015291786 [0,1,0,0,1,0|1,0,0]=3 6882 B16R2.2832 Cc1ccc(s1)COCc2ccccn2 34a_100000238367_100000721315 [0,1,0,0,1,0|2,0,0]=4 6883 B16R2.2832 Cc1ccc(s1)COCc2cccnc2 34a_100000238367_100000733263 [0,1,0,0,1,0|2,0,0]=4 6884 B16R2.2832 Cc1csc(c1)CNCc2ccccc2 207a_100015204214_100015611070 [0,1,0,0,1,0|2,0,0]=4 6885 B16R2.2832 Cc1csc(c1)CNCc2ccccc2 207a_100015324214_100102525248 [0,1,0,0,1,0|2,0,0]=4 6886 B16R2.2832 Cc1csc(c1)CNCc2ccccc2 2230a_100015204214_100015291786 [0,1,0,0,1,0|2,0,0]=4 6887 B16R2.2832 Cc1csc(c1)CNCc2ccccc2 270004a_100015204214_100015611070 [0,1,0,0,1,0|2,0,0]=4 6888 B16R2.2832 Cc1csc(c1)CNCc2ccccc2 270004a_100015324214_100102525248 [0,1,0,0,1,0|2,0,0]=4 6889 B16R2.2832 Cc1csc(c1)CNCc2ccccc2 34a_100015204214_100015291786 [0,1,0,0,1,0|2,0,0]=4 6890 B16R2.2832 Cc1csc(c1)COCc2ccccc2 34a_200000068372_100015291786 [0,1,0,0,1,0|1,0,0]=3 6891 B16R2.2832 Cc1csc(c1)COCc2ccccc2 7a_200000068372_100000211182 [0,1,0,0,1,0|1,0,0]=3 6892 B16R2.2832 Cc1csc(c1)COCc2ccccn2 34a_200000068372_100000721315 [0,1,0,0,1,0|2,0,0]=4 6893 B16R2.2832 Cc1csc(c1)COCc2ccccn2 7a_200000068372_100000721315 [0,1,0,0,1,0|2,0,0]=4 6894 B16R2.2832 Cc1csc(c1)COCc2cccnc2 34a_200000068372_100000733263 [0,1,0,0,1,0|2,0,0]=4 6895 B16R2.2832 Cc1csc(c1)COCc2cccnc2 7a_200000068372_100000741622 [0,1,0,0,1,0|2,0,0]=4 6896 B16R2.2832 Cc1csc(c1)COCc2ccncc2 7a_200000068372_100015193705 [0,1,0,0,1,0|2,0,0]=4 6897 B16R2.2832 Cc1nc(co1)COCc2ccccc2 34a_100012017233_100015291786 [0,1,0,0,1,0|2,0,0]=4 6898 B16R2.2832 Cc1nc(cs1)COCc2ccccc2 34a_100000210790_100015186478 [0,1,0,0,1,0|2,0,0]=4 6899 B16R2.2832 Cc1nc(cs1)COCc2ccccc2 34a_100000735831_100015291786 [0,1,0,0,1,0|2,0,0]=4 6900 B16R2.2832 Cc1nc(cs1)COCc2ccccc2 7a_100000210790_100015186478 [0,1,0,0,1,0|2,0,0]=4 6901 B16R2.2832 Cc1ncc(s1)COCc2ccccc2 34a_100000210790_100020635045 [0,1,0,0,1,0|2,0,0]=4 6902 B16R2.2832 Cc1ncc(s1)COCc2ccccc2 7a_100000210790_100020635045 [0,1,0,0,1,0|2,0,0]=4 6903 B16R2.2832 Cc1ncc(s1)COCc2ccccc2 7a_100000743366_100000211182 [0,1,0,0,1,0|2,0,0]=4 6904 B16R2.2832 Clc1cc(cs1)CNCc2ccccc2 207a_100015324214_100009844934 [0,1,0,0,1,0|2,0,0]=4 6905 B16R2.2832 Clc1cc(cs1)CNCc2ccccc2 270004a_100015324214_100009844934 [0,1,0,0,1,0|2,0,0]=4 6906 B16R2.2832 Clc1cc(cs1)COCc2ccccc2 34a_100009863405_100015291786 [0,1,0,0,1,0|1,0,0]=3 6907 B16R2.2832 Clc1cc(cs1)COCc2ccccc2 7a_100009863405_100000211182 [0,1,0,0,1,0|1,0,0]=3 6908 B16R2.2832 Clc1cc(cs1)COCc2ccccn2 34a_100009863405_100000721315 [0,1,0,0,1,0|2,0,0]=4 6909 B16R2.2832 Clc1cc(cs1)COCc2ccccn2 7a_100009863405_100000721315 [0,1,0,0,1,0|2,0,0]=4 6910 B16R2.2832 Clc1cc(cs1)COCc2cccnc2 34a_100009863405_100000733263 [0,1,0,0,1,0|2,0,0]=4 6911 B16R2.2832 Clc1cc(cs1)COCc2cccnc2 7a_100009863405_100000741622 [0,1,0,0,1,0|2,0,0]=4 6912 B16R2.2832 Clc1cc(cs1)COCc2ccncc2 7a_100009863405_100015193705 [0,1,0,0,1,0|2,0,0]=4 6913 B16R2.2832 Clc1ccc(o1)CNCc2ccccc2 207a_100015324214_100000188459 [0,1,0,0,1,0|2,0,0]=4 6914 B16R2.2832 Clc1ccc(o1)CNCc2ccccc2 270004a_100015324214_100000188459 [0,1,0,0,1,0|2,0,0]=4 6915 B16R2.2832 Clc1ccc(s1)CNCc2ccccc2 207a_100000737310_100015611070 [0,1,0,0,1,0|2,0,0]=4 6916 B16R2.2832 Clc1ccc(s1)CNCc2ccccc2 207a_100015324214_100000242774 [0,1,0,0,1,0|2,0,0]=4 6917 B16R2.2832 Clc1ccc(s1)CNCc2ccccc2 2230a_100000737310_100015291786 [0,1,0,0,1,0|2,0,0]=4 6918 B16R2.2832 Clc1ccc(s1)CNCc2ccccc2 2230a_100015324214_100000185097 [0,1,0,0,1,0|2,0,0]=4 6919 B16R2.2832 Clc1ccc(s1)CNCc2ccccc2 270004a_100000737310_100015611070 [0,1,0,0,1,0|2,0,0]=4 6920 B16R2.2832 Clc1ccc(s1)CNCc2ccccc2 270004a_100015324214_100000242774 [0,1,0,0,1,0|2,0,0]=4 6921 B16R2.2832 Clc1ccc(s1)CNCc2ccccc2 34a_100015324214_100000185097 [0,1,0,0,1,0|2,0,0]=4 6922 B16R2.2832 Clc1ccc(s1)COCc2ccccc2 34a_100000210790_100000185097 [0,1,0,0,1,0|1,0,0]=3 6923 B16R2.2832 Clc1ccc(s1)COCc2ccccc2 7a_100000210790_100000185097 [0,1,0,0,1,0|1,0,0]=3 6924 B16R2.2832 Clc1ccc(s1)CSCc2ccccc2 62a_100000185097_100015291786 [0,1,0,0,1,0|1,1,0]=4 6925 B16R2.2832 Clc1ccc(s1)CSCc2ccccc2 62a_100000211182_100000185097 [0,1,0,0,1,0|1,1,0]=4 6926 B16R2.2832 Clc1cnn(c1)COCc2ccccc2 34a_100000732729_100015291786 [0,1,0,0,1,0|2,0,0]=4 6927 B16R2.2832 Clc1csc(c1)CNCc2ccccc2 207a_100015324214_100000102487 [0,1,0,0,1,0|2,0,0]=4 6928 B16R2.2832 Clc1csc(c1)CNCc2ccccc2 270004a_100015324214_100000102487 [0,1,0,0,1,0|2,0,0]=4 6929 B16R2.2832 Clc1nc(cs1)COCc2ccccc2 34a_100000210790_100000024076 [0,1,0,0,1,0|2,0,0]=4 6930 B16R2.2832 Clc1nc(cs1)COCc2ccccc2 7a_100000210790_100000024076 [0,1,0,0,1,0|2,0,0]=4 6931 B16R2.2832 Clc1ncc(s1)COCc2ccccc2 34a_100000210790_100000058068 [0,1,0,0,1,0|2,0,0]=4 6932 B16R2.2832 Clc1ncc(s1)COCc2ccccc2 7a_100000210790_100000058068 [0,1,0,0,1,0|2,0,0]=4 6933 B16R2.2832 Clc1ncc(s1)COCc2ccccc2 7a_100000697714_100000211182 [0,1,0,0,1,0|2,0,0]=4 6934 B16R2.2832 Cn1cc(cn1)COCc2ccccc2 34a_100000210790_100000744441 [0,1,0,0,1,0|2,0,0]=4 6935 B16R2.2832 Cn1cc(cn1)COCc2ccccc2 34a_100000239500_100015291786 [0,1,0,0,1,0|2,0,0]=4 6936 B16R2.2832 Cn1cc(cn1)COCc2ccccc2 7a_100000210790_100000744441 [0,1,0,0,1,0|2,0,0]=4 6937 B16R2.2832 Cn1ccc(n1)COCc2ccccc2 34a_100000210790_100000726502 [0,1,0,0,1,0|2,0,0]=4 6938 B16R2.2832 Cn1ccc(n1)COCc2ccccc2 34a_100000744484_100015291786 [0,1,0,0,1,0|2,0,0]=4 6939 B16R2.2832 Cn1ccc(n1)COCc2ccccc2 7a_100000210790_100000726502 [0,1,0,0,1,0|2,0,0]=4 6940 B16R2.2832 Cn1cnc(c1)COCc2ccccc2 34a_100000210790_100000717665 [0,1,0,0,1,0|2,0,0]=4 6941 B16R2.2832 Cn1cnc(c1)COCc2ccccc2 34a_100000710007_100015291786 [0,1,0,0,1,0|2,0,0]=4 6942 B16R2.2832 Cn1cnc(c1)COCc2ccccc2 7a_100000210790_100000717665 [0,1,0,0,1,0|2,0,0]=4 6943 B16R2.2832 Ic1ccc(o1)CNCc2ccccc2 207a_100015324214_100000186757 [0,1,0,0,1,0|2,0,0]=4 6944 B16R2.2832 Ic1csc(c1)CNCc2ccccc2 207a_100015324214_100010179861 [0,1,0,0,1,0|2,0,0]=4 6945 B16R2.2832 Nc1ncc(s1)COCc2ccccc2 7a_100011997359_100000211182 [0,1,0,0,1,0|2,0,0]=4 6946 B16R2.2832 O=C1C=C(CO1)COCc2ccccc2 34a_100000210790_100000716558 [0,1,0,0,1,0|1,0,1]=4 6947 B16R2.2959 Brc1ccccc1CNCc2ccco2 207a_100000185738_100000211189 [0,1,0,0,1,0|2,0,0]=4 6948 B16R2.2959 Brc1ccccc1CNCc2ccco2 207a_100000689332_100000186105 [0,1,0,0,1,0|2,0,0]=4 6949 B16R2.2959 Brc1ccccc1CNCc2ccco2 2230a_100000185738_100000184730 [0,1,0,0,1,0|2,0,0]=4 6950 B16R2.2959 Brc1ccccc1CNCc2ccco2 270004a_100000185738_100000211189 [0,1,0,0,1,0|2,0,0]=4 6951 B16R2.2959 Brc1ccccc1CNCc2ccco2 270004a_100000689332_100000186105 [0,1,0,0,1,0|2,0,0]=4 6952 B16R2.2959 Brc1ccccc1CNCc2ccco2 34a_100000185738_100000184730 [0,1,0,0,1,0|2,0,0]=4 6953 B16R2.2959 Brc1ccccc1CNCc2cccs2 207a_100000211653_100000211189 [0,1,0,0,1,0|2,0,0]=4 6954 B16R2.2959 Brc1ccccc1CNCc2cccs2 207a_100000689332_100000209959 [0,1,0,0,1,0|2,0,0]=4 6955 B16R2.2959 Brc1ccccc1CNCc2cccs2 2230a_100000211653_100000184730 [0,1,0,0,1,0|2,0,0]=4 6956 B16R2.2959 Brc1ccccc1CNCc2cccs2 270004a_100000211653_100000211189 [0,1,0,0,1,0|2,0,0]=4 6957 B16R2.2959 Brc1ccccc1CNCc2cccs2 270004a_100000689332_100000209959 [0,1,0,0,1,0|2,0,0]=4 6958 B16R2.2959 Brc1ccccc1CNCc2ccoc2 207a_100000689332_100011215517 [0,1,0,0,1,0|2,0,0]=4 6959 B16R2.2959 Brc1ccccc1CNCc2ccoc2 207a_100015206860_100000211189 [0,1,0,0,1,0|2,0,0]=4 6960 B16R2.2959 Brc1ccccc1CNCc2ccoc2 2230a_100015206860_100000184730 [0,1,0,0,1,0|2,0,0]=4 6961 B16R2.2959 Brc1ccccc1CNCc2ccoc2 270004a_100000689332_100011215517 [0,1,0,0,1,0|2,0,0]=4 6962 B16R2.2959 Brc1ccccc1CNCc2ccoc2 270004a_100015206860_100000211189 [0,1,0,0,1,0|2,0,0]=4 6963 B16R2.2959 Brc1ccccc1CNCc2ccoc2 34a_100015206860_100000184730 [0,1,0,0,1,0|2,0,0]=4 6964 B16R2.2959 Brc1ccccc1CNCc2ccsc2 207a_100000186416_100000211189 [0,1,0,0,1,0|2,0,0]=4 6965 B16R2.2959 Brc1ccccc1CNCc2ccsc2 207a_100000689332_100000188534 [0,1,0,0,1,0|2,0,0]=4 6966 B16R2.2959 Brc1ccccc1CNCc2ccsc2 2230a_100000186416_100000184730 [0,1,0,0,1,0|2,0,0]=4 6967 B16R2.2959 Brc1ccccc1CNCc2ccsc2 2230a_100000689332_100011261437 [0,1,0,0,1,0|2,0,0]=4 6968 B16R2.2959 Brc1ccccc1CNCc2ccsc2 270004a_100000186416_100000211189 [0,1,0,0,1,0|2,0,0]=4 6969 B16R2.2959 Brc1ccccc1CNCc2ccsc2 270004a_100000689332_100000188534 [0,1,0,0,1,0|2,0,0]=4 6970 B16R2.2959 Brc1ccccc1CNCc2ccsc2 34a_100000186416_100000184730 [0,1,0,0,1,0|2,0,0]=4 6971 B16R2.2959 Brc1ccccc1CNCc2ccsc2 34a_100000689332_100011261437 [0,1,0,0,1,0|2,0,0]=4 6972 B16R2.2959 Brc1ccccc1COCc2c[nH]cn2 34a_100000756307_100000707719 [0,1,0,0,1,0|2,0,0]=4 6973 B16R2.2959 Brc1ccccc1COCc2ccco2 34a_100000210059_100000184730 [0,1,0,0,1,0|1,0,0]=3 6974 B16R2.2959 Brc1ccccc1COCc2cccs2 34a_100000211240_100000184730 [0,1,0,0,1,0|1,0,0]=3 6975 B16R2.2959 Brc1ccccc1COCc2ccn[nH]2 34a_100000756307_100000728653 [0,1,0,0,1,0|2,0,0]=4 6976 B16R2.2959 Brc1ccccc1COCc2ccn[nH]2 7a_100000756307_100000728653 [0,1,0,0,1,0|2,0,0]=4 6977 B16R2.2959 Brc1ccccc1COCc2ccno2 34a_100000740478_100000184730 [0,1,0,0,1,0|2,0,0]=4 6978 B16R2.2959 Brc1ccccc1COCc2ccoc2 34a_100011215357_100000184730 [0,1,0,0,1,0|1,0,0]=3 6979 B16R2.2959 Brc1ccccc1COCc2ccon2 34a_100000756307_100000234950 [0,1,0,0,1,0|2,0,0]=4 6980 B16R2.2959 Brc1ccccc1COCc2ccon2 7a_100000756307_100000234950 [0,1,0,0,1,0|2,0,0]=4 6981 B16R2.2959 Brc1ccccc1COCc2ccsc2 34a_100000756307_100011261437 [0,1,0,0,1,0|1,0,0]=3 6982 B16R2.2959 Brc1ccccc1COCc2ccsc2 34a_100011215551_100000184730 [0,1,0,0,1,0|1,0,0]=3 6983 B16R2.2959 Brc1ccccc1COCc2ccsc2 7a_100000756307_100011261437 [0,1,0,0,1,0|1,0,0]=3 6984 B16R2.2959 Brc1ccccc1COCc2cncs2 34a_100000756307_100015185245 [0,1,0,0,1,0|2,0,0]=4 6985 B16R2.2959 Brc1ccccc1COCc2cncs2 7a_100000756307_100015185245 [0,1,0,0,1,0|2,0,0]=4 6986 B16R2.2959 Brc1ccccc1COCc2cscn2 34a_100000756307_100000205941 [0,1,0,0,1,0|2,0,0]=4 6987 B16R2.2959 Brc1ccccc1COCc2cscn2 7a_100000756307_100000205941 [0,1,0,0,1,0|2,0,0]=4 6988 B16R2.2959 Brc1ccccc1COCc2ncc[nH]2 34a_100000756307_100016991755 [0,1,0,0,1,0|2,0,0]=4 6989 B16R2.2959 Brc1ccccc1COCc2ncc[nH]2 7a_100000756307_100000753453 [0,1,0,0,1,0|2,0,0]=4 6990 B16R2.2959 Brc1ccccc1COCc2ncco2 34a_100000062594_100000184730 [0,1,0,0,1,0|2,0,0]=4 6991 B16R2.2959 Brc1ccccc1COCc2ncco2 34a_100000756307_103436540062 [0,1,0,0,1,0|2,0,0]=4 6992 B16R2.2959 Brc1ccccc1COCc2ncco2 7a_100000756307_103436540062 [0,1,0,0,1,0|2,0,0]=4 6993 B16R2.2959 Brc1ccccc1COCc2nccs2 34a_100000756307_100015184050 [0,1,0,0,1,0|2,0,0]=4 6994 B16R2.2959 Brc1ccccc1COCc2nccs2 7a_100000756307_100015184050 [0,1,0,0,1,0|2,0,0]=4 6995 B16R2.2959 Brc1ccccc1COCn2cccn2 34a_100000731028_100000184730 [0,1,0,0,1,0|2,0,0]=4 6996 B16R2.2959 Brc1ccccc1CSCc2ccsc2 62a_100000184730_100011233845 [0,1,0,0,1,0|1,1,0]=4 6997 B16R2.2959 Brc1ccccc1CSCc2ccsc2 62a_100011261437_100000184730 [0,1,0,0,1,0|1,1,0]=4 6998 B16R2.2959 Brc1cccnc1COCc2ccco2 34a_100000210059_100025702911 [0,1,0,0,1,0|2,0,0]=4 6999 B16R2.2959 Brc1cccnc1COCc2cccs2 34a_100000211240_100025702911 [0,1,0,0,1,0|2,0,0]=4 7000 B16R2.2959 Brc1cccnc1COCc2ccoc2 34a_100011215357_100025702911 [0,1,0,0,1,0|2,0,0]=4 7001 B16R2.2959 Brc1cccnc1COCc2ccsc2 34a_100011215551_100025702911 [0,1,0,0,1,0|2,0,0]=4 7002 B16R2.2959 Brc1cccnc1COCc2ccsc2 34a_100011996772_100011261437 [0,1,0,0,1,0|2,0,0]=4 7003 B16R2.2959 Brc1ncccc1COCc2ccco2 34a_100000210059_100010140945 [0,1,0,0,1,0|2,0,0]=4 7004 B16R2.2959 Brc1ncccc1COCc2cccs2 34a_100000211240_100010140945 [0,1,0,0,1,0|2,0,0]=4 7005 B16R2.2959 Brc1ncccc1COCc2ccoc2 34a_100011215357_100010140945 [0,1,0,0,1,0|2,0,0]=4 7006 B16R2.2959 Brc1ncccc1COCc2ccsc2 34a_100000719692_100011261437 [0,1,0,0,1,0|2,0,0]=4 7007 B16R2.2959 Brc1ncccc1COCc2ccsc2 34a_100011215551_100010140945 [0,1,0,0,1,0|2,0,0]=4 7008 B16R2.2959 Brc1ncccc1COCc2ccsc2 7a_100000719692_100011261437 [0,1,0,0,1,0|2,0,0]=4 7009 B16R2.2959 Cc1ccccc1CNCc2ccco2 207a_100000174972_100000186105 [0,1,0,0,1,0|2,0,0]=4 7010 B16R2.2959 Cc1ccccc1CNCc2ccco2 207a_100000185738_100000211143 [0,1,0,0,1,0|2,0,0]=4 7011 B16R2.2959 Cc1ccccc1CNCc2ccco2 2230a_100000185738_100000211839 [0,1,0,0,1,0|2,0,0]=4 7012 B16R2.2959 Cc1ccccc1CNCc2ccco2 270004a_100000174972_100000186105 [0,1,0,0,1,0|2,0,0]=4 7013 B16R2.2959 Cc1ccccc1CNCc2ccco2 270004a_100000185738_100000211143 [0,1,0,0,1,0|2,0,0]=4 7014 B16R2.2959 Cc1ccccc1CNCc2ccco2 34a_100000185738_100000211839 [0,1,0,0,1,0|2,0,0]=4 7015 B16R2.2959 Cc1ccccc1CNCc2cccs2 207a_100000174972_100000209959 [0,1,0,0,1,0|2,0,0]=4 7016 B16R2.2959 Cc1ccccc1CNCc2cccs2 207a_100000211653_100000211143 [0,1,0,0,1,0|2,0,0]=4 7017 B16R2.2959 Cc1ccccc1CNCc2cccs2 2230a_100000211653_100000211839 [0,1,0,0,1,0|2,0,0]=4 7018 B16R2.2959 Cc1ccccc1CNCc2cccs2 270004a_100000174972_100000209959 [0,1,0,0,1,0|2,0,0]=4 7019 B16R2.2959 Cc1ccccc1CNCc2cccs2 270004a_100000211653_100000211143 [0,1,0,0,1,0|2,0,0]=4 7020 B16R2.2959 Cc1ccccc1CNCc2ccoc2 207a_100000174972_100011215517 [0,1,0,0,1,0|2,0,0]=4 7021 B16R2.2959 Cc1ccccc1CNCc2ccoc2 207a_100015206860_100000211143 [0,1,0,0,1,0|2,0,0]=4 7022 B16R2.2959 Cc1ccccc1CNCc2ccoc2 2230a_100015206860_100000211839 [0,1,0,0,1,0|2,0,0]=4 7023 B16R2.2959 Cc1ccccc1CNCc2ccoc2 270004a_100000174972_100011215517 [0,1,0,0,1,0|2,0,0]=4 7024 B16R2.2959 Cc1ccccc1CNCc2ccoc2 270004a_100015206860_100000211143 [0,1,0,0,1,0|2,0,0]=4 7025 B16R2.2959 Cc1ccccc1CNCc2ccoc2 34a_100015206860_100000211839 [0,1,0,0,1,0|2,0,0]=4 7026 B16R2.2959 Cc1ccccc1CNCc2ccsc2 207a_100000174972_100000188534 [0,1,0,0,1,0|2,0,0]=4 7027 B16R2.2959 Cc1ccccc1CNCc2ccsc2 207a_100000186416_100000211143 [0,1,0,0,1,0|2,0,0]=4 7028 B16R2.2959 Cc1ccccc1CNCc2ccsc2 2230a_100000186416_100000211839 [0,1,0,0,1,0|2,0,0]=4 7029 B16R2.2959 Cc1ccccc1CNCc2ccsc2 270004a_100000174972_100000188534 [0,1,0,0,1,0|2,0,0]=4 7030 B16R2.2959 Cc1ccccc1CNCc2ccsc2 270004a_100000186416_100000211143 [0,1,0,0,1,0|2,0,0]=4 7031 B16R2.2959 Cc1ccccc1CNCc2ccsc2 34a_100000174972_100011261437 [0,1,0,0,1,0|2,0,0]=4 7032 B16R2.2959 Cc1ccccc1CNCc2ccsc2 34a_100000186416_100000211839 [0,1,0,0,1,0|2,0,0]=4 7033 B16R2.2959 Cc1ccccc1COCc2c[nH]cn2 34a_100000698903_100000707719 [0,1,0,0,1,0|2,0,0]=4 7034 B16R2.2959 Cc1ccccc1COCc2ccco2 34a_100000210059_100000211839 [0,1,0,0,1,0|1,0,0]=3 7035 B16R2.2959 Cc1ccccc1COCc2cccs2 34a_100000211240_100000211839 [0,1,0,0,1,0|1,0,0]=3 7036 B16R2.2959 Cc1ccccc1COCc2ccn[nH]2 34a_100000698903_100000728653 [0,1,0,0,1,0|2,0,0]=4 7037 B16R2.2959 Cc1ccccc1COCc2ccn[nH]2 7a_100000698903_100000728653 [0,1,0,0,1,0|2,0,0]=4 7038 B16R2.2959 Cc1ccccc1COCc2ccno2 34a_100000740478_100000211839 [0,1,0,0,1,0|2,0,0]=4 7039 B16R2.2959 Cc1ccccc1COCc2ccoc2 34a_100011215357_100000211839 [0,1,0,0,1,0|1,0,0]=3 7040 B16R2.2959 Cc1ccccc1COCc2ccon2 34a_100000698903_100000234950 [0,1,0,0,1,0|2,0,0]=4 7041 B16R2.2959 Cc1ccccc1COCc2ccon2 7a_100000698903_100000234950 [0,1,0,0,1,0|2,0,0]=4 7042 B16R2.2959 Cc1ccccc1COCc2ccsc2 34a_100000698903_100011261437 [0,1,0,0,1,0|1,0,0]=3 7043 B16R2.2959 Cc1ccccc1COCc2ccsc2 34a_100011215551_100000211839 [0,1,0,0,1,0|1,0,0]=3 7044 B16R2.2959 Cc1ccccc1COCc2ccsc2 7a_100000698903_100011261437 [0,1,0,0,1,0|1,0,0]=3 7045 B16R2.2959 Cc1ccccc1COCc2cncs2 34a_100000698903_100015185245 [0,1,0,0,1,0|2,0,0]=4 7046 B16R2.2959 Cc1ccccc1COCc2cncs2 7a_100000698903_100015185245 [0,1,0,0,1,0|2,0,0]=4 7047 B16R2.2959 Cc1ccccc1COCc2cscn2 34a_100000698903_100000205941 [0,1,0,0,1,0|2,0,0]=4 7048 B16R2.2959 Cc1ccccc1COCc2cscn2 7a_100000698903_100000205941 [0,1,0,0,1,0|2,0,0]=4 7049 B16R2.2959 Cc1ccccc1COCc2ncc[nH]2 34a_100000698903_100016991755 [0,1,0,0,1,0|2,0,0]=4 7050 B16R2.2959 Cc1ccccc1COCc2ncc[nH]2 7a_100000698903_100000753453 [0,1,0,0,1,0|2,0,0]=4 7051 B16R2.2959 Cc1ccccc1COCc2ncco2 34a_100000062594_100000211839 [0,1,0,0,1,0|2,0,0]=4 7052 B16R2.2959 Cc1ccccc1COCc2ncco2 34a_100000698903_103436540062 [0,1,0,0,1,0|2,0,0]=4 7053 B16R2.2959 Cc1ccccc1COCc2ncco2 7a_100000698903_103436540062 [0,1,0,0,1,0|2,0,0]=4 7054 B16R2.2959 Cc1ccccc1COCc2nccs2 34a_100000698903_100015184050 [0,1,0,0,1,0|2,0,0]=4 7055 B16R2.2959 Cc1ccccc1COCc2nccs2 7a_100000698903_100015184050 [0,1,0,0,1,0|2,0,0]=4 7056 B16R2.2959 Cc1ccccc1COCn2cccn2 34a_100000731028_100000211839 [0,1,0,0,1,0|2,0,0]=4 7057 B16R2.2959 Cc1ccccc1CSCc2ccsc2 62a_100000211839_100011233845 [0,1,0,0,1,0|1,1,0]=4 7058 B16R2.2959 Cc1ccccc1CSCc2ccsc2 62a_100011261437_100000211839 [0,1,0,0,1,0|1,1,0]=4 7059 B16R2.2959 Cc1cccnc1COCc2ccco2 34a_100000210059_100000696600 [0,1,0,0,1,0|2,0,0]=4 7060 B16R2.2959 Cc1cccnc1COCc2cccs2 34a_100000211240_100000696600 [0,1,0,0,1,0|2,0,0]=4 7061 B16R2.2959 Cc1cccnc1COCc2ccoc2 34a_100011215357_100000696600 [0,1,0,0,1,0|2,0,0]=4 7062 B16R2.2959 Cc1cccnc1COCc2ccsc2 34a_100000698912_100011261437 [0,1,0,0,1,0|2,0,0]=4 7063 B16R2.2959 Cc1cccnc1COCc2ccsc2 34a_100011215551_100000696600 [0,1,0,0,1,0|2,0,0]=4 7064 B16R2.2959 Cc1ccncc1COCc2ccco2 34a_100000210059_100000690890 [0,1,0,0,1,0|2,0,0]=4 7065 B16R2.2959 Cc1ccncc1COCc2cccs2 34a_100000211240_100000690890 [0,1,0,0,1,0|2,0,0]=4 7066 B16R2.2959 Cc1ccncc1COCc2ccoc2 34a_100011215357_100000690890 [0,1,0,0,1,0|2,0,0]=4 7067 B16R2.2959 Cc1ccncc1COCc2ccsc2 34a_100011215551_100000690890 [0,1,0,0,1,0|2,0,0]=4 7068 B16R2.2959 Cc1ccncc1COCc2ccsc2 34a_100011996381_100011261437 [0,1,0,0,1,0|2,0,0]=4 7069 B16R2.2959 Cc1cnccc1COCc2ccco2 34a_100000210059_100020672809 [0,1,0,0,1,0|2,0,0]=4 7070 B16R2.2959 Cc1cnccc1COCc2cccs2 34a_100000211240_100020672809 [0,1,0,0,1,0|2,0,0]=4 7071 B16R2.2959 Cc1cnccc1COCc2ccoc2 34a_100011215357_100020672809 [0,1,0,0,1,0|2,0,0]=4 7072 B16R2.2959 Cc1cnccc1COCc2ccsc2 34a_100011215551_100020672809 [0,1,0,0,1,0|2,0,0]=4 7073 B16R2.2959 Cc1cnccc1COCc2ccsc2 34a_100011997032_100011261437 [0,1,0,0,1,0|2,0,0]=4 7074 B16R2.2959 Cc1ncccc1COCc2ccco2 34a_100000210059_100000732876 [0,1,0,0,1,0|2,0,0]=4 7075 B16R2.2959 Cc1ncccc1COCc2cccs2 34a_100000211240_100000732876 [0,1,0,0,1,0|2,0,0]=4 7076 B16R2.2959 Cc1ncccc1COCc2ccoc2 34a_100011215357_100000732876 [0,1,0,0,1,0|2,0,0]=4 7077 B16R2.2959 Cc1ncccc1COCc2ccsc2 34a_100000729262_100011261437 [0,1,0,0,1,0|2,0,0]=4 7078 B16R2.2959 Cc1ncccc1COCc2ccsc2 34a_100011215551_100000732876 [0,1,0,0,1,0|2,0,0]=4 7079 B16R2.2959 Cc1ncccc1COCc2ccsc2 7a_100000729262_100011261437 [0,1,0,0,1,0|2,0,0]=4 7080 B16R2.2959 Clc1ccccc1CNCc2ccco2 207a_100000174879_100000186105 [0,1,0,0,1,0|2,0,0]=4 7081 B16R2.2959 Clc1ccccc1CNCc2ccco2 207a_100000185738_100000210073 [0,1,0,0,1,0|2,0,0]=4 7082 B16R2.2959 Clc1ccccc1CNCc2ccco2 2230a_100000185738_100000187162 [0,1,0,0,1,0|2,0,0]=4 7083 B16R2.2959 Clc1ccccc1CNCc2ccco2 270004a_100000174879_100000186105 [0,1,0,0,1,0|2,0,0]=4 7084 B16R2.2959 Clc1ccccc1CNCc2ccco2 270004a_100000185738_100000210073 [0,1,0,0,1,0|2,0,0]=4 7085 B16R2.2959 Clc1ccccc1CNCc2ccco2 34a_100000185738_100000187162 [0,1,0,0,1,0|2,0,0]=4 7086 B16R2.2959 Clc1ccccc1CNCc2cccs2 207a_100000174879_100000209959 [0,1,0,0,1,0|2,0,0]=4 7087 B16R2.2959 Clc1ccccc1CNCc2cccs2 207a_100000211653_100000210073 [0,1,0,0,1,0|2,0,0]=4 7088 B16R2.2959 Clc1ccccc1CNCc2cccs2 2230a_100000211653_100000187162 [0,1,0,0,1,0|2,0,0]=4 7089 B16R2.2959 Clc1ccccc1CNCc2cccs2 270004a_100000174879_100000209959 [0,1,0,0,1,0|2,0,0]=4 7090 B16R2.2959 Clc1ccccc1CNCc2cccs2 270004a_100000211653_100000210073 [0,1,0,0,1,0|2,0,0]=4 7091 B16R2.2959 Clc1ccccc1CNCc2ccoc2 207a_100000174879_100011215517 [0,1,0,0,1,0|2,0,0]=4 7092 B16R2.2959 Clc1ccccc1CNCc2ccoc2 207a_100015206860_100000210073 [0,1,0,0,1,0|2,0,0]=4 7093 B16R2.2959 Clc1ccccc1CNCc2ccoc2 2230a_100015206860_100000187162 [0,1,0,0,1,0|2,0,0]=4 7094 B16R2.2959 Clc1ccccc1CNCc2ccoc2 270004a_100000174879_100011215517 [0,1,0,0,1,0|2,0,0]=4 7095 B16R2.2959 Clc1ccccc1CNCc2ccoc2 270004a_100015206860_100000210073 [0,1,0,0,1,0|2,0,0]=4 7096 B16R2.2959 Clc1ccccc1CNCc2ccoc2 34a_100015206860_100000187162 [0,1,0,0,1,0|2,0,0]=4 7097 B16R2.2959 Clc1ccccc1CNCc2ccsc2 207a_100000174879_100000188534 [0,1,0,0,1,0|2,0,0]=4 7098 B16R2.2959 Clc1ccccc1CNCc2ccsc2 207a_100000186416_100000210073 [0,1,0,0,1,0|2,0,0]=4 7099 B16R2.2959 Clc1ccccc1CNCc2ccsc2 2230a_100000174879_100011261437 [0,1,0,0,1,0|2,0,0]=4 7100 B16R2.2959 Clc1ccccc1CNCc2ccsc2 2230a_100000186416_100000187162 [0,1,0,0,1,0|2,0,0]=4 7101 B16R2.2959 Clc1ccccc1CNCc2ccsc2 270004a_100000174879_100000188534 [0,1,0,0,1,0|2,0,0]=4 7102 B16R2.2959 Clc1ccccc1CNCc2ccsc2 270004a_100000186416_100000210073 [0,1,0,0,1,0|2,0,0]=4 7103 B16R2.2959 Clc1ccccc1CNCc2ccsc2 34a_100000174879_100011261437 [0,1,0,0,1,0|2,0,0]=4 7104 B16R2.2959 Clc1ccccc1CNCc2ccsc2 34a_100000186416_100000187162 [0,1,0,0,1,0|2,0,0]=4 7105 B16R2.2959 Clc1ccccc1COCc2c[nH]cn2 34a_100000210847_100000707719 [0,1,0,0,1,0|2,0,0]=4 7106 B16R2.2959 Clc1ccccc1COCc2ccco2 34a_100000210059_100000187162 [0,1,0,0,1,0|1,0,0]=3 7107 B16R2.2959 Clc1ccccc1COCc2cccs2 34a_100000211240_100000187162 [0,1,0,0,1,0|1,0,0]=3 7108 B16R2.2959 Clc1ccccc1COCc2ccn[nH]2 34a_100000210847_100000728653 [0,1,0,0,1,0|2,0,0]=4 7109 B16R2.2959 Clc1ccccc1COCc2ccn[nH]2 7a_100000210847_100000728653 [0,1,0,0,1,0|2,0,0]=4 7110 B16R2.2959 Clc1ccccc1COCc2ccno2 34a_100000740478_100000187162 [0,1,0,0,1,0|2,0,0]=4 7111 B16R2.2959 Clc1ccccc1COCc2ccoc2 34a_100011215357_100000187162 [0,1,0,0,1,0|1,0,0]=3 7112 B16R2.2959 Clc1ccccc1COCc2ccon2 34a_100000210847_100000234950 [0,1,0,0,1,0|2,0,0]=4 7113 B16R2.2959 Clc1ccccc1COCc2ccon2 7a_100000210847_100000234950 [0,1,0,0,1,0|2,0,0]=4 7114 B16R2.2959 Clc1ccccc1COCc2ccsc2 34a_100000210847_100011261437 [0,1,0,0,1,0|1,0,0]=3 7115 B16R2.2959 Clc1ccccc1COCc2ccsc2 34a_100011215551_100000187162 [0,1,0,0,1,0|1,0,0]=3 7116 B16R2.2959 Clc1ccccc1COCc2ccsc2 7a_100000210847_100011261437 [0,1,0,0,1,0|1,0,0]=3 7117 B16R2.2959 Clc1ccccc1COCc2cncs2 34a_100000210847_100015185245 [0,1,0,0,1,0|2,0,0]=4 7118 B16R2.2959 Clc1ccccc1COCc2cncs2 7a_100000210847_100015185245 [0,1,0,0,1,0|2,0,0]=4 7119 B16R2.2959 Clc1ccccc1COCc2cscn2 34a_100000210847_100000205941 [0,1,0,0,1,0|2,0,0]=4 7120 B16R2.2959 Clc1ccccc1COCc2cscn2 7a_100000210847_100000205941 [0,1,0,0,1,0|2,0,0]=4 7121 B16R2.2959 Clc1ccccc1COCc2ncc[nH]2 34a_100000210847_100016991755 [0,1,0,0,1,0|2,0,0]=4 7122 B16R2.2959 Clc1ccccc1COCc2ncc[nH]2 7a_100000210847_100000753453 [0,1,0,0,1,0|2,0,0]=4 7123 B16R2.2959 Clc1ccccc1COCc2ncco2 34a_100000062594_100000187162 [0,1,0,0,1,0|2,0,0]=4 7124 B16R2.2959 Clc1ccccc1COCc2ncco2 34a_100000210847_103436540062 [0,1,0,0,1,0|2,0,0]=4 7125 B16R2.2959 Clc1ccccc1COCc2ncco2 7a_100000210847_103436540062 [0,1,0,0,1,0|2,0,0]=4 7126 B16R2.2959 Clc1ccccc1COCc2nccs2 34a_100000210847_100015184050 [0,1,0,0,1,0|2,0,0]=4 7127 B16R2.2959 Clc1ccccc1COCc2nccs2 7a_100000210847_100015184050 [0,1,0,0,1,0|2,0,0]=4 7128 B16R2.2959 Clc1ccccc1COCn2cccn2 34a_100000731028_100000187162 [0,1,0,0,1,0|2,0,0]=4 7129 B16R2.2959 Clc1ccccc1CSCc2ccsc2 62a_100000187162_100011233845 [0,1,0,0,1,0|1,1,0]=4 7130 B16R2.2959 Clc1ccccc1CSCc2ccsc2 62a_100011261437_100000187162 [0,1,0,0,1,0|1,1,0]=4 7131 B16R2.2959 Clc1cccnc1COCc2ccsc2 34a_100012002383_100011261437 [0,1,0,0,1,0|2,0,0]=4 7132 B16R2.2959 Clc1ccncc1COCc2ccsc2 34a_100000117392_100011261437 [0,1,0,0,1,0|2,0,0]=4 7133 B16R2.2959 Clc1ncccc1COCc2ccco2 34a_100000210059_100000045678 [0,1,0,0,1,0|2,0,0]=4 7134 B16R2.2959 Clc1ncccc1COCc2cccs2 34a_100000211240_100000045678 [0,1,0,0,1,0|2,0,0]=4 7135 B16R2.2959 Clc1ncccc1COCc2ccoc2 34a_100011215357_100000045678 [0,1,0,0,1,0|2,0,0]=4 7136 B16R2.2959 Clc1ncccc1COCc2ccsc2 34a_100000748726_100011261437 [0,1,0,0,1,0|2,0,0]=4 7137 B16R2.2959 Clc1ncccc1COCc2ccsc2 34a_100011215551_100000045678 [0,1,0,0,1,0|2,0,0]=4 7138 B16R2.2959 Clc1ncccc1COCc2ccsc2 7a_100000748726_100011261437 [0,1,0,0,1,0|2,0,0]=4 7139 B16R2.2959 Fc1ccccc1CNCc2ccco2 207a_100000174869_100000186105 [0,1,0,0,1,0|2,0,0]=4 7140 B16R2.2959 Fc1ccccc1CNCc2ccco2 207a_100000185738_100000210811 [0,1,0,0,1,0|2,0,0]=4 7141 B16R2.2959 Fc1ccccc1CNCc2ccco2 2230a_100000185738_100000211605 [0,1,0,0,1,0|2,0,0]=4 7142 B16R2.2959 Fc1ccccc1CNCc2ccco2 270004a_100000174869_100000186105 [0,1,0,0,1,0|2,0,0]=4 7143 B16R2.2959 Fc1ccccc1CNCc2ccco2 270004a_100000185738_100000210811 [0,1,0,0,1,0|2,0,0]=4 7144 B16R2.2959 Fc1ccccc1CNCc2ccco2 34a_100000185738_100000211605 [0,1,0,0,1,0|2,0,0]=4 7145 B16R2.2959 Fc1ccccc1CNCc2cccs2 207a_100000174869_100000209959 [0,1,0,0,1,0|2,0,0]=4 7146 B16R2.2959 Fc1ccccc1CNCc2cccs2 207a_100000211653_100000210811 [0,1,0,0,1,0|2,0,0]=4 7147 B16R2.2959 Fc1ccccc1CNCc2cccs2 2230a_100000211653_100000211605 [0,1,0,0,1,0|2,0,0]=4 7148 B16R2.2959 Fc1ccccc1CNCc2cccs2 270004a_100000174869_100000209959 [0,1,0,0,1,0|2,0,0]=4 7149 B16R2.2959 Fc1ccccc1CNCc2cccs2 270004a_100000211653_100000210811 [0,1,0,0,1,0|2,0,0]=4 7150 B16R2.2959 Fc1ccccc1CNCc2ccoc2 207a_100000174869_100011215517 [0,1,0,0,1,0|2,0,0]=4 7151 B16R2.2959 Fc1ccccc1CNCc2ccoc2 207a_100015206860_100000210811 [0,1,0,0,1,0|2,0,0]=4 7152 B16R2.2959 Fc1ccccc1CNCc2ccoc2 2230a_100015206860_100000211605 [0,1,0,0,1,0|2,0,0]=4 7153 B16R2.2959 Fc1ccccc1CNCc2ccoc2 270004a_100000174869_100011215517 [0,1,0,0,1,0|2,0,0]=4 7154 B16R2.2959 Fc1ccccc1CNCc2ccoc2 270004a_100015206860_100000210811 [0,1,0,0,1,0|2,0,0]=4 7155 B16R2.2959 Fc1ccccc1CNCc2ccoc2 34a_100015206860_100000211605 [0,1,0,0,1,0|2,0,0]=4 7156 B16R2.2959 Fc1ccccc1CNCc2ccsc2 207a_100000174869_100000188534 [0,1,0,0,1,0|2,0,0]=4 7157 B16R2.2959 Fc1ccccc1CNCc2ccsc2 207a_100000186416_100000210811 [0,1,0,0,1,0|2,0,0]=4 7158 B16R2.2959 Fc1ccccc1CNCc2ccsc2 2230a_100000186416_100000211605 [0,1,0,0,1,0|2,0,0]=4 7159 B16R2.2959 Fc1ccccc1CNCc2ccsc2 270004a_100000174869_100000188534 [0,1,0,0,1,0|2,0,0]=4 7160 B16R2.2959 Fc1ccccc1CNCc2ccsc2 270004a_100000186416_100000210811 [0,1,0,0,1,0|2,0,0]=4 7161 B16R2.2959 Fc1ccccc1CNCc2ccsc2 34a_100000174869_100011261437 [0,1,0,0,1,0|2,0,0]=4 7162 B16R2.2959 Fc1ccccc1CNCc2ccsc2 34a_100000186416_100000211605 [0,1,0,0,1,0|2,0,0]=4 7163 B16R2.2959 Fc1ccccc1COCc2c[nH]cn2 34a_100000211962_100000707719 [0,1,0,0,1,0|2,0,0]=4 7164 B16R2.2959 Fc1ccccc1COCc2ccco2 34a_100000210059_100000211605 [0,1,0,0,1,0|1,0,0]=3 7165 B16R2.2959 Fc1ccccc1COCc2cccs2 34a_100000211240_100000211605 [0,1,0,0,1,0|1,0,0]=3 7166 B16R2.2959 Fc1ccccc1COCc2ccn[nH]2 34a_100000211962_100000728653 [0,1,0,0,1,0|2,0,0]=4 7167 B16R2.2959 Fc1ccccc1COCc2ccn[nH]2 7a_100000211962_100000728653 [0,1,0,0,1,0|2,0,0]=4 7168 B16R2.2959 Fc1ccccc1COCc2ccno2 34a_100000740478_100000211605 [0,1,0,0,1,0|2,0,0]=4 7169 B16R2.2959 Fc1ccccc1COCc2ccoc2 34a_100011215357_100000211605 [0,1,0,0,1,0|1,0,0]=3 7170 B16R2.2959 Fc1ccccc1COCc2ccon2 34a_100000211962_100000234950 [0,1,0,0,1,0|2,0,0]=4 7171 B16R2.2959 Fc1ccccc1COCc2ccon2 7a_100000211962_100000234950 [0,1,0,0,1,0|2,0,0]=4 7172 B16R2.2959 Fc1ccccc1COCc2ccsc2 34a_100000211962_100011261437 [0,1,0,0,1,0|1,0,0]=3 7173 B16R2.2959 Fc1ccccc1COCc2ccsc2 34a_100011215551_100000211605 [0,1,0,0,1,0|1,0,0]=3 7174 B16R2.2959 Fc1ccccc1COCc2ccsc2 7a_100000211962_100011261437 [0,1,0,0,1,0|1,0,0]=3 7175 B16R2.2959 Fc1ccccc1COCc2cncs2 34a_100000211962_100015185245 [0,1,0,0,1,0|2,0,0]=4 7176 B16R2.2959 Fc1ccccc1COCc2cncs2 7a_100000211962_100015185245 [0,1,0,0,1,0|2,0,0]=4 7177 B16R2.2959 Fc1ccccc1COCc2cscn2 34a_100000211962_100000205941 [0,1,0,0,1,0|2,0,0]=4 7178 B16R2.2959 Fc1ccccc1COCc2cscn2 7a_100000211962_100000205941 [0,1,0,0,1,0|2,0,0]=4 7179 B16R2.2959 Fc1ccccc1COCc2ncc[nH]2 34a_100000211962_100016991755 [0,1,0,0,1,0|2,0,0]=4 7180 B16R2.2959 Fc1ccccc1COCc2ncc[nH]2 7a_100000211962_100000753453 [0,1,0,0,1,0|2,0,0]=4 7181 B16R2.2959 Fc1ccccc1COCc2ncco2 34a_100000062594_100000211605 [0,1,0,0,1,0|2,0,0]=4 7182 B16R2.2959 Fc1ccccc1COCc2ncco2 34a_100000211962_103436540062 [0,1,0,0,1,0|2,0,0]=4 7183 B16R2.2959 Fc1ccccc1COCc2ncco2 7a_100000211962_103436540062 [0,1,0,0,1,0|2,0,0]=4 7184 B16R2.2959 Fc1ccccc1COCc2nccs2 34a_100000211962_100015184050 [0,1,0,0,1,0|2,0,0]=4 7185 B16R2.2959 Fc1ccccc1COCc2nccs2 7a_100000211962_100015184050 [0,1,0,0,1,0|2,0,0]=4 7186 B16R2.2959 Fc1ccccc1COCn2cccn2 34a_100000731028_100000211605 [0,1,0,0,1,0|2,0,0]=4 7187 B16R2.2959 Fc1ccccc1CSCc2ccsc2 62a_100000211605_100011233845 [0,1,0,0,1,0|1,1,0]=4 7188 B16R2.2959 Fc1ccccc1CSCc2ccsc2 62a_100011261437_100000211605 [0,1,0,0,1,0|1,1,0]=4 7189 B16R2.2959 Fc1cccnc1COCc2ccco2 34a_100000210059_100000104219 [0,1,0,0,1,0|2,0,0]=4 7190 B16R2.2959 Fc1cccnc1COCc2cccs2 34a_100000211240_100000104219 [0,1,0,0,1,0|2,0,0]=4 7191 B16R2.2959 Fc1cccnc1COCc2ccoc2 34a_100011215357_100000104219 [0,1,0,0,1,0|2,0,0]=4 7192 B16R2.2959 Fc1cccnc1COCc2ccsc2 34a_100011215551_100000104219 [0,1,0,0,1,0|2,0,0]=4 7193 B16R2.2959 Fc1cccnc1COCc2ccsc2 34a_100011934865_100011261437 [0,1,0,0,1,0|2,0,0]=4 7194 B16R2.2959 Fc1cnccc1COCc2ccsc2 34a_100012172863_100011261437 [0,1,0,0,1,0|2,0,0]=4 7195 B16R2.2959 Fc1ncccc1COCc2ccco2 34a_100000210059_100000099810 [0,1,0,0,1,0|2,0,0]=4 7196 B16R2.2959 Fc1ncccc1COCc2cccs2 34a_100000211240_100000099810 [0,1,0,0,1,0|2,0,0]=4 7197 B16R2.2959 Fc1ncccc1COCc2ccoc2 34a_100011215357_100000099810 [0,1,0,0,1,0|2,0,0]=4 7198 B16R2.2959 Fc1ncccc1COCc2ccsc2 34a_100000079888_100011261437 [0,1,0,0,1,0|2,0,0]=4 7199 B16R2.2959 Fc1ncccc1COCc2ccsc2 34a_100011215551_100000099810 [0,1,0,0,1,0|2,0,0]=4 7200 B16R2.2959 Fc1ncccc1COCc2ccsc2 7a_100000079888_100011261437 [0,1,0,0,1,0|2,0,0]=4 7201 B16R2.2959 Ic1ccccc1CNCc2ccco2 207a_100000185738_100000010305 [0,1,0,0,1,0|2,0,0]=4 7202 B16R2.2959 Ic1ccccc1CNCc2ccco2 207a_100015347259_100000186105 [0,1,0,0,1,0|2,0,0]=4 7203 B16R2.2959 Ic1ccccc1CNCc2ccco2 2230a_100000185738_100011215278 [0,1,0,0,1,0|2,0,0]=4 7204 B16R2.2959 Ic1ccccc1CNCc2ccco2 270004a_100000185738_100000010305 [0,1,0,0,1,0|2,0,0]=4 7205 B16R2.2959 Ic1ccccc1CNCc2ccco2 270004a_100015347259_100000186105 [0,1,0,0,1,0|2,0,0]=4 7206 B16R2.2959 Ic1ccccc1CNCc2ccco2 34a_100000185738_100011215278 [0,1,0,0,1,0|2,0,0]=4 7207 B16R2.2959 Ic1ccccc1CNCc2cccs2 207a_100000211653_100000010305 [0,1,0,0,1,0|2,0,0]=4 7208 B16R2.2959 Ic1ccccc1CNCc2cccs2 207a_100015347259_100000209959 [0,1,0,0,1,0|2,0,0]=4 7209 B16R2.2959 Ic1ccccc1CNCc2cccs2 2230a_100000211653_100011215278 [0,1,0,0,1,0|2,0,0]=4 7210 B16R2.2959 Ic1ccccc1CNCc2cccs2 270004a_100000211653_100000010305 [0,1,0,0,1,0|2,0,0]=4 7211 B16R2.2959 Ic1ccccc1CNCc2cccs2 270004a_100015347259_100000209959 [0,1,0,0,1,0|2,0,0]=4 7212 B16R2.2959 Ic1ccccc1CNCc2ccoc2 207a_100015206860_100000010305 [0,1,0,0,1,0|2,0,0]=4 7213 B16R2.2959 Ic1ccccc1CNCc2ccoc2 207a_100015347259_100011215517 [0,1,0,0,1,0|2,0,0]=4 7214 B16R2.2959 Ic1ccccc1CNCc2ccoc2 2230a_100015206860_100011215278 [0,1,0,0,1,0|2,0,0]=4 7215 B16R2.2959 Ic1ccccc1CNCc2ccoc2 270004a_100015206860_100000010305 [0,1,0,0,1,0|2,0,0]=4 7216 B16R2.2959 Ic1ccccc1CNCc2ccoc2 270004a_100015347259_100011215517 [0,1,0,0,1,0|2,0,0]=4 7217 B16R2.2959 Ic1ccccc1CNCc2ccoc2 34a_100015206860_100011215278 [0,1,0,0,1,0|2,0,0]=4 7218 B16R2.2959 Ic1ccccc1CNCc2ccsc2 207a_100000186416_100000010305 [0,1,0,0,1,0|2,0,0]=4 7219 B16R2.2959 Ic1ccccc1CNCc2ccsc2 207a_100015347259_100000188534 [0,1,0,0,1,0|2,0,0]=4 7220 B16R2.2959 Ic1ccccc1CNCc2ccsc2 2230a_100000186416_100011215278 [0,1,0,0,1,0|2,0,0]=4 7221 B16R2.2959 Ic1ccccc1CNCc2ccsc2 270004a_100000186416_100000010305 [0,1,0,0,1,0|2,0,0]=4 7222 B16R2.2959 Ic1ccccc1CNCc2ccsc2 270004a_100015347259_100000188534 [0,1,0,0,1,0|2,0,0]=4 7223 B16R2.2959 Ic1ccccc1CNCc2ccsc2 34a_100000186416_100011215278 [0,1,0,0,1,0|2,0,0]=4 7224 B16R2.2959 Ic1ccccc1COCc2c[nH]cn2 34a_100000187465_100000707719 [0,1,0,0,1,0|2,0,0]=4 7225 B16R2.2959 Ic1ccccc1COCc2ccco2 34a_100000210059_100011215278 [0,1,0,0,1,0|1,0,0]=3 7226 B16R2.2959 Ic1ccccc1COCc2cccs2 34a_100000211240_100011215278 [0,1,0,0,1,0|1,0,0]=3 7227 B16R2.2959 Ic1ccccc1COCc2ccn[nH]2 34a_100000187465_100000728653 [0,1,0,0,1,0|2,0,0]=4 7228 B16R2.2959 Ic1ccccc1COCc2ccn[nH]2 7a_100000187465_100000728653 [0,1,0,0,1,0|2,0,0]=4 7229 B16R2.2959 Ic1ccccc1COCc2ccno2 34a_100000740478_100011215278 [0,1,0,0,1,0|2,0,0]=4 7230 B16R2.2959 Ic1ccccc1COCc2ccoc2 34a_100011215357_100011215278 [0,1,0,0,1,0|1,0,0]=3 7231 B16R2.2959 Ic1ccccc1COCc2ccon2 34a_100000187465_100000234950 [0,1,0,0,1,0|2,0,0]=4 7232 B16R2.2959 Ic1ccccc1COCc2ccon2 7a_100000187465_100000234950 [0,1,0,0,1,0|2,0,0]=4 7233 B16R2.2959 Ic1ccccc1COCc2ccsc2 34a_100000187465_100011261437 [0,1,0,0,1,0|1,0,0]=3 7234 B16R2.2959 Ic1ccccc1COCc2ccsc2 34a_100011215551_100011215278 [0,1,0,0,1,0|1,0,0]=3 7235 B16R2.2959 Ic1ccccc1COCc2ccsc2 7a_100000187465_100011261437 [0,1,0,0,1,0|1,0,0]=3 7236 B16R2.2959 Ic1ccccc1COCc2cncs2 34a_100000187465_100015185245 [0,1,0,0,1,0|2,0,0]=4 7237 B16R2.2959 Ic1ccccc1COCc2cncs2 7a_100000187465_100015185245 [0,1,0,0,1,0|2,0,0]=4 7238 B16R2.2959 Ic1ccccc1COCc2cscn2 34a_100000187465_100000205941 [0,1,0,0,1,0|2,0,0]=4 7239 B16R2.2959 Ic1ccccc1COCc2cscn2 7a_100000187465_100000205941 [0,1,0,0,1,0|2,0,0]=4 7240 B16R2.2959 Ic1ccccc1COCc2ncc[nH]2 34a_100000187465_100016991755 [0,1,0,0,1,0|2,0,0]=4 7241 B16R2.2959 Ic1ccccc1COCc2ncc[nH]2 7a_100000187465_100000753453 [0,1,0,0,1,0|2,0,0]=4 7242 B16R2.2959 Ic1ccccc1COCc2ncco2 34a_100000062594_100011215278 [0,1,0,0,1,0|2,0,0]=4 7243 B16R2.2959 Ic1ccccc1COCc2ncco2 34a_100000187465_103436540062 [0,1,0,0,1,0|2,0,0]=4 7244 B16R2.2959 Ic1ccccc1COCc2ncco2 7a_100000187465_103436540062 [0,1,0,0,1,0|2,0,0]=4 7245 B16R2.2959 Ic1ccccc1COCc2nccs2 34a_100000187465_100015184050 [0,1,0,0,1,0|2,0,0]=4 7246 B16R2.2959 Ic1ccccc1COCc2nccs2 7a_100000187465_100015184050 [0,1,0,0,1,0|2,0,0]=4 7247 B16R2.2959 Ic1ccccc1COCn2cccn2 34a_100000731028_100011215278 [0,1,0,0,1,0|2,0,0]=4 7248 B16R2.2959 Ic1ccccc1CSCc2ccsc2 62a_100011216222_100011233845 [0,1,0,0,1,0|1,1,0]=4 7249 B16R2.2959 Ic1ccccc1CSCc2ccsc2 62a_100011261437_100011216222 [0,1,0,0,1,0|1,1,0]=4 7250 B16R2.2959 Nc1ccccc1COCc2c[nH]cn2 34a_100000212039_100000707719 [0,1,0,0,1,0|2,0,0]=4 7251 B16R2.2959 Nc1ccccc1COCc2ccn[nH]2 34a_100000212039_100000728653 [0,1,0,0,1,0|2,0,0]=4 7252 B16R2.2959 Nc1ccccc1COCc2ccon2 34a_100000212039_100000234950 [0,1,0,0,1,0|2,0,0]=4 7253 B16R2.2959 Nc1ccccc1COCc2ccsc2 34a_100000212039_100011261437 [0,1,0,0,1,0|1,0,0]=3 7254 B16R2.2959 Nc1ccccc1COCc2cncs2 34a_100000212039_100015185245 [0,1,0,0,1,0|2,0,0]=4 7255 B16R2.2959 Nc1ccccc1COCc2cscn2 34a_100000212039_100000205941 [0,1,0,0,1,0|2,0,0]=4 7256 B16R2.2959 Nc1ccccc1COCc2ncc[nH]2 34a_100000212039_100016991755 [0,1,0,0,1,0|2,0,0]=4 7257 B16R2.2959 Nc1ccccc1COCc2ncco2 34a_100000212039_103436540062 [0,1,0,0,1,0|2,0,0]=4 7258 B16R2.2959 Nc1ccccc1COCc2nccs2 34a_100000212039_100015184050 [0,1,0,0,1,0|2,0,0]=4 7259 B16R2.2959 Nc1cccnc1COCc2ccsc2 34a_114873767017_100011261437 [0,1,0,0,1,0|2,0,0]=4 7260 B16R2.2959 Oc1ccccc1CNCc2ccco2 207a_100000185550_100000186105 [0,1,0,0,1,0|2,0,0]=4 7261 B16R2.2959 Oc1ccccc1CNCc2ccco2 270004a_100000185550_100000186105 [0,1,0,0,1,0|2,0,0]=4 7262 B16R2.2959 Oc1ccccc1CNCc2cccs2 207a_100000185550_100000209959 [0,1,0,0,1,0|2,0,0]=4 7263 B16R2.2959 Oc1ccccc1CNCc2cccs2 270004a_100000185550_100000209959 [0,1,0,0,1,0|2,0,0]=4 7264 B16R2.2959 Oc1ccccc1CNCc2ccoc2 207a_100000185550_100011215517 [0,1,0,0,1,0|2,0,0]=4 7265 B16R2.2959 Oc1ccccc1CNCc2ccoc2 270004a_100000185550_100011215517 [0,1,0,0,1,0|2,0,0]=4 7266 B16R2.2959 Oc1ccccc1CNCc2ccsc2 207a_100000185550_100000188534 [0,1,0,0,1,0|2,0,0]=4 7267 B16R2.2959 Oc1ccccc1CNCc2ccsc2 270004a_100000185550_100000188534 [0,1,0,0,1,0|2,0,0]=4 7268 B16R2.2959 Oc1ccccc1CNCc2ccsc2 34a_100000185550_100011261437 [0,1,0,0,1,0|2,0,0]=4 7269 B16R2.2959 Oc1cccnc1COCc2ccco2 34a_100000210059_200020655725 [0,1,0,0,1,0|2,0,0]=4 7270 B16R2.2959 Oc1cccnc1COCc2cccs2 34a_100000211240_200020655725 [0,1,0,0,1,0|2,0,0]=4 7271 B16R2.2959 Oc1cccnc1COCc2ccoc2 34a_100011215357_200020655725 [0,1,0,0,1,0|2,0,0]=4 7272 B16R2.2959 Oc1cccnc1COCc2ccsc2 34a_100011215551_200020655725 [0,1,0,0,1,0|2,0,0]=4 7273 B16R2.3250 Brc1ccoc1CNCc2ccccc2 270004a_100015324214_100000756499 [0,1,0,0,1,0|2,0,0]=4 7274 B16R2.3250 Brc1ccsc1CNCc2ccccc2 207a_100015324214_100000766043 [0,1,0,0,1,0|2,0,0]=4 7275 B16R2.3250 Brc1ccsc1CNCc2ccccc2 270004a_100015324214_100000766043 [0,1,0,0,1,0|2,0,0]=4 7276 B16R2.3250 Brc1ccsc1COCc2ccccc2 34a_100000702026_100015291786 [0,1,0,0,1,0|1,0,0]=3 7277 B16R2.3250 Brc1ccsc1COCc2ccccn2 34a_100000702026_100000721315 [0,1,0,0,1,0|2,0,0]=4 7278 B16R2.3250 Brc1ccsc1COCc2cccnc2 34a_100000702026_100000733263 [0,1,0,0,1,0|2,0,0]=4 7279 B16R2.3250 Brc1cscc1CNCc2ccccc2 207a_100015324214_100000685484 [0,1,0,0,1,0|2,0,0]=4 7280 B16R2.3250 Brc1cscc1CNCc2ccccc2 270004a_100015324214_100000685484 [0,1,0,0,1,0|2,0,0]=4 7281 B16R2.3250 Brc1cscc1COCc2ccccc2 34a_100000724555_100015291786 [0,1,0,0,1,0|1,0,0]=3 7282 B16R2.3250 Brc1cscc1COCc2ccccn2 34a_100000724555_100000721315 [0,1,0,0,1,0|2,0,0]=4 7283 B16R2.3250 Brc1cscc1COCc2cccnc2 34a_100000724555_100000733263 [0,1,0,0,1,0|2,0,0]=4 7284 B16R2.3250 Brc1ncsc1COCc2ccccc2 7a_100012000948_100000211182 [0,1,0,0,1,0|2,0,0]=4 7285 B16R2.3250 Brc1sccc1CNCc2ccccc2 207a_100000727803_100015611070 [0,1,0,0,1,0|2,0,0]=4 7286 B16R2.3250 Brc1sccc1CNCc2ccccc2 207a_100015324214_100009816921 [0,1,0,0,1,0|2,0,0]=4 7287 B16R2.3250 Brc1sccc1CNCc2ccccc2 2230a_100000727803_100015291786 [0,1,0,0,1,0|2,0,0]=4 7288 B16R2.3250 Brc1sccc1CNCc2ccccc2 2230a_100015324214_100009814289 [0,1,0,0,1,0|2,0,0]=4 7289 B16R2.3250 Brc1sccc1CNCc2ccccc2 270004a_100000727803_100015611070 [0,1,0,0,1,0|2,0,0]=4 7290 B16R2.3250 Brc1sccc1CNCc2ccccc2 270004a_100015324214_100009816921 [0,1,0,0,1,0|2,0,0]=4 7291 B16R2.3250 Brc1sccc1CNCc2ccccc2 34a_100000727803_100015291786 [0,1,0,0,1,0|2,0,0]=4 7292 B16R2.3250 Brc1sccc1CNCc2ccccc2 34a_100015324214_100009814289 [0,1,0,0,1,0|2,0,0]=4 7293 B16R2.3250 Brc1sccc1COCc2ccccc2 34a_100000210790_100009814289 [0,1,0,0,1,0|1,0,0]=3 7294 B16R2.3250 Brc1sccc1COCc2ccccc2 34a_100009816922_100015291786 [0,1,0,0,1,0|1,0,0]=3 7295 B16R2.3250 Brc1sccc1COCc2ccccc2 7a_100000210790_100009814289 [0,1,0,0,1,0|1,0,0]=3 7296 B16R2.3250 Brc1sccc1COCc2ccccc2 7a_100009816922_100000211182 [0,1,0,0,1,0|1,0,0]=3 7297 B16R2.3250 Brc1sccc1COCc2ccccn2 34a_100009816922_100000721315 [0,1,0,0,1,0|2,0,0]=4 7298 B16R2.3250 Brc1sccc1COCc2ccccn2 7a_100009816922_100000721315 [0,1,0,0,1,0|2,0,0]=4 7299 B16R2.3250 Brc1sccc1COCc2cccnc2 34a_100009816922_100000733263 [0,1,0,0,1,0|2,0,0]=4 7300 B16R2.3250 Brc1sccc1COCc2cccnc2 7a_100009816922_100000741622 [0,1,0,0,1,0|2,0,0]=4 7301 B16R2.3250 Brc1sccc1COCc2ccncc2 7a_100009816922_100015193705 [0,1,0,0,1,0|2,0,0]=4 7302 B16R2.3250 Brc1sccc1CSCc2ccccc2 62a_100000211182_100009814289 [0,1,0,0,1,0|1,1,0]=4 7303 B16R2.3250 Brc1sccc1CSCc2ccccc2 62a_100009814289_100015291786 [0,1,0,0,1,0|1,1,0]=4 7304 B16R2.3250 Cc1ccoc1CNCc2ccccc2 207a_100015324214_100000763527 [0,1,0,0,1,0|2,0,0]=4 7305 B16R2.3250 Cc1ccoc1CNCc2ccccc2 270004a_100015324214_100000763527 [0,1,0,0,1,0|2,0,0]=4 7306 B16R2.3250 Cc1ccoc1COCc2ccccc2 34a_100011273948_100015291786 [0,1,0,0,1,0|1,0,0]=3 7307 B16R2.3250 Cc1ccoc1COCc2ccccc2 7a_100011273948_100000211182 [0,1,0,0,1,0|1,0,0]=3 7308 B16R2.3250 Cc1ccoc1COCc2ccccn2 34a_100011273948_100000721315 [0,1,0,0,1,0|2,0,0]=4 7309 B16R2.3250 Cc1ccoc1COCc2ccccn2 7a_100011273948_100000721315 [0,1,0,0,1,0|2,0,0]=4 7310 B16R2.3250 Cc1ccoc1COCc2cccnc2 34a_100011273948_100000733263 [0,1,0,0,1,0|2,0,0]=4 7311 B16R2.3250 Cc1ccoc1COCc2cccnc2 7a_100011273948_100000741622 [0,1,0,0,1,0|2,0,0]=4 7312 B16R2.3250 Cc1ccoc1COCc2ccncc2 7a_100011273948_100015193705 [0,1,0,0,1,0|2,0,0]=4 7313 B16R2.3250 Cc1ccsc1CNCc2ccccc2 207a_100000238519_100015611070 [0,1,0,0,1,0|2,0,0]=4 7314 B16R2.3250 Cc1ccsc1CNCc2ccccc2 207a_100015324214_100000210881 [0,1,0,0,1,0|2,0,0]=4 7315 B16R2.3250 Cc1ccsc1CNCc2ccccc2 2230a_100000238519_100015291786 [0,1,0,0,1,0|2,0,0]=4 7316 B16R2.3250 Cc1ccsc1CNCc2ccccc2 270004a_100000238519_100015611070 [0,1,0,0,1,0|2,0,0]=4 7317 B16R2.3250 Cc1ccsc1CNCc2ccccc2 270004a_100015324214_100000210881 [0,1,0,0,1,0|2,0,0]=4 7318 B16R2.3250 Cc1ccsc1CNCc2ccccc2 34a_100000238519_100015291786 [0,1,0,0,1,0|2,0,0]=4 7319 B16R2.3250 Cc1ccsc1COCc2ccccc2 34a_100000238368_100015291786 [0,1,0,0,1,0|1,0,0]=3 7320 B16R2.3250 Cc1ccsc1COCc2ccccc2 7a_100000238368_100000211182 [0,1,0,0,1,0|1,0,0]=3 7321 B16R2.3250 Cc1ccsc1COCc2ccccn2 34a_100000238368_100000721315 [0,1,0,0,1,0|2,0,0]=4 7322 B16R2.3250 Cc1ccsc1COCc2ccccn2 7a_100000238368_100000721315 [0,1,0,0,1,0|2,0,0]=4 7323 B16R2.3250 Cc1ccsc1COCc2cccnc2 34a_100000238368_100000733263 [0,1,0,0,1,0|2,0,0]=4 7324 B16R2.3250 Cc1ccsc1COCc2cccnc2 7a_100000238368_100000741622 [0,1,0,0,1,0|2,0,0]=4 7325 B16R2.3250 Cc1ccsc1COCc2ccncc2 7a_100000238368_100015193705 [0,1,0,0,1,0|2,0,0]=4 7326 B16R2.3250 Cc1cnoc1COCc2ccccc2 34a_200011065769_100015291786 [0,1,0,0,1,0|2,0,0]=4 7327 B16R2.3250 Cc1ncoc1COCc2ccccc2 34a_100000717716_100015291786 [0,1,0,0,1,0|2,0,0]=4 7328 B16R2.3250 Cc1ncoc1COCc2ccccc2 7a_100000717716_100000211182 [0,1,0,0,1,0|2,0,0]=4 7329 B16R2.3250 Cc1ncsc1COCc2ccccc2 34a_100000750112_100015291786 [0,1,0,0,1,0|2,0,0]=4 7330 B16R2.3250 Cc1ncsc1COCc2ccccc2 7a_100000750112_100000211182 [0,1,0,0,1,0|2,0,0]=4 7331 B16R2.3250 Cc1occc1COCc2ccccc2 34a_100011219433_100015291786 [0,1,0,0,1,0|1,0,0]=3 7332 B16R2.3250 Cc1occc1COCc2ccccc2 7a_100011219433_100000211182 [0,1,0,0,1,0|1,0,0]=3 7333 B16R2.3250 Cc1occc1COCc2ccccn2 34a_100011219433_100000721315 [0,1,0,0,1,0|2,0,0]=4 7334 B16R2.3250 Cc1occc1COCc2ccccn2 7a_100011219433_100000721315 [0,1,0,0,1,0|2,0,0]=4 7335 B16R2.3250 Cc1occc1COCc2cccnc2 34a_100011219433_100000733263 [0,1,0,0,1,0|2,0,0]=4 7336 B16R2.3250 Cc1occc1COCc2cccnc2 7a_100011219433_100000741622 [0,1,0,0,1,0|2,0,0]=4 7337 B16R2.3250 Cc1occc1COCc2ccncc2 7a_100011219433_100015193705 [0,1,0,0,1,0|2,0,0]=4 7338 B16R2.3250 Cc1ocnc1COCc2ccccc2 34a_100000210790_200000693990 [0,1,0,0,1,0|2,0,0]=4 7339 B16R2.3250 Cc1ocnc1COCc2ccccc2 34a_100012017639_100015291786 [0,1,0,0,1,0|2,0,0]=4 7340 B16R2.3250 Cc1ocnc1COCc2ccccc2 7a_100000210790_200000693990 [0,1,0,0,1,0|2,0,0]=4 7341 B16R2.3250 Clc1ccsc1CNCc2ccccc2 207a_100011934584_100015611070 [0,1,0,0,1,0|2,0,0]=4 7342 B16R2.3250 Clc1ccsc1CNCc2ccccc2 207a_100015324214_100000722334 [0,1,0,0,1,0|2,0,0]=4 7343 B16R2.3250 Clc1ccsc1CNCc2ccccc2 2230a_100011934584_100015291786 [0,1,0,0,1,0|2,0,0]=4 7344 B16R2.3250 Clc1ccsc1CNCc2ccccc2 270004a_100011934584_100015611070 [0,1,0,0,1,0|2,0,0]=4 7345 B16R2.3250 Clc1ccsc1CNCc2ccccc2 270004a_100015324214_100000722334 [0,1,0,0,1,0|2,0,0]=4 7346 B16R2.3250 Clc1ccsc1CNCc2ccccc2 34a_100011934584_100015291786 [0,1,0,0,1,0|2,0,0]=4 7347 B16R2.3250 Clc1ccsc1COCc2ccccc2 34a_100000722387_100015291786 [0,1,0,0,1,0|1,0,0]=3 7348 B16R2.3250 Clc1ccsc1COCc2ccccc2 7a_100000722387_100000211182 [0,1,0,0,1,0|1,0,0]=3 7349 B16R2.3250 Clc1ccsc1COCc2ccccn2 34a_100000722387_100000721315 [0,1,0,0,1,0|2,0,0]=4 7350 B16R2.3250 Clc1ccsc1COCc2ccccn2 7a_100000722387_100000721315 [0,1,0,0,1,0|2,0,0]=4 7351 B16R2.3250 Clc1ccsc1COCc2cccnc2 34a_100000722387_100000733263 [0,1,0,0,1,0|2,0,0]=4 7352 B16R2.3250 Clc1ccsc1COCc2cccnc2 7a_100000722387_100000741622 [0,1,0,0,1,0|2,0,0]=4 7353 B16R2.3250 Clc1ccsc1COCc2ccncc2 7a_100000722387_100015193705 [0,1,0,0,1,0|2,0,0]=4 7354 B16R2.3250 Clc1sccc1CNCc2ccccc2 207a_100015324214_100000089901 [0,1,0,0,1,0|2,0,0]=4 7355 B16R2.3250 Clc1sccc1CNCc2ccccc2 2230a_100015324214_100010167017 [0,1,0,0,1,0|2,0,0]=4 7356 B16R2.3250 Clc1sccc1CNCc2ccccc2 270004a_100015324214_100000089901 [0,1,0,0,1,0|2,0,0]=4 7357 B16R2.3250 Clc1sccc1CNCc2ccccc2 34a_100015324214_100010167017 [0,1,0,0,1,0|2,0,0]=4 7358 B16R2.3250 Clc1sccc1COCc2ccccc2 34a_100000210790_100010167017 [0,1,0,0,1,0|1,0,0]=3 7359 B16R2.3250 Clc1sccc1COCc2ccccc2 7a_100000210790_100010167017 [0,1,0,0,1,0|1,0,0]=3 7360 B16R2.3250 Clc1sccc1CSCc2ccccc2 62a_100000211182_100010167017 [0,1,0,0,1,0|1,1,0]=4 7361 B16R2.3250 Clc1sccc1CSCc2ccccc2 62a_100010167017_100015291786 [0,1,0,0,1,0|1,1,0]=4 7362 B16R2.3250 Cn1cccc1CNCc2ccccc2 270004a_100015324214_100000211633 [0,1,0,0,1,0|2,0,0]=4 7363 B16R2.3250 Cn1cccc1CNCc2ccccc2 34a_100011219357_100015291786 [0,1,0,0,1,0|2,0,0]=4 7364 B16R2.3250 Cn1ccnc1COCc2ccccc2 34a_100000210790_100000700302 [0,1,0,0,1,0|2,0,0]=4 7365 B16R2.3250 Cn1ccnc1COCc2ccccc2 7a_100000210790_100000700302 [0,1,0,0,1,0|2,0,0]=4 7366 B16R2.3250 Cn1ccnc1COCc2ccccc2 7a_100000691215_100000211182 [0,1,0,0,1,0|2,0,0]=4 7367 B16R2.3250 Cn1nccc1COCc2ccccc2 34a_100000210790_100000691648 [0,1,0,0,1,0|2,0,0]=4 7368 B16R2.3250 Cn1nccc1COCc2ccccc2 34a_100000684702_100015291786 [0,1,0,0,1,0|2,0,0]=4 7369 B16R2.3250 Cn1nccc1COCc2ccccc2 7a_100000210790_100000691648 [0,1,0,0,1,0|2,0,0]=4 7370 B16R2.3250 O=C1CCC=C1COCc2ccccc2 34a_100000087531_100015291786 [0,1,0,0,1,0|0,0,2]=4 7371 B16R2.5767 CC(NCc1ccco1)c2ccccc2 2230a_100000185738_100000230085 [0,1,0,0,1,0|2,0,0]=4 7372 B16R2.5767 CC(NCc1ccco1)c2ccccc2 34a_100000185738_100000211855 [0,1,0,0,1,0|2,0,0]=4 7373 B16R2.5767 CC(NCc1cccs1)c2ccccc2 2230a_100000211653_100000230085 [0,1,0,0,1,0|2,0,0]=4 7374 B16R2.5767 CC(NCc1cccs1)c2ccccc2 269862a_100000211653_100000185851 [0,1,0,0,1,0|2,0,0]=4 7375 B16R2.5767 CC(NCc1ccoc1)c2ccccc2 2230a_100015206860_100000230085 [0,1,0,0,1,0|2,0,0]=4 7376 B16R2.5767 CC(NCc1ccoc1)c2ccccc2 269862a_100015206860_100000185851 [0,1,0,0,1,0|2,0,0]=4 7377 B16R2.5767 CC(NCc1ccoc1)c2ccccc2 34a_100015206860_100000211855 [0,1,0,0,1,0|2,0,0]=4 7378 B16R2.5767 CC(NCc1ccsc1)c2ccccc2 2230a_100000186416_100000230085 [0,1,0,0,1,0|2,0,0]=4 7379 B16R2.5767 CC(NCc1ccsc1)c2ccccc2 269862a_100000186416_100000185851 [0,1,0,0,1,0|2,0,0]=4 7380 B16R2.5767 CC(NCc1ccsc1)c2ccccc2 34a_100000186416_100000211855 [0,1,0,0,1,0|2,0,0]=4 7381 B16R2.5767 CC(OCc1ccco1)c2ccccc2 34a_100000210059_100000211855 [0,1,0,0,1,0|1,0,0]=3 7382 B16R2.5767 CC(OCc1cccs1)c2ccccc2 34a_100000211240_100000211855 [0,1,0,0,1,0|1,0,0]=3 7383 B16R2.5767 CC(OCc1ccno1)c2ccccc2 34a_100000740478_100000211855 [0,1,0,0,1,0|2,0,0]=4 7384 B16R2.5767 CC(OCc1ccoc1)c2ccccc2 34a_100011215357_100000211855 [0,1,0,0,1,0|1,0,0]=3 7385 B16R2.5767 CC(OCc1ccsc1)c2ccccc2 34a_100011215551_100000211855 [0,1,0,0,1,0|1,0,0]=3 7386 B16R2.5767 CC(OCc1ncco1)c2ccccc2 34a_100000062594_100000211855 [0,1,0,0,1,0|2,0,0]=4 7387 B16R2.5767 CC(OCn1cccn1)c2ccccc2 34a_100000731028_100000211855 [0,1,0,0,1,0|2,0,0]=4 7388 B16R2.5767 CC(SCc1ccsc1)c2ccccc2 62a_100000230085_100011233845 [0,1,0,0,1,0|1,1,0]=4 7389 B16R2.5767 CC(SCc1ccsc1)c2ccccc2 62a_100011261437_100000230085 [0,1,0,0,1,0|1,1,0]=4 7390 B16R2.5767 C[C@@H](NCc1ccco1)c2ccccc2 207a_100000751104_100000186105 [0,1,0,0,1,0|2,0,0]=4 7391 B16R2.5767 C[C@@H](NCc1ccco1)c2ccccc2 270004a_100000751104_100000186105 [0,1,0,0,1,0|2,0,0]=4 7392 B16R2.5767 C[C@@H](NCc1cccs1)c2ccccc2 207a_100000751104_100000209959 [0,1,0,0,1,0|2,0,0]=4 7393 B16R2.5767 C[C@@H](NCc1cccs1)c2ccccc2 270004a_100000751104_100000209959 [0,1,0,0,1,0|2,0,0]=4 7394 B16R2.5767 C[C@@H](NCc1ccoc1)c2ccccc2 207a_100000751104_100011215517 [0,1,0,0,1,0|2,0,0]=4 7395 B16R2.5767 C[C@@H](NCc1ccoc1)c2ccccc2 270004a_100000751104_100011215517 [0,1,0,0,1,0|2,0,0]=4 7396 B16R2.5767 C[C@@H](NCc1ccsc1)c2ccccc2 207a_100000751104_100000188534 [0,1,0,0,1,0|2,0,0]=4 7397 B16R2.5767 C[C@@H](NCc1ccsc1)c2ccccc2 2230a_100000751104_100011261437 [0,1,0,0,1,0|2,0,0]=4 7398 B16R2.5767 C[C@@H](NCc1ccsc1)c2ccccc2 270004a_100000751104_100000188534 [0,1,0,0,1,0|2,0,0]=4 7399 B16R2.5767 C[C@@H](OCc1c[nH]cn1)c2ccccc2 34a_100000761318_100000707719 [0,1,0,0,1,0|2,0,0]=4 7400 B16R2.5767 C[C@@H](OCc1ccn[nH]1)c2ccccc2 34a_100000761318_100000728653 [0,1,0,0,1,0|2,0,0]=4 7401 B16R2.5767 C[C@@H](OCc1ccn[nH]1)c2ccccc2 7a_100000761318_100000728653 [0,1,0,0,1,0|2,0,0]=4 7402 B16R2.5767 C[C@@H](OCc1ccon1)c2ccccc2 34a_100000761318_100000234950 [0,1,0,0,1,0|2,0,0]=4 7403 B16R2.5767 C[C@@H](OCc1ccon1)c2ccccc2 7a_100000761318_100000234950 [0,1,0,0,1,0|2,0,0]=4 7404 B16R2.5767 C[C@@H](OCc1ccsc1)c2ccccc2 34a_100000761318_100011261437 [0,1,0,0,1,0|1,0,0]=3 7405 B16R2.5767 C[C@@H](OCc1ccsc1)c2ccccc2 7a_100000761318_100011261437 [0,1,0,0,1,0|1,0,0]=3 7406 B16R2.5767 C[C@@H](OCc1cncs1)c2ccccc2 34a_100000761318_100015185245 [0,1,0,0,1,0|2,0,0]=4 7407 B16R2.5767 C[C@@H](OCc1cncs1)c2ccccc2 7a_100000761318_100015185245 [0,1,0,0,1,0|2,0,0]=4 7408 B16R2.5767 C[C@@H](OCc1cscn1)c2ccccc2 34a_100000761318_100000205941 [0,1,0,0,1,0|2,0,0]=4 7409 B16R2.5767 C[C@@H](OCc1cscn1)c2ccccc2 7a_100000761318_100000205941 [0,1,0,0,1,0|2,0,0]=4 7410 B16R2.5767 C[C@@H](OCc1ncc[nH]1)c2ccccc2 34a_100000761318_100016991755 [0,1,0,0,1,0|2,0,0]=4 7411 B16R2.5767 C[C@@H](OCc1ncc[nH]1)c2ccccc2 7a_100000761318_100000753453 [0,1,0,0,1,0|2,0,0]=4 7412 B16R2.5767 C[C@@H](OCc1ncco1)c2ccccc2 34a_100000761318_103436540062 [0,1,0,0,1,0|2,0,0]=4 7413 B16R2.5767 C[C@@H](OCc1ncco1)c2ccccc2 7a_100000761318_103436540062 [0,1,0,0,1,0|2,0,0]=4 7414 B16R2.5767 C[C@@H](OCc1nccs1)c2ccccc2 34a_100000761318_100015184050 [0,1,0,0,1,0|2,0,0]=4 7415 B16R2.5767 C[C@@H](OCc1nccs1)c2ccccc2 7a_100000761318_100015184050 [0,1,0,0,1,0|2,0,0]=4 7416 B18R2.270 Brc1ccc(cc1)C#CCNc2ccccc2 34a_100000106764_100010706785 [0,1,0,0,0,1|1,0,1]=4 7417 B18R2.270 Brc1ccc(cc1)C#CCOc2ccccc2 34a_100000210340_100010706785 [0,1,0,0,0,1|1,0,1]=4 7418 B18R2.270 Brc1ccc(cc1)C#CCOc2ccccc2 7a_100000210340_100010706785 [0,1,0,0,0,1|1,0,1]=4 7419 B18R2.270 Brc1ccc(cc1)C#CCSc2ccccc2 62a_100000719477_100010706785 [0,1,0,0,0,1|1,0,1]=4 7420 B18R2.270 Brc1ccc(cc1)C#CCSc2ccccc2 62a_100010706785_100000041952 [0,1,0,0,0,1|1,0,1]=4 7421 B18R2.270 Brc1ccc(cc1)C=NNCc2ccccc2 4a_100000007032_100000186029 [0,1,0,0,0,1|1,0,1]=4 7422 B18R2.270 Brc1ccc(cc1)CC=NNc2ccccc2 4a_100015195140_100011361690 [0,1,0,0,0,1|2,0,0]=4 7423 B18R2.270 Brc1ccc(cc1)CCCNc2ccccc2 34a_100000106764_100011713682 [0,1,0,0,0,1|1,0,0]=3 7424 B18R2.270 Brc1ccc(cc1)CCCOc2ccccc2 34a_100000210340_100011713682 [0,1,0,0,0,1|1,0,0]=3 7425 B18R2.270 Brc1ccc(cc1)CCCOc2ccccc2 7a_100000210340_100011713682 [0,1,0,0,0,1|1,0,0]=3 7426 B18R2.270 Brc1ccc(cc1)CCCOc2cccnc2 34a_100000210849_100011713682 [0,1,0,0,0,1|2,0,0]=4 7427 B18R2.270 Brc1ccc(cc1)CCCOc2cccnc2 7a_100000210849_100011713682 [0,1,0,0,0,1|2,0,0]=4 7428 B18R2.270 Brc1ccc(cc1)CCCOc2ccncc2 34a_100000212176_100011713682 [0,1,0,0,0,1|2,0,0]=4 7429 B18R2.270 Brc1ccc(cc1)CCCSc2ccccc2 62a_100000719477_100011713682 [0,1,0,0,0,1|1,0,0]=3 7430 B18R2.270 Brc1ccc(cc1)CCCSc2ccccc2 62a_100011713682_100000041952 [0,1,0,0,0,1|1,0,0]=3 7431 B18R2.270 Brc1ccc(cc1)CCCSc2ccccn2 62a_100011216584_100011713682 [0,1,0,0,0,1|2,0,0]=4 7432 B18R2.270 Brc1ccc(cc1)CCCSc2ccccn2 62a_100011713682_100011216584 [0,1,0,0,0,1|2,0,0]=4 7433 B18R2.270 Brc1ccc(cc1)CCCSc2cccnc2 62a_100000210063_100011713682 [0,1,0,0,0,1|2,0,0]=4 7434 B18R2.270 Brc1ccc(cc1)CCCSc2cccnc2 62a_100011713682_100000210063 [0,1,0,0,0,1|2,0,0]=4 7435 B18R2.270 Brc1ccc(cc1)CCCSc2ccncc2 62a_100000728582_100011713682 [0,1,0,0,0,1|2,0,0]=4 7436 B18R2.270 Brc1ccc(cc1)CCCSc2ccncc2 62a_100011713682_100000728582 [0,1,0,0,0,1|2,0,0]=4 7437 B18R2.270 Brc1ccc(cc1)CCNCc2ccccc2 207a_100000755846_100015611070 [0,1,0,0,0,1|1,0,0]=3 7438 B18R2.270 Brc1ccc(cc1)CCNCc2ccccc2 2230a_100000755846_100015291786 [0,1,0,0,0,1|1,0,0]=3 7439 B18R2.270 Brc1ccc(cc1)CCNCc2ccccc2 2230a_100015324214_100011740612 [0,1,0,0,0,1|1,0,0]=3 7440 B18R2.270 Brc1ccc(cc1)CCNCc2ccccc2 270004a_100000755846_100015611070 [0,1,0,0,0,1|1,0,0]=3 7441 B18R2.270 Brc1ccc(cc1)CCNCc2ccccc2 34a_100000755846_100015291786 [0,1,0,0,0,1|1,0,0]=3 7442 B18R2.270 Brc1ccc(cc1)CCNCc2ccccc2 34a_100015324214_100011740612 [0,1,0,0,0,1|1,0,0]=3 7443 B18R2.270 Brc1ccc(cc1)CCNCc2ccccn2 207a_100000755846_100000209966 [0,1,0,0,0,1|2,0,0]=4 7444 B18R2.270 Brc1ccc(cc1)CCNCc2ccccn2 2230a_100000755846_100000721315 [0,1,0,0,0,1|2,0,0]=4 7445 B18R2.270 Brc1ccc(cc1)CCNCc2ccccn2 270004a_100000755846_100000209966 [0,1,0,0,0,1|2,0,0]=4 7446 B18R2.270 Brc1ccc(cc1)CCNCc2ccccn2 34a_100000755846_100000721315 [0,1,0,0,0,1|2,0,0]=4 7447 B18R2.270 Brc1ccc(cc1)CCNCc2cccnc2 207a_100000755846_100000209961 [0,1,0,0,0,1|2,0,0]=4 7448 B18R2.270 Brc1ccc(cc1)CCNCc2cccnc2 2230a_100000755846_100000741622 [0,1,0,0,0,1|2,0,0]=4 7449 B18R2.270 Brc1ccc(cc1)CCNCc2cccnc2 270004a_100000755846_100000209961 [0,1,0,0,0,1|2,0,0]=4 7450 B18R2.270 Brc1ccc(cc1)CCNCc2cccnc2 34a_100000755846_100000733263 [0,1,0,0,0,1|2,0,0]=4 7451 B18R2.270 Brc1ccc(cc1)CCNCc2ccncc2 207a_100000755846_100000186114 [0,1,0,0,0,1|2,0,0]=4 7452 B18R2.270 Brc1ccc(cc1)CCNCc2ccncc2 2230a_100000755846_100015193705 [0,1,0,0,0,1|2,0,0]=4 7453 B18R2.270 Brc1ccc(cc1)CCOCc2ccccc2 34a_100000210790_100011740612 [0,1,0,0,0,1|0,0,0]=2 7454 B18R2.270 Brc1ccc(cc1)CCOCc2ccccc2 34a_100000766406_100015291786 [0,1,0,0,0,1|0,0,0]=2 7455 B18R2.270 Brc1ccc(cc1)CCOCc2ccccc2 7a_100000210790_100011740612 [0,1,0,0,0,1|0,0,0]=2 7456 B18R2.270 Brc1ccc(cc1)CCOCc2ccccc2 7a_100000766406_100000211182 [0,1,0,0,0,1|0,0,0]=2 7457 B18R2.270 Brc1ccc(cc1)CCOCc2ccccn2 34a_100000766406_100000721315 [0,1,0,0,0,1|1,0,0]=3 7458 B18R2.270 Brc1ccc(cc1)CCOCc2ccccn2 7a_100000766406_100000721315 [0,1,0,0,0,1|1,0,0]=3 7459 B18R2.270 Brc1ccc(cc1)CCOCc2cccnc2 34a_100000766406_100000733263 [0,1,0,0,0,1|1,0,0]=3 7460 B18R2.270 Brc1ccc(cc1)CCOCc2cccnc2 7a_100000766406_100000741622 [0,1,0,0,0,1|1,0,0]=3 7461 B18R2.270 Brc1ccc(cc1)CCOCc2cccnn2 34a_100000766406_100016990269 [0,1,0,0,0,1|2,0,0]=4 7462 B18R2.270 Brc1ccc(cc1)CCOCc2cccnn2 7a_100000766406_100016990269 [0,1,0,0,0,1|2,0,0]=4 7463 B18R2.270 Brc1ccc(cc1)CCOCc2ccncc2 7a_100000766406_100015193705 [0,1,0,0,0,1|1,0,0]=3 7464 B18R2.270 Brc1ccc(cc1)CCOCc2cnccn2 34a_100000766406_100016995436 [0,1,0,0,0,1|2,0,0]=4 7465 B18R2.270 Brc1ccc(cc1)CCOCc2cnccn2 7a_100000766406_100016995436 [0,1,0,0,0,1|2,0,0]=4 7466 B18R2.270 Brc1ccc(cc1)CCOCc2cncnc2 34a_100000766406_100015196519 [0,1,0,0,0,1|2,0,0]=4 7467 B18R2.270 Brc1ccc(cc1)CCOCc2cncnc2 7a_100000766406_100015196519 [0,1,0,0,0,1|2,0,0]=4 7468 B18R2.270 Brc1ccc(cc1)CCOCc2ncccn2 34a_100000766406_100000703007 [0,1,0,0,0,1|2,0,0]=4 7469 B18R2.270 Brc1ccc(cc1)CCOCc2ncccn2 7a_100000766406_100000703007 [0,1,0,0,0,1|2,0,0]=4 7470 B18R2.270 Brc1ccc(cc1)CCSCc2ccccc2 62a_100000211182_100011740612 [0,1,0,0,0,1|0,1,0]=3 7471 B18R2.270 Brc1ccc(cc1)CCSCc2ccccc2 62a_100011740612_100015291786 [0,1,0,0,0,1|0,1,0]=3 7472 B18R2.270 Brc1ccc(cc1)CCSCc2ccccn2 62a_100000721315_100011740612 [0,1,0,0,0,1|1,1,0]=4 7473 B18R2.270 Brc1ccc(cc1)CCSCc2ccccn2 62a_100011740612_100000721315 [0,1,0,0,0,1|1,1,0]=4 7474 B18R2.270 Brc1ccc(cc1)CCSCc2cccnc2 62a_100000741622_100011740612 [0,1,0,0,0,1|1,1,0]=4 7475 B18R2.270 Brc1ccc(cc1)CCSCc2cccnc2 62a_100011740612_100000741622 [0,1,0,0,0,1|1,1,0]=4 7476 B18R2.270 Brc1ccc(cc1)CCSCc2ccncc2 62a_100011740612_100015193705 [0,1,0,0,0,1|1,1,0]=4 7477 B18R2.270 Brc1ccc(cc1)CCSCc2ccncc2 62a_100015193705_100011740612 [0,1,0,0,0,1|1,1,0]=4 7478 B18R2.270 Brc1ccc(cc1)CNCCc2ccccc2 207a_100000106460_100000186029 [0,1,0,0,0,1|1,0,0]=3 7479 B18R2.270 Brc1ccc(cc1)CNCCc2ccccc2 2230a_100000106460_100011217064 [0,1,0,0,0,1|1,0,0]=3 7480 B18R2.270 Brc1ccc(cc1)CNCCc2ccccc2 2230a_100000174875_100000765856 [0,1,0,0,0,1|1,0,0]=3 7481 B18R2.270 Brc1ccc(cc1)CNCCc2ccccc2 270004a_100000106460_100000186029 [0,1,0,0,0,1|1,0,0]=3 7482 B18R2.270 Brc1ccc(cc1)CNCCc2ccccc2 34a_100000106460_100000189115 [0,1,0,0,0,1|1,0,0]=3 7483 B18R2.270 Brc1ccc(cc1)CNCCc2ccccc2 34a_100000174875_100000765856 [0,1,0,0,0,1|1,0,0]=3 7484 B18R2.270 Brc1ccc(cc1)CNCCc2ccccn2 207a_100000211156_100000186029 [0,1,0,0,0,1|2,0,0]=4 7485 B18R2.270 Brc1ccc(cc1)CNCCc2ccccn2 2230a_100000174875_100015183660 [0,1,0,0,0,1|2,0,0]=4 7486 B18R2.270 Brc1ccc(cc1)CNCCc2ccccn2 270004a_100000211156_100000186029 [0,1,0,0,0,1|2,0,0]=4 7487 B18R2.270 Brc1ccc(cc1)CNCCc2cccnc2 207a_100000736294_100000186029 [0,1,0,0,0,1|2,0,0]=4 7488 B18R2.270 Brc1ccc(cc1)CNCCc2cccnc2 2230a_100000174875_200011713674 [0,1,0,0,0,1|2,0,0]=4 7489 B18R2.270 Brc1ccc(cc1)CNCCc2cccnc2 2230a_100000736294_100011217064 [0,1,0,0,0,1|2,0,0]=4 7490 B18R2.270 Brc1ccc(cc1)CNCCc2cccnc2 270004a_100000736294_100000186029 [0,1,0,0,0,1|2,0,0]=4 7491 B18R2.270 Brc1ccc(cc1)CNCCc2ccncc2 207a_100000742849_100000186029 [0,1,0,0,0,1|2,0,0]=4 7492 B18R2.270 Brc1ccc(cc1)CNCCc2ccncc2 2230a_100000174875_100000723409 [0,1,0,0,0,1|2,0,0]=4 7493 B18R2.270 Brc1ccc(cc1)CNCCc2ccncc2 270004a_100000742849_100000186029 [0,1,0,0,0,1|2,0,0]=4 7494 B18R2.270 Brc1ccc(cc1)CNCSc2ccccc2 2230a_100000174875_100011218342 [0,1,0,0,0,1|1,0,0]=3 7495 B18R2.270 Brc1ccc(cc1)CNN=Cc2ccccc2 4a_100016993955_100015611070 [0,1,0,0,0,1|1,0,1]=4 7496 B18R2.270 Brc1ccc(cc1)COCCc2ccccc2 34a_100000210268_100000189115 [0,1,0,0,0,1|0,0,0]=2 7497 B18R2.270 Brc1ccc(cc1)COCCc2ccccc2 34a_100000695286_100000765856 [0,1,0,0,0,1|0,0,0]=2 7498 B18R2.270 Brc1ccc(cc1)COCCc2ccccc2 7a_100000210268_100011217064 [0,1,0,0,0,1|0,0,0]=2 7499 B18R2.270 Brc1ccc(cc1)COCCc2ccccn2 34a_100000210271_100000189115 [0,1,0,0,0,1|1,0,0]=3 7500 B18R2.270 Brc1ccc(cc1)COCCc2cccnc2 34a_100011217484_100000189115 [0,1,0,0,0,1|1,0,0]=3 7501 B18R2.270 Brc1ccc(cc1)COCCc2ccncc2 34a_100011216225_100000189115 [0,1,0,0,0,1|1,0,0]=3 7502 B18R2.270 Brc1ccc(cc1)COCCc2cnccn2 34a_100011349526_100000189115 [0,1,0,0,0,1|2,0,0]=4 7503 B18R2.270 Brc1ccc(cc1)COCCc2cncnc2 34a_100011709255_100000189115 [0,1,0,0,0,1|2,0,0]=4 7504 B18R2.270 Brc1ccc(cc1)CSCCc2ccccc2 62a_100000189115_100011218657 [0,1,0,0,0,1|0,1,0]=3 7505 B18R2.270 Brc1ccc(cc1)CSCCc2ccccc2 62a_100000765856_100000189115 [0,1,0,0,0,1|0,1,0]=3 7506 B18R2.270 Brc1ccc(cc1)CSCCc2ccccn2 62a_100000189115_100015183660 [0,1,0,0,0,1|1,1,0]=4 7507 B18R2.270 Brc1ccc(cc1)CSCCc2ccccn2 62a_100015183660_100000189115 [0,1,0,0,0,1|1,1,0]=4 7508 B18R2.270 Brc1ccc(cc1)CSCCc2cccnc2 62a_100000189115_200011713674 [0,1,0,0,0,1|1,1,0]=4 7509 B18R2.270 Brc1ccc(cc1)CSCCc2cccnc2 62a_200011713674_100000189115 [0,1,0,0,0,1|1,1,0]=4 7510 B18R2.270 Brc1ccc(cc1)CSCCc2ccncc2 62a_100000189115_100000723409 [0,1,0,0,0,1|1,1,0]=4 7511 B18R2.270 Brc1ccc(cc1)CSCCc2ccncc2 62a_100000723409_100000189115 [0,1,0,0,0,1|1,1,0]=4 7512 B18R2.270 Brc1ccc(cc1)CSCSc2ccccc2 62a_100000189115_100011218342 [0,1,0,0,0,1|0,1,0]=3 7513 B18R2.270 Brc1ccc(cc1)CSCSc2ccccc2 62a_100011218342_100000189115 [0,1,0,0,0,1|0,1,0]=3 7514 B18R2.270 Brc1ccc(cc1)NC/C=C/c2ccccc2 2230a_100000210018_100016265936 [0,1,0,0,0,1|1,0,1]=4 7515 B18R2.270 Brc1ccc(cc1)NC/C=C/c2ccccc2 34a_100000210018_100016265936 [0,1,0,0,0,1|1,0,1]=4 7516 B18R2.270 Brc1ccc(cc1)NCC#Cc2ccccc2 2230a_100000210018_100011352542 [0,1,0,0,0,1|1,0,1]=4 7517 B18R2.270 Brc1ccc(cc1)NCC#Cc2ccccc2 34a_100000210018_100011352542 [0,1,0,0,0,1|1,0,1]=4 7518 B18R2.270 Brc1ccc(cc1)NCCCc2ccccc2 2230a_100000210018_100000211621 [0,1,0,0,0,1|1,0,0]=3 7519 B18R2.270 Brc1ccc(cc1)NCCCc2ccccc2 34a_100000210018_100000211621 [0,1,0,0,0,1|1,0,0]=3 7520 B18R2.270 Brc1ccc(cc1)NCCOc2ccccc2 2230a_100000210018_100000184471 [0,1,0,0,0,1|2,0,0]=4 7521 B18R2.270 Brc1ccc(cc1)NCCOc2ccccc2 34a_100000210018_100000184471 [0,1,0,0,0,1|2,0,0]=4 7522 B18R2.270 Brc1ccc(cc1)NCCSc2ccccc2 2230a_100000210018_100000246102 [0,1,0,0,0,1|2,0,0]=4 7523 B18R2.270 Brc1ccc(cc1)NCCSc2ccccc2 34a_100000210018_100000246102 [0,1,0,0,0,1|2,0,0]=4 7524 B18R2.270 Brc1ccc(cc1)NCOCc2ccccc2 2230a_100000210018_100000763385 [0,1,0,0,0,1|0,0,0]=2 7525 B18R2.270 Brc1ccc(cc1)NCOCc2ccccc2 34a_100000210018_100000763385 [0,1,0,0,0,1|0,0,0]=2 7526 B18R2.270 Brc1ccc(cc1)NCSCc2ccccc2 2230a_100000210018_200011217039 [0,1,0,0,0,1|0,1,0]=3 7527 B18R2.270 Brc1ccc(cc1)NCSCc2ccccc2 34a_100000210018_200011217039 [0,1,0,0,0,1|0,1,0]=3 7528 B18R2.270 Brc1ccc(cc1)NN=CCc2ccccc2 4a_100000735608_100000209964 [0,1,0,0,0,1|2,0,0]=4 7529 B18R2.270 Brc1ccc(cc1)OC/C=C/c2ccccc2 34a_100000185759_100016265936 [0,1,0,0,0,1|1,0,1]=4 7530 B18R2.270 Brc1ccc(cc1)OC/C=C/c2ccccc2 7a_100000185759_100016265936 [0,1,0,0,0,1|1,0,1]=4 7531 B18R2.270 Brc1ccc(cc1)OCC#Cc2ccccc2 34a_100000185759_100011352542 [0,1,0,0,0,1|1,0,1]=4 7532 B18R2.270 Brc1ccc(cc1)OCC#Cc2ccccc2 7a_100000185759_100011352542 [0,1,0,0,0,1|1,0,1]=4 7533 B18R2.270 Brc1ccc(cc1)OCCCc2ccccc2 34a_100000185759_100000211621 [0,1,0,0,0,1|1,0,0]=3 7534 B18R2.270 Brc1ccc(cc1)OCCCc2ccccc2 7a_100000185759_100000211621 [0,1,0,0,0,1|1,0,0]=3 7535 B18R2.270 Brc1ccc(cc1)OCCNc2ccccc2 34a_100000106764_100000183278 [0,1,0,0,0,1|2,0,0]=4 7536 B18R2.270 Brc1ccc(cc1)OCCOc2ccccc2 34a_100000185759_100000184471 [0,1,0,0,0,1|2,0,0]=4 7537 B18R2.270 Brc1ccc(cc1)OCCOc2ccccc2 34a_100000210340_100000183278 [0,1,0,0,0,1|2,0,0]=4 7538 B18R2.270 Brc1ccc(cc1)OCCOc2ccccc2 7a_100000185759_100000184471 [0,1,0,0,0,1|2,0,0]=4 7539 B18R2.270 Brc1ccc(cc1)OCCOc2ccccc2 7a_100000210340_100000183278 [0,1,0,0,0,1|2,0,0]=4 7540 B18R2.270 Brc1ccc(cc1)OCCSc2ccccc2 34a_100000185759_100000246102 [0,1,0,0,0,1|2,0,0]=4 7541 B18R2.270 Brc1ccc(cc1)OCCSc2ccccc2 62a_100000183278_100000041952 [0,1,0,0,0,1|2,0,0]=4 7542 B18R2.270 Brc1ccc(cc1)OCCSc2ccccc2 62a_100000719477_100000183278 [0,1,0,0,0,1|2,0,0]=4 7543 B18R2.270 Brc1ccc(cc1)OCCSc2ccccc2 7a_100000185759_100000246102 [0,1,0,0,0,1|2,0,0]=4 7544 B18R2.270 Brc1ccc(cc1)OCOCc2ccccc2 34a_100000185759_100000763385 [0,1,0,0,0,1|0,0,0]=2 7545 B18R2.270 Brc1ccc(cc1)OCSCc2ccccc2 34a_100000185759_200011217039 [0,1,0,0,0,1|0,1,0]=3 7546 B18R2.270 Brc1ccc(cc1)SC/C=C/c2ccccc2 62a_100000752885_100016265936 [0,1,0,0,0,1|1,0,1]=4 7547 B18R2.270 Brc1ccc(cc1)SC/C=C/c2ccccc2 62a_100016265936_100000752885 [0,1,0,0,0,1|1,0,1]=4 7548 B18R2.270 Brc1ccc(cc1)SCC#Cc2ccccc2 62a_100000752885_100011352542 [0,1,0,0,0,1|1,0,1]=4 7549 B18R2.270 Brc1ccc(cc1)SCCCc2ccccc2 62a_100000211621_100000752885 [0,1,0,0,0,1|1,0,0]=3 7550 B18R2.270 Brc1ccc(cc1)SCCCc2ccccc2 62a_100000752885_100000211621 [0,1,0,0,0,1|1,0,0]=3 7551 B18R2.270 Brc1ccc(cc1)SCCOc2ccccc2 62a_100000184471_100000752885 [0,1,0,0,0,1|2,0,0]=4 7552 B18R2.270 Brc1ccc(cc1)SCCOc2ccccc2 62a_100000752885_100000184471 [0,1,0,0,0,1|2,0,0]=4 7553 B18R2.270 Brc1ccc(cc1)SCCSc2ccccc2 62a_100000246102_100000752885 [0,1,0,0,0,1|2,0,0]=4 7554 B18R2.270 Brc1ccc(cc1)SCCSc2ccccc2 62a_100000752885_100000246102 [0,1,0,0,0,1|2,0,0]=4 7555 B18R2.270 Brc1ccc(cc1)SCOCc2ccccc2 62a_100000752885_100000763385 [0,1,0,0,0,1|0,0,0]=2 7556 B18R2.270 Brc1ccc(cc1)SCOCc2ccccc2 62a_100000763385_100000752885 [0,1,0,0,0,1|0,0,0]=2 7557 B18R2.270 Brc1ccc(cc1)SCSCc2ccccc2 62a_100000752885_200011217039 [0,1,0,0,0,1|0,1,0]=3 7558 B18R2.270 Brc1ccc(cc1)SCSCc2ccccc2 62a_200011217039_100000752885 [0,1,0,0,0,1|0,1,0]=3 7559 B18R2.270 Brc1ccc(cn1)CNCCc2ccccc2 2230a_100000106460_100009831999 [0,1,0,0,0,1|2,0,0]=4 7560 B18R2.270 Brc1ccc(cn1)CNCCc2ccccc2 2230a_100009817727_100000765856 [0,1,0,0,0,1|2,0,0]=4 7561 B18R2.270 Brc1ccc(cn1)CNCCc2ccccc2 34a_100000106460_100009831999 [0,1,0,0,0,1|2,0,0]=4 7562 B18R2.270 Brc1ccc(cn1)CNCCc2ccccc2 34a_100009817727_100000765856 [0,1,0,0,0,1|2,0,0]=4 7563 B18R2.270 Brc1ccc(cn1)CNCSc2ccccc2 2230a_100009817727_100011218342 [0,1,0,0,0,1|2,0,0]=4 7564 B18R2.270 Brc1ccc(cn1)COCCc2ccccc2 34a_100000210268_100009831999 [0,1,0,0,0,1|1,0,0]=3 7565 B18R2.270 Brc1ccc(cn1)COCCc2ccccc2 34a_100009816760_100000765856 [0,1,0,0,0,1|1,0,0]=3 7566 B18R2.270 Brc1ccc(cn1)COCCc2ccccc2 7a_100000210268_100009831999 [0,1,0,0,0,1|1,0,0]=3 7567 B18R2.270 Brc1ccc(cn1)COCCc2ccccc2 7a_100009816760_100000765856 [0,1,0,0,0,1|1,0,0]=3 7568 B18R2.270 Brc1ccc(cn1)COCCc2ccccn2 34a_100000210271_100009831999 [0,1,0,0,0,1|2,0,0]=4 7569 B18R2.270 Brc1ccc(cn1)COCCc2ccccn2 7a_100009816760_100015183660 [0,1,0,0,0,1|2,0,0]=4 7570 B18R2.270 Brc1ccc(cn1)COCCc2cccnc2 34a_100011217484_100009831999 [0,1,0,0,0,1|2,0,0]=4 7571 B18R2.270 Brc1ccc(cn1)COCCc2cccnc2 7a_100009816760_200011713674 [0,1,0,0,0,1|2,0,0]=4 7572 B18R2.270 Brc1ccc(cn1)COCCc2ccncc2 34a_100011216225_100009831999 [0,1,0,0,0,1|2,0,0]=4 7573 B18R2.270 Brc1ccc(cn1)COCCc2ccncc2 7a_100009816760_100000723409 [0,1,0,0,0,1|2,0,0]=4 7574 B18R2.270 Brc1ccc(cn1)CSCCc2ccccc2 62a_100000765856_100009831999 [0,1,0,0,0,1|1,1,0]=4 7575 B18R2.270 Brc1ccc(cn1)CSCCc2ccccc2 62a_100009831999_100011218657 [0,1,0,0,0,1|1,1,0]=4 7576 B18R2.270 Brc1ccc(cn1)CSCSc2ccccc2 62a_100009831999_100011218342 [0,1,0,0,0,1|1,1,0]=4 7577 B18R2.270 Brc1ccc(cn1)CSCSc2ccccc2 62a_100011218342_100009831999 [0,1,0,0,0,1|1,1,0]=4 7578 B18R2.270 Brc1ccc(cn1)OCCCc2ccccc2 34a_100000685995_100000211621 [0,1,0,0,0,1|2,0,0]=4 7579 B18R2.270 Brc1ccc(cn1)OCCCc2ccccc2 7a_100000685995_100000211621 [0,1,0,0,0,1|2,0,0]=4 7580 B18R2.270 Brc1ccc(cn1)OCOCc2ccccc2 34a_100000685995_100000763385 [0,1,0,0,0,1|1,0,0]=3 7581 B18R2.270 Brc1ccc(cn1)OCSCc2ccccc2 34a_100000685995_200011217039 [0,1,0,0,0,1|1,1,0]=4 7582 B18R2.270 Brc1ccc(cn1)SCCCc2ccccc2 62a_100000211621_100009814638 [0,1,0,0,0,1|2,0,0]=4 7583 B18R2.270 Brc1ccc(cn1)SCCCc2ccccc2 62a_100009814638_100000211621 [0,1,0,0,0,1|2,0,0]=4 7584 B18R2.270 Brc1ccc(cn1)SCOCc2ccccc2 62a_100000763385_100009814638 [0,1,0,0,0,1|1,0,0]=3 7585 B18R2.270 Brc1ccc(cn1)SCOCc2ccccc2 62a_100009814638_100000763385 [0,1,0,0,0,1|1,0,0]=3 7586 B18R2.270 Brc1ccc(cn1)SCSCc2ccccc2 62a_100009814638_200011217039 [0,1,0,0,0,1|1,1,0]=4 7587 B18R2.270 Brc1ccc(cn1)SCSCc2ccccc2 62a_200011217039_100009814638 [0,1,0,0,0,1|1,1,0]=4 7588 B18R2.270 Brc1ccc(nc1)CCOCc2ccccc2 34a_100012357577_100015291786 [0,1,0,0,0,1|1,0,0]=3 7589 B18R2.270 Brc1ccc(nc1)CCOCc2ccccn2 34a_100012357577_100000721315 [0,1,0,0,0,1|2,0,0]=4 7590 B18R2.270 Brc1ccc(nc1)CCOCc2cccnc2 34a_100012357577_100000733263 [0,1,0,0,0,1|2,0,0]=4 7591 B18R2.270 Brc1ccc(nc1)CNCCc2ccccc2 207a_100000106460_100000754260 [0,1,0,0,0,1|2,0,0]=4 7592 B18R2.270 Brc1ccc(nc1)CNCCc2ccccc2 2230a_100000106460_100000702658 [0,1,0,0,0,1|2,0,0]=4 7593 B18R2.270 Brc1ccc(nc1)CNCCc2ccccc2 270004a_100000106460_100000754260 [0,1,0,0,0,1|2,0,0]=4 7594 B18R2.270 Brc1ccc(nc1)CNCCc2ccccc2 34a_100000106460_100000702658 [0,1,0,0,0,1|2,0,0]=4 7595 B18R2.270 Brc1ccc(nc1)CNCCc2ccccc2 34a_100015188789_100000765856 [0,1,0,0,0,1|2,0,0]=4 7596 B18R2.270 Brc1ccc(nc1)COCCc2ccccc2 34a_100000210268_100000702658 [0,1,0,0,0,1|1,0,0]=3 7597 B18R2.270 Brc1ccc(nc1)COCCc2ccccc2 34a_100000754261_100000765856 [0,1,0,0,0,1|1,0,0]=3 7598 B18R2.270 Brc1ccc(nc1)COCCc2ccccc2 7a_100000210268_100000702658 [0,1,0,0,0,1|1,0,0]=3 7599 B18R2.270 Brc1ccc(nc1)COCCc2ccccn2 34a_100000210271_100000702658 [0,1,0,0,0,1|2,0,0]=4 7600 B18R2.270 Brc1ccc(nc1)COCCc2cccnc2 34a_100011217484_100000702658 [0,1,0,0,0,1|2,0,0]=4 7601 B18R2.270 Brc1ccc(nc1)COCCc2ccncc2 34a_100011216225_100000702658 [0,1,0,0,0,1|2,0,0]=4 7602 B18R2.270 Brc1ccc(nc1)CSCCc2ccccc2 62a_100000702658_100011218657 [0,1,0,0,0,1|1,1,0]=4 7603 B18R2.270 Brc1ccc(nc1)CSCCc2ccccc2 62a_100000765856_100000702658 [0,1,0,0,0,1|1,1,0]=4 7604 B18R2.270 Brc1ccc(nc1)CSCSc2ccccc2 62a_100000702658_100011218342 [0,1,0,0,0,1|1,1,0]=4 7605 B18R2.270 Brc1ccc(nc1)CSCSc2ccccc2 62a_100011218342_100000702658 [0,1,0,0,0,1|1,1,0]=4 7606 B18R2.270 Brc1ccc(nc1)NCCCc2ccccc2 27a_100000211184_100000686858 [0,1,0,0,0,1|2,0,0]=4 7607 B18R2.270 Brc1ccc(nc1)SCCCc2ccccc2 62a_100000211621_100000686858 [0,1,0,0,0,1|2,0,0]=4 7608 B18R2.270 Brc1ccc(nc1)SCCCc2ccccc2 62a_100000686858_100000211621 [0,1,0,0,0,1|2,0,0]=4 7609 B18R2.270 Brc1ccc(nc1)SCOCc2ccccc2 62a_100000686858_100000763385 [0,1,0,0,0,1|1,0,0]=3 7610 B18R2.270 Brc1ccc(nc1)SCOCc2ccccc2 62a_100000763385_100000686858 [0,1,0,0,0,1|1,0,0]=3 7611 B18R2.270 Brc1ccc(nc1)SCSCc2ccccc2 62a_100000686858_200011217039 [0,1,0,0,0,1|1,1,0]=4 7612 B18R2.270 Brc1ccc(nc1)SCSCc2ccccc2 62a_200011217039_100000686858 [0,1,0,0,0,1|1,1,0]=4 7613 B18R2.270 Brc1cnc(cn1)OCOCc2ccccc2 34a_100011934580_100000763385 [0,1,0,0,0,1|2,0,0]=4 7614 B18R2.270 Brc1cnc(cn1)SCOCc2ccccc2 62a_100000763385_100010187541 [0,1,0,0,0,1|2,0,0]=4 7615 B18R2.270 Brc1cnc(cn1)SCOCc2ccccc2 62a_100010187541_100000763385 [0,1,0,0,0,1|2,0,0]=4 7616 B18R2.270 Brc1cnc(nc1)COCCc2ccccc2 34a_100000210268_100010064664 [0,1,0,0,0,1|2,0,0]=4 7617 B18R2.270 Brc1cnc(nc1)COCCc2ccccc2 7a_100000210268_100010064664 [0,1,0,0,0,1|2,0,0]=4 7618 B18R2.270 Brc1cnc(nc1)SCOCc2ccccc2 62a_100000690281_100000763385 [0,1,0,0,0,1|2,0,0]=4 7619 B18R2.270 Brc1cnc(nc1)SCOCc2ccccc2 62a_100000763385_100000690281 [0,1,0,0,0,1|2,0,0]=4 7620 B18R2.270 Brc1ncc(cn1)OCOCc2ccccc2 34a_100000730009_100000763385 [0,1,0,0,0,1|2,0,0]=4 7621 B18R2.270 Brc1ncc(cn1)SCOCc2ccccc2 62a_100000763385_200012349914 [0,1,0,0,0,1|2,0,0]=4 7622 B18R2.270 Brc1ncc(cn1)SCOCc2ccccc2 62a_200012349914_100000763385 [0,1,0,0,0,1|2,0,0]=4 7623 B18R2.270 C[n+]1ccc(cc1)COCCc2ccccc2 34a_100009831711_100000765856 [0,1,0,0,0,1|1,0,0]=3 7624 B18R2.270 Cc1ccc(cc1)C=NNCc2ccccc2 4a_100000007032_100000211033 [0,1,0,0,0,1|1,0,1]=4 7625 B18R2.270 Cc1ccc(cc1)CC=NNc2ccccc2 4a_100015195140_100011361684 [0,1,0,0,0,1|2,0,0]=4 7626 B18R2.270 Cc1ccc(cc1)CCNCc2ccccc2 207a_100000705350_100015611070 [0,1,0,0,0,1|1,0,0]=3 7627 B18R2.270 Cc1ccc(cc1)CCNCc2ccccc2 2230a_100000705350_100015291786 [0,1,0,0,0,1|1,0,0]=3 7628 B18R2.270 Cc1ccc(cc1)CCNCc2ccccc2 2230a_100015324214_100011713686 [0,1,0,0,0,1|1,0,0]=3 7629 B18R2.270 Cc1ccc(cc1)CCNCc2ccccc2 270004a_100000705350_100015611070 [0,1,0,0,0,1|1,0,0]=3 7630 B18R2.270 Cc1ccc(cc1)CCNCc2ccccc2 34a_100000705350_100015291786 [0,1,0,0,0,1|1,0,0]=3 7631 B18R2.270 Cc1ccc(cc1)CCNCc2ccccc2 34a_100015324214_100011713686 [0,1,0,0,0,1|1,0,0]=3 7632 B18R2.270 Cc1ccc(cc1)CCNCc2ccccn2 207a_100000705350_100000209966 [0,1,0,0,0,1|2,0,0]=4 7633 B18R2.270 Cc1ccc(cc1)CCNCc2ccccn2 2230a_100000705350_100000721315 [0,1,0,0,0,1|2,0,0]=4 7634 B18R2.270 Cc1ccc(cc1)CCNCc2ccccn2 270004a_100000705350_100000209966 [0,1,0,0,0,1|2,0,0]=4 7635 B18R2.270 Cc1ccc(cc1)CCNCc2ccccn2 34a_100000705350_100000721315 [0,1,0,0,0,1|2,0,0]=4 7636 B18R2.270 Cc1ccc(cc1)CCNCc2cccnc2 207a_100000705350_100000209961 [0,1,0,0,0,1|2,0,0]=4 7637 B18R2.270 Cc1ccc(cc1)CCNCc2cccnc2 2230a_100000705350_100000741622 [0,1,0,0,0,1|2,0,0]=4 7638 B18R2.270 Cc1ccc(cc1)CCNCc2cccnc2 270004a_100000705350_100000209961 [0,1,0,0,0,1|2,0,0]=4 7639 B18R2.270 Cc1ccc(cc1)CCNCc2cccnc2 34a_100000705350_100000733263 [0,1,0,0,0,1|2,0,0]=4 7640 B18R2.270 Cc1ccc(cc1)CCNCc2ccncc2 207a_100000705350_100000186114 [0,1,0,0,0,1|2,0,0]=4 7641 B18R2.270 Cc1ccc(cc1)CCNCc2ccncc2 2230a_100000705350_100015193705 [0,1,0,0,0,1|2,0,0]=4 7642 B18R2.270 Cc1ccc(cc1)CCOCc2ccccc2 34a_100000210790_100011713686 [0,1,0,0,0,1|0,0,0]=2 7643 B18R2.270 Cc1ccc(cc1)CCOCc2ccccc2 34a_100000756670_100015291786 [0,1,0,0,0,1|0,0,0]=2 7644 B18R2.270 Cc1ccc(cc1)CCOCc2ccccc2 7a_100000210790_100011713686 [0,1,0,0,0,1|0,0,0]=2 7645 B18R2.270 Cc1ccc(cc1)CCOCc2ccccc2 7a_100000756670_100000211182 [0,1,0,0,0,1|0,0,0]=2 7646 B18R2.270 Cc1ccc(cc1)CCOCc2ccccn2 34a_100000756670_100000721315 [0,1,0,0,0,1|1,0,0]=3 7647 B18R2.270 Cc1ccc(cc1)CCOCc2ccccn2 7a_100000756670_100000721315 [0,1,0,0,0,1|1,0,0]=3 7648 B18R2.270 Cc1ccc(cc1)CCOCc2cccnc2 34a_100000756670_100000733263 [0,1,0,0,0,1|1,0,0]=3 7649 B18R2.270 Cc1ccc(cc1)CCOCc2cccnc2 7a_100000756670_100000741622 [0,1,0,0,0,1|1,0,0]=3 7650 B18R2.270 Cc1ccc(cc1)CCOCc2cccnn2 34a_100000756670_100016990269 [0,1,0,0,0,1|2,0,0]=4 7651 B18R2.270 Cc1ccc(cc1)CCOCc2cccnn2 7a_100000756670_100016990269 [0,1,0,0,0,1|2,0,0]=4 7652 B18R2.270 Cc1ccc(cc1)CCOCc2ccncc2 7a_100000756670_100015193705 [0,1,0,0,0,1|1,0,0]=3 7653 B18R2.270 Cc1ccc(cc1)CCOCc2cnccn2 34a_100000756670_100016995436 [0,1,0,0,0,1|2,0,0]=4 7654 B18R2.270 Cc1ccc(cc1)CCOCc2cnccn2 7a_100000756670_100016995436 [0,1,0,0,0,1|2,0,0]=4 7655 B18R2.270 Cc1ccc(cc1)CCOCc2cncnc2 34a_100000756670_100015196519 [0,1,0,0,0,1|2,0,0]=4 7656 B18R2.270 Cc1ccc(cc1)CCOCc2cncnc2 7a_100000756670_100015196519 [0,1,0,0,0,1|2,0,0]=4 7657 B18R2.270 Cc1ccc(cc1)CCOCc2ncccn2 34a_100000756670_100000703007 [0,1,0,0,0,1|2,0,0]=4 7658 B18R2.270 Cc1ccc(cc1)CCOCc2ncccn2 7a_100000756670_100000703007 [0,1,0,0,0,1|2,0,0]=4 7659 B18R2.270 Cc1ccc(cc1)CCSCc2ccccc2 62a_100000211182_100011713686 [0,1,0,0,0,1|0,1,0]=3 7660 B18R2.270 Cc1ccc(cc1)CCSCc2ccccc2 62a_100011713686_100015291786 [0,1,0,0,0,1|0,1,0]=3 7661 B18R2.270 Cc1ccc(cc1)CCSCc2ccccn2 62a_100000721315_100011713686 [0,1,0,0,0,1|1,1,0]=4 7662 B18R2.270 Cc1ccc(cc1)CCSCc2ccccn2 62a_100011713686_100000721315 [0,1,0,0,0,1|1,1,0]=4 7663 B18R2.270 Cc1ccc(cc1)CCSCc2cccnc2 62a_100000741622_100011713686 [0,1,0,0,0,1|1,1,0]=4 7664 B18R2.270 Cc1ccc(cc1)CCSCc2cccnc2 62a_100011713686_100000741622 [0,1,0,0,0,1|1,1,0]=4 7665 B18R2.270 Cc1ccc(cc1)CCSCc2ccncc2 62a_100011713686_100015193705 [0,1,0,0,0,1|1,1,0]=4 7666 B18R2.270 Cc1ccc(cc1)CCSCc2ccncc2 62a_100015193705_100011713686 [0,1,0,0,0,1|1,1,0]=4 7667 B18R2.270 Cc1ccc(cc1)CNCCc2ccccc2 207a_100000106460_100000211033 [0,1,0,0,0,1|1,0,0]=3 7668 B18R2.270 Cc1ccc(cc1)CNCCc2ccccc2 2230a_100000106460_100000210814 [0,1,0,0,0,1|1,0,0]=3 7669 B18R2.270 Cc1ccc(cc1)CNCCc2ccccc2 2230a_100000174908_100000765856 [0,1,0,0,0,1|1,0,0]=3 7670 B18R2.270 Cc1ccc(cc1)CNCCc2ccccc2 270004a_100000106460_100000211033 [0,1,0,0,0,1|1,0,0]=3 7671 B18R2.270 Cc1ccc(cc1)CNCCc2ccccc2 34a_100000106460_100000210814 [0,1,0,0,0,1|1,0,0]=3 7672 B18R2.270 Cc1ccc(cc1)CNCCc2ccccc2 34a_100000174908_100000765856 [0,1,0,0,0,1|1,0,0]=3 7673 B18R2.270 Cc1ccc(cc1)CNCCc2ccccn2 207a_100000211156_100000211033 [0,1,0,0,0,1|2,0,0]=4 7674 B18R2.270 Cc1ccc(cc1)CNCCc2ccccn2 2230a_100000174908_100015183660 [0,1,0,0,0,1|2,0,0]=4 7675 B18R2.270 Cc1ccc(cc1)CNCCc2ccccn2 270004a_100000211156_100000211033 [0,1,0,0,0,1|2,0,0]=4 7676 B18R2.270 Cc1ccc(cc1)CNCCc2cccnc2 207a_100000736294_100000211033 [0,1,0,0,0,1|2,0,0]=4 7677 B18R2.270 Cc1ccc(cc1)CNCCc2cccnc2 2230a_100000174908_200011713674 [0,1,0,0,0,1|2,0,0]=4 7678 B18R2.270 Cc1ccc(cc1)CNCCc2cccnc2 2230a_100000736294_100000210814 [0,1,0,0,0,1|2,0,0]=4 7679 B18R2.270 Cc1ccc(cc1)CNCCc2cccnc2 270004a_100000736294_100000211033 [0,1,0,0,0,1|2,0,0]=4 7680 B18R2.270 Cc1ccc(cc1)CNCCc2ccncc2 207a_100000742849_100000211033 [0,1,0,0,0,1|2,0,0]=4 7681 B18R2.270 Cc1ccc(cc1)CNCCc2ccncc2 2230a_100000174908_100000723409 [0,1,0,0,0,1|2,0,0]=4 7682 B18R2.270 Cc1ccc(cc1)CNCCc2ccncc2 270004a_100000742849_100000211033 [0,1,0,0,0,1|2,0,0]=4 7683 B18R2.270 Cc1ccc(cc1)CNCSc2ccccc2 2230a_100000174908_100011218342 [0,1,0,0,0,1|1,0,0]=3 7684 B18R2.270 Cc1ccc(cc1)CNN=Cc2ccccc2 4a_100011197965_100015611070 [0,1,0,0,0,1|1,0,1]=4 7685 B18R2.270 Cc1ccc(cc1)COCCc2ccccc2 34a_100000210268_100000210814 [0,1,0,0,0,1|0,0,0]=2 7686 B18R2.270 Cc1ccc(cc1)COCCc2ccccc2 34a_100011215236_100000765856 [0,1,0,0,0,1|0,0,0]=2 7687 B18R2.270 Cc1ccc(cc1)COCCc2ccccc2 7a_100000210268_100000210814 [0,1,0,0,0,1|0,0,0]=2 7688 B18R2.270 Cc1ccc(cc1)COCCc2ccccc2 7a_100011215236_100000765856 [0,1,0,0,0,1|0,0,0]=2 7689 B18R2.270 Cc1ccc(cc1)COCCc2ccccn2 34a_100000210271_100000210814 [0,1,0,0,0,1|1,0,0]=3 7690 B18R2.270 Cc1ccc(cc1)COCCc2ccccn2 7a_100011215236_100015183660 [0,1,0,0,0,1|1,0,0]=3 7691 B18R2.270 Cc1ccc(cc1)COCCc2cccnc2 34a_100011217484_100000210814 [0,1,0,0,0,1|1,0,0]=3 7692 B18R2.270 Cc1ccc(cc1)COCCc2cccnc2 7a_100011215236_200011713674 [0,1,0,0,0,1|1,0,0]=3 7693 B18R2.270 Cc1ccc(cc1)COCCc2ccncc2 34a_100011216225_100000210814 [0,1,0,0,0,1|1,0,0]=3 7694 B18R2.270 Cc1ccc(cc1)COCCc2ccncc2 7a_100011215236_100000723409 [0,1,0,0,0,1|1,0,0]=3 7695 B18R2.270 Cc1ccc(cc1)COCCc2cnccn2 34a_100011349526_100000210814 [0,1,0,0,0,1|2,0,0]=4 7696 B18R2.270 Cc1ccc(cc1)COCCc2cncnc2 34a_100011709255_100000210814 [0,1,0,0,0,1|2,0,0]=4 7697 B18R2.270 Cc1ccc(cc1)CSCCc2ccccc2 62a_100000210814_100011218657 [0,1,0,0,0,1|0,1,0]=3 7698 B18R2.270 Cc1ccc(cc1)CSCCc2ccccc2 62a_100000765856_100000210814 [0,1,0,0,0,1|0,1,0]=3 7699 B18R2.270 Cc1ccc(cc1)CSCCc2ccccn2 62a_100000210814_100015183660 [0,1,0,0,0,1|1,1,0]=4 7700 B18R2.270 Cc1ccc(cc1)CSCCc2ccccn2 62a_100015183660_100000210814 [0,1,0,0,0,1|1,1,0]=4 7701 B18R2.270 Cc1ccc(cc1)CSCCc2cccnc2 62a_100000210814_200011713674 [0,1,0,0,0,1|1,1,0]=4 7702 B18R2.270 Cc1ccc(cc1)CSCCc2cccnc2 62a_200011713674_100000210814 [0,1,0,0,0,1|1,1,0]=4 7703 B18R2.270 Cc1ccc(cc1)CSCCc2ccncc2 62a_100000210814_100000723409 [0,1,0,0,0,1|1,1,0]=4 7704 B18R2.270 Cc1ccc(cc1)CSCCc2ccncc2 62a_100000723409_100000210814 [0,1,0,0,0,1|1,1,0]=4 7705 B18R2.270 Cc1ccc(cc1)CSCSc2ccccc2 62a_100000210814_100011218342 [0,1,0,0,0,1|0,1,0]=3 7706 B18R2.270 Cc1ccc(cc1)CSCSc2ccccc2 62a_100011218342_100000210814 [0,1,0,0,0,1|0,1,0]=3 7707 B18R2.270 Cc1ccc(cc1)NC/C=C/c2ccccc2 34a_100000124888_100016265936 [0,1,0,0,0,1|1,0,1]=4 7708 B18R2.270 Cc1ccc(cc1)NCC#Cc2ccccc2 34a_100000124888_100011352542 [0,1,0,0,0,1|1,0,1]=4 7709 B18R2.270 Cc1ccc(cc1)NCCCc2ccccc2 34a_100000124888_100000211621 [0,1,0,0,0,1|1,0,0]=3 7710 B18R2.270 Cc1ccc(cc1)NCCOc2ccccc2 34a_100000124888_100000184471 [0,1,0,0,0,1|2,0,0]=4 7711 B18R2.270 Cc1ccc(cc1)NCCSc2ccccc2 34a_100000124888_100000246102 [0,1,0,0,0,1|2,0,0]=4 7712 B18R2.270 Cc1ccc(cc1)NCOCc2ccccc2 34a_100000124888_100000763385 [0,1,0,0,0,1|0,0,0]=2 7713 B18R2.270 Cc1ccc(cc1)NCSCc2ccccc2 34a_100000124888_200011217039 [0,1,0,0,0,1|0,1,0]=3 7714 B18R2.270 Cc1ccc(cc1)NN=CCc2ccccc2 4a_100000683527_100000209964 [0,1,0,0,0,1|2,0,0]=4 7715 B18R2.270 Cc1ccc(cc1)OC/C=C/c2ccccc2 34a_100000210336_100016265936 [0,1,0,0,0,1|1,0,1]=4 7716 B18R2.270 Cc1ccc(cc1)OC/C=C/c2ccccc2 7a_100000210336_100016265936 [0,1,0,0,0,1|1,0,1]=4 7717 B18R2.270 Cc1ccc(cc1)OCC#Cc2ccccc2 34a_100000210336_100011352542 [0,1,0,0,0,1|1,0,1]=4 7718 B18R2.270 Cc1ccc(cc1)OCC#Cc2ccccc2 7a_100000210336_100011352542 [0,1,0,0,0,1|1,0,1]=4 7719 B18R2.270 Cc1ccc(cc1)OCCCc2ccccc2 34a_100000210336_100000211621 [0,1,0,0,0,1|1,0,0]=3 7720 B18R2.270 Cc1ccc(cc1)OCCCc2ccccc2 7a_100000210336_100000211621 [0,1,0,0,0,1|1,0,0]=3 7721 B18R2.270 Cc1ccc(cc1)OCCNc2ccccc2 34a_100000106764_100000183172 [0,1,0,0,0,1|2,0,0]=4 7722 B18R2.270 Cc1ccc(cc1)OCCOc2ccccc2 34a_100000210336_100000184471 [0,1,0,0,0,1|2,0,0]=4 7723 B18R2.270 Cc1ccc(cc1)OCCOc2ccccc2 34a_100000210340_100000183172 [0,1,0,0,0,1|2,0,0]=4 7724 B18R2.270 Cc1ccc(cc1)OCCOc2ccccc2 7a_100000210336_100000184471 [0,1,0,0,0,1|2,0,0]=4 7725 B18R2.270 Cc1ccc(cc1)OCCOc2ccccc2 7a_100000210340_100000183172 [0,1,0,0,0,1|2,0,0]=4 7726 B18R2.270 Cc1ccc(cc1)OCCSc2ccccc2 34a_100000210336_100000246102 [0,1,0,0,0,1|2,0,0]=4 7727 B18R2.270 Cc1ccc(cc1)OCCSc2ccccc2 62a_100000183172_100000041952 [0,1,0,0,0,1|2,0,0]=4 7728 B18R2.270 Cc1ccc(cc1)OCCSc2ccccc2 62a_100000719477_100000183172 [0,1,0,0,0,1|2,0,0]=4 7729 B18R2.270 Cc1ccc(cc1)OCCSc2ccccc2 7a_100000210336_100000246102 [0,1,0,0,0,1|2,0,0]=4 7730 B18R2.270 Cc1ccc(cc1)OCOCc2ccccc2 34a_100000210336_100000763385 [0,1,0,0,0,1|0,0,0]=2 7731 B18R2.270 Cc1ccc(cc1)OCSCc2ccccc2 34a_100000210336_200011217039 [0,1,0,0,0,1|0,1,0]=3 7732 B18R2.270 Cc1ccc(cc1)SC/C=C/c2ccccc2 62a_100000186775_100016265936 [0,1,0,0,0,1|1,0,1]=4 7733 B18R2.270 Cc1ccc(cc1)SC/C=C/c2ccccc2 62a_100016265936_100000186775 [0,1,0,0,0,1|1,0,1]=4 7734 B18R2.270 Cc1ccc(cc1)SCC#Cc2ccccc2 62a_100000186775_100011352542 [0,1,0,0,0,1|1,0,1]=4 7735 B18R2.270 Cc1ccc(cc1)SCCCc2ccccc2 62a_100000186775_100000211621 [0,1,0,0,0,1|1,0,0]=3 7736 B18R2.270 Cc1ccc(cc1)SCCCc2ccccc2 62a_100000211621_100000186775 [0,1,0,0,0,1|1,0,0]=3 7737 B18R2.270 Cc1ccc(cc1)SCCOc2ccccc2 62a_100000184471_100000186775 [0,1,0,0,0,1|2,0,0]=4 7738 B18R2.270 Cc1ccc(cc1)SCCOc2ccccc2 62a_100000186775_100000184471 [0,1,0,0,0,1|2,0,0]=4 7739 B18R2.270 Cc1ccc(cc1)SCCSc2ccccc2 62a_100000186775_100000246102 [0,1,0,0,0,1|2,0,0]=4 7740 B18R2.270 Cc1ccc(cc1)SCCSc2ccccc2 62a_100000246102_100000186775 [0,1,0,0,0,1|2,0,0]=4 7741 B18R2.270 Cc1ccc(cc1)SCOCc2ccccc2 62a_100000186775_100000763385 [0,1,0,0,0,1|0,0,0]=2 7742 B18R2.270 Cc1ccc(cc1)SCOCc2ccccc2 62a_100000763385_100000186775 [0,1,0,0,0,1|0,0,0]=2 7743 B18R2.270 Cc1ccc(cc1)SCSCc2ccccc2 62a_100000186775_200011217039 [0,1,0,0,0,1|0,1,0]=3 7744 B18R2.270 Cc1ccc(cc1)SCSCc2ccccc2 62a_200011217039_100000186775 [0,1,0,0,0,1|0,1,0]=3 7745 B18R2.270 Cc1ccc(cn1)CCOCc2ccccc2 34a_100011815783_100015291786 [0,1,0,0,0,1|1,0,0]=3 7746 B18R2.270 Cc1ccc(cn1)CCOCc2ccccn2 34a_100011815783_100000721315 [0,1,0,0,0,1|2,0,0]=4 7747 B18R2.270 Cc1ccc(cn1)CCOCc2cccnc2 34a_100011815783_100000733263 [0,1,0,0,0,1|2,0,0]=4 7748 B18R2.270 Cc1ccc(cn1)CNCCc2ccccc2 2230a_100000106460_100016987292 [0,1,0,0,0,1|2,0,0]=4 7749 B18R2.270 Cc1ccc(cn1)CNCCc2ccccc2 270004a_100000106460_100000743784 [0,1,0,0,0,1|2,0,0]=4 7750 B18R2.270 Cc1ccc(cn1)CNCCc2ccccc2 34a_100000106460_100016987292 [0,1,0,0,0,1|2,0,0]=4 7751 B18R2.270 Cc1ccc(cn1)CNCCc2ccccc2 34a_100000740942_100000765856 [0,1,0,0,0,1|2,0,0]=4 7752 B18R2.270 Cc1ccc(cn1)COCCc2ccccc2 34a_100000210268_100016987292 [0,1,0,0,0,1|1,0,0]=3 7753 B18R2.270 Cc1ccc(cn1)COCCc2ccccc2 34a_100011248133_100000765856 [0,1,0,0,0,1|1,0,0]=3 7754 B18R2.270 Cc1ccc(cn1)COCCc2ccccc2 7a_100000210268_100016987292 [0,1,0,0,0,1|1,0,0]=3 7755 B18R2.270 Cc1ccc(cn1)COCCc2ccccn2 34a_100000210271_100016987292 [0,1,0,0,0,1|2,0,0]=4 7756 B18R2.270 Cc1ccc(cn1)COCCc2cccnc2 34a_100011217484_100016987292 [0,1,0,0,0,1|2,0,0]=4 7757 B18R2.270 Cc1ccc(cn1)COCCc2ccncc2 34a_100011216225_100016987292 [0,1,0,0,0,1|2,0,0]=4 7758 B18R2.270 Cc1ccc(cn1)CSCCc2ccccc2 62a_100000765856_100016987292 [0,1,0,0,0,1|1,1,0]=4 7759 B18R2.270 Cc1ccc(cn1)CSCCc2ccccc2 62a_100016987292_100011218657 [0,1,0,0,0,1|1,1,0]=4 7760 B18R2.270 Cc1ccc(cn1)CSCSc2ccccc2 62a_100011218342_100016987292 [0,1,0,0,0,1|1,1,0]=4 7761 B18R2.270 Cc1ccc(cn1)CSCSc2ccccc2 62a_100016987292_100011218342 [0,1,0,0,0,1|1,1,0]=4 7762 B18R2.270 Cc1ccc(cn1)OCCCc2ccccc2 34a_100000745506_100000211621 [0,1,0,0,0,1|2,0,0]=4 7763 B18R2.270 Cc1ccc(cn1)OCCCc2ccccc2 7a_100000745506_100000211621 [0,1,0,0,0,1|2,0,0]=4 7764 B18R2.270 Cc1ccc(cn1)OCOCc2ccccc2 34a_100000745506_100000763385 [0,1,0,0,0,1|1,0,0]=3 7765 B18R2.270 Cc1ccc(cn1)OCSCc2ccccc2 34a_100000745506_200011217039 [0,1,0,0,0,1|1,1,0]=4 7766 B18R2.270 Cc1ccc(cn1)SCCCc2ccccc2 62a_100000211621_100000751577 [0,1,0,0,0,1|2,0,0]=4 7767 B18R2.270 Cc1ccc(cn1)SCCCc2ccccc2 62a_100000751577_100000211621 [0,1,0,0,0,1|2,0,0]=4 7768 B18R2.270 Cc1ccc(cn1)SCOCc2ccccc2 62a_100000751577_100000763385 [0,1,0,0,0,1|1,0,0]=3 7769 B18R2.270 Cc1ccc(cn1)SCOCc2ccccc2 62a_100000763385_100000751577 [0,1,0,0,0,1|1,0,0]=3 7770 B18R2.270 Cc1ccc(cn1)SCSCc2ccccc2 62a_100000751577_200011217039 [0,1,0,0,0,1|1,1,0]=4 7771 B18R2.270 Cc1ccc(cn1)SCSCc2ccccc2 62a_200011217039_100000751577 [0,1,0,0,0,1|1,1,0]=4 7772 B18R2.270 Cc1ccc(nc1)CNCCc2ccccc2 207a_100000106460_100000050478 [0,1,0,0,0,1|2,0,0]=4 7773 B18R2.270 Cc1ccc(nc1)CNCCc2ccccc2 2230a_100000106460_100000691093 [0,1,0,0,0,1|2,0,0]=4 7774 B18R2.270 Cc1ccc(nc1)CNCCc2ccccc2 270004a_100000106460_100000050478 [0,1,0,0,0,1|2,0,0]=4 7775 B18R2.270 Cc1ccc(nc1)CNCCc2ccccc2 34a_100000106460_100000691093 [0,1,0,0,0,1|2,0,0]=4 7776 B18R2.270 Cc1ccc(nc1)CNCCc2ccccc2 34a_100015187455_100000765856 [0,1,0,0,0,1|2,0,0]=4 7777 B18R2.270 Cc1ccc(nc1)COCCc2ccccc2 34a_100000210268_100000691093 [0,1,0,0,0,1|1,0,0]=3 7778 B18R2.270 Cc1ccc(nc1)COCCc2ccccc2 34a_100012001401_100000765856 [0,1,0,0,0,1|1,0,0]=3 7779 B18R2.270 Cc1ccc(nc1)COCCc2ccccc2 7a_100000210268_100000691093 [0,1,0,0,0,1|1,0,0]=3 7780 B18R2.270 Cc1ccc(nc1)COCCc2ccccn2 34a_100000210271_100000691093 [0,1,0,0,0,1|2,0,0]=4 7781 B18R2.270 Cc1ccc(nc1)COCCc2cccnc2 34a_100011217484_100000691093 [0,1,0,0,0,1|2,0,0]=4 7782 B18R2.270 Cc1ccc(nc1)COCCc2ccncc2 34a_100011216225_100000691093 [0,1,0,0,0,1|2,0,0]=4 7783 B18R2.270 Cc1ccc(nc1)CSCCc2ccccc2 62a_100000691093_100011218657 [0,1,0,0,0,1|1,1,0]=4 7784 B18R2.270 Cc1ccc(nc1)CSCCc2ccccc2 62a_100000765856_100000691093 [0,1,0,0,0,1|1,1,0]=4 7785 B18R2.270 Cc1ccc(nc1)CSCSc2ccccc2 62a_100000691093_100011218342 [0,1,0,0,0,1|1,1,0]=4 7786 B18R2.270 Cc1ccc(nc1)CSCSc2ccccc2 62a_100011218342_100000691093 [0,1,0,0,0,1|1,1,0]=4 7787 B18R2.270 Cc1ccc(nc1)OCCCc2ccccc2 34a_100000759353_100000211621 [0,1,0,0,0,1|2,0,0]=4 7788 B18R2.270 Cc1ccc(nc1)OCOCc2ccccc2 34a_100000759353_100000763385 [0,1,0,0,0,1|1,0,0]=3 7789 B18R2.270 Cc1ccc(nc1)OCSCc2ccccc2 34a_100000759353_200011217039 [0,1,0,0,0,1|1,1,0]=4 7790 B18R2.270 Cc1ccc(nc1)SCCCc2ccccc2 62a_100000211621_100000754016 [0,1,0,0,0,1|2,0,0]=4 7791 B18R2.270 Cc1ccc(nc1)SCCCc2ccccc2 62a_100011192072_100000211621 [0,1,0,0,0,1|2,0,0]=4 7792 B18R2.270 Cc1ccc(nc1)SCOCc2ccccc2 62a_100000763385_100000754016 [0,1,0,0,0,1|1,0,0]=3 7793 B18R2.270 Cc1ccc(nc1)SCOCc2ccccc2 62a_100011192072_100000763385 [0,1,0,0,0,1|1,0,0]=3 7794 B18R2.270 Cc1ccc(nc1)SCSCc2ccccc2 62a_100011192072_200011217039 [0,1,0,0,0,1|1,1,0]=4 7795 B18R2.270 Cc1ccc(nc1)SCSCc2ccccc2 62a_200011217039_100000754016 [0,1,0,0,0,1|1,1,0]=4 7796 B18R2.270 Cc1ccc(nn1)SCOCc2ccccc2 62a_100000744512_100000763385 [0,1,0,0,0,1|2,0,0]=4 7797 B18R2.270 Cc1ccc(nn1)SCOCc2ccccc2 62a_100000763385_100000744512 [0,1,0,0,0,1|2,0,0]=4 7798 B18R2.270 Cc1cnc(cn1)COCCc2ccccc2 34a_100011273949_100000765856 [0,1,0,0,0,1|2,0,0]=4 7799 B18R2.270 Cc1cnc(cn1)COCCc2ccccc2 7a_100000210268_100000752025 [0,1,0,0,0,1|2,0,0]=4 7800 B18R2.270 Cc1cnc(cn1)SCOCc2ccccc2 62a_100000763385_100011999403 [0,1,0,0,0,1|2,0,0]=4 7801 B18R2.270 Cc1cnc(cn1)SCOCc2ccccc2 62a_100011999403_100000763385 [0,1,0,0,0,1|2,0,0]=4 7802 B18R2.270 Cc1cnc(nc1)COCCc2ccccc2 34a_100000210268_100000685645 [0,1,0,0,0,1|2,0,0]=4 7803 B18R2.270 Cc1cnc(nc1)COCCc2ccccc2 7a_100000210268_100000685645 [0,1,0,0,0,1|2,0,0]=4 7804 B18R2.270 Cc1cnc(nc1)SCOCc2ccccc2 62a_100000061069_100000763385 [0,1,0,0,0,1|2,0,0]=4 7805 B18R2.270 Cc1cnc(nc1)SCOCc2ccccc2 62a_100000763385_100000061069 [0,1,0,0,0,1|2,0,0]=4 7806 B18R2.270 Cc1ncc(cn1)COCCc2ccccc2 34a_100011746891_100000765856 [0,1,0,0,0,1|2,0,0]=4 7807 B18R2.270 Cc1ncc(cn1)OCOCc2ccccc2 34a_100000062939_100000763385 [0,1,0,0,0,1|2,0,0]=4 7808 B18R2.270 Cc1ncc(cn1)SCOCc2ccccc2 62a_100000686985_100000763385 [0,1,0,0,0,1|2,0,0]=4 7809 B18R2.270 Cc1ncc(cn1)SCOCc2ccccc2 62a_100000763385_100000686985 [0,1,0,0,0,1|2,0,0]=4 7810 B18R2.270 Clc1ccc(cc1)C=NNCc2ccccc2 4a_100000007032_100000189385 [0,1,0,0,0,1|1,0,1]=4 7811 B18R2.270 Clc1ccc(cc1)CC=NNc2ccccc2 4a_100015195140_100000730895 [0,1,0,0,0,1|2,0,0]=4 7812 B18R2.270 Clc1ccc(cc1)CCCNc2ccccc2 34a_100000106764_100000759440 [0,1,0,0,0,1|1,0,0]=3 7813 B18R2.270 Clc1ccc(cc1)CCCOc2ccccc2 34a_100000210340_100000759440 [0,1,0,0,0,1|1,0,0]=3 7814 B18R2.270 Clc1ccc(cc1)CCCOc2ccccc2 7a_100000210340_100000759440 [0,1,0,0,0,1|1,0,0]=3 7815 B18R2.270 Clc1ccc(cc1)CCCOc2cccnc2 34a_100000210849_100000759440 [0,1,0,0,0,1|2,0,0]=4 7816 B18R2.270 Clc1ccc(cc1)CCCOc2cccnc2 7a_100000210849_100000759440 [0,1,0,0,0,1|2,0,0]=4 7817 B18R2.270 Clc1ccc(cc1)CCCOc2ccncc2 34a_100000212176_100000759440 [0,1,0,0,0,1|2,0,0]=4 7818 B18R2.270 Clc1ccc(cc1)CCCSc2ccccc2 62a_100000719477_100000759440 [0,1,0,0,0,1|1,0,0]=3 7819 B18R2.270 Clc1ccc(cc1)CCCSc2ccccc2 62a_100000759440_100000041952 [0,1,0,0,0,1|1,0,0]=3 7820 B18R2.270 Clc1ccc(cc1)CCCSc2ccccn2 62a_100000759440_100011216584 [0,1,0,0,0,1|2,0,0]=4 7821 B18R2.270 Clc1ccc(cc1)CCCSc2ccccn2 62a_100011216584_100000759440 [0,1,0,0,0,1|2,0,0]=4 7822 B18R2.270 Clc1ccc(cc1)CCCSc2cccnc2 62a_100000210063_100000759440 [0,1,0,0,0,1|2,0,0]=4 7823 B18R2.270 Clc1ccc(cc1)CCCSc2cccnc2 62a_100000759440_100000210063 [0,1,0,0,0,1|2,0,0]=4 7824 B18R2.270 Clc1ccc(cc1)CCCSc2ccncc2 62a_100000728582_100000759440 [0,1,0,0,0,1|2,0,0]=4 7825 B18R2.270 Clc1ccc(cc1)CCCSc2ccncc2 62a_100000759440_100000728582 [0,1,0,0,0,1|2,0,0]=4 7826 B18R2.270 Clc1ccc(cc1)CCNCc2ccccc2 207a_100000185265_100015611070 [0,1,0,0,0,1|1,0,0]=3 7827 B18R2.270 Clc1ccc(cc1)CCNCc2ccccc2 2230a_100000185265_100015291786 [0,1,0,0,0,1|1,0,0]=3 7828 B18R2.270 Clc1ccc(cc1)CCNCc2ccccc2 2230a_100015324214_100011713675 [0,1,0,0,0,1|1,0,0]=3 7829 B18R2.270 Clc1ccc(cc1)CCNCc2ccccc2 270004a_100000185265_100015611070 [0,1,0,0,0,1|1,0,0]=3 7830 B18R2.270 Clc1ccc(cc1)CCNCc2ccccc2 34a_100000185265_100015291786 [0,1,0,0,0,1|1,0,0]=3 7831 B18R2.270 Clc1ccc(cc1)CCNCc2ccccc2 34a_100015324214_100011713675 [0,1,0,0,0,1|1,0,0]=3 7832 B18R2.270 Clc1ccc(cc1)CCNCc2ccccn2 207a_100000185265_100000209966 [0,1,0,0,0,1|2,0,0]=4 7833 B18R2.270 Clc1ccc(cc1)CCNCc2ccccn2 2230a_100000185265_100000721315 [0,1,0,0,0,1|2,0,0]=4 7834 B18R2.270 Clc1ccc(cc1)CCNCc2ccccn2 270004a_100000185265_100000209966 [0,1,0,0,0,1|2,0,0]=4 7835 B18R2.270 Clc1ccc(cc1)CCNCc2ccccn2 34a_100000185265_100000721315 [0,1,0,0,0,1|2,0,0]=4 7836 B18R2.270 Clc1ccc(cc1)CCNCc2cccnc2 207a_100000185265_100000209961 [0,1,0,0,0,1|2,0,0]=4 7837 B18R2.270 Clc1ccc(cc1)CCNCc2cccnc2 2230a_100000185265_100000741622 [0,1,0,0,0,1|2,0,0]=4 7838 B18R2.270 Clc1ccc(cc1)CCNCc2cccnc2 270004a_100000185265_100000209961 [0,1,0,0,0,1|2,0,0]=4 7839 B18R2.270 Clc1ccc(cc1)CCNCc2cccnc2 34a_100000185265_100000733263 [0,1,0,0,0,1|2,0,0]=4 7840 B18R2.270 Clc1ccc(cc1)CCNCc2ccncc2 207a_100000185265_100000186114 [0,1,0,0,0,1|2,0,0]=4 7841 B18R2.270 Clc1ccc(cc1)CCNCc2ccncc2 2230a_100000185265_100015193705 [0,1,0,0,0,1|2,0,0]=4 7842 B18R2.270 Clc1ccc(cc1)CCOCc2ccccc2 34a_100000210790_100011713675 [0,1,0,0,0,1|0,0,0]=2 7843 B18R2.270 Clc1ccc(cc1)CCOCc2ccccc2 34a_100011219627_100015291786 [0,1,0,0,0,1|0,0,0]=2 7844 B18R2.270 Clc1ccc(cc1)CCOCc2ccccc2 7a_100000210790_100011713675 [0,1,0,0,0,1|0,0,0]=2 7845 B18R2.270 Clc1ccc(cc1)CCOCc2ccccc2 7a_100011219627_100000211182 [0,1,0,0,0,1|0,0,0]=2 7846 B18R2.270 Clc1ccc(cc1)CCOCc2ccccn2 34a_100011219627_100000721315 [0,1,0,0,0,1|1,0,0]=3 7847 B18R2.270 Clc1ccc(cc1)CCOCc2ccccn2 7a_100011219627_100000721315 [0,1,0,0,0,1|1,0,0]=3 7848 B18R2.270 Clc1ccc(cc1)CCOCc2cccnc2 34a_100011219627_100000733263 [0,1,0,0,0,1|1,0,0]=3 7849 B18R2.270 Clc1ccc(cc1)CCOCc2cccnc2 7a_100011219627_100000741622 [0,1,0,0,0,1|1,0,0]=3 7850 B18R2.270 Clc1ccc(cc1)CCOCc2cccnn2 34a_100011219627_100016990269 [0,1,0,0,0,1|2,0,0]=4 7851 B18R2.270 Clc1ccc(cc1)CCOCc2cccnn2 7a_100011219627_100016990269 [0,1,0,0,0,1|2,0,0]=4 7852 B18R2.270 Clc1ccc(cc1)CCOCc2ccncc2 7a_100011219627_100015193705 [0,1,0,0,0,1|1,0,0]=3 7853 B18R2.270 Clc1ccc(cc1)CCOCc2cnccn2 34a_100011219627_100016995436 [0,1,0,0,0,1|2,0,0]=4 7854 B18R2.270 Clc1ccc(cc1)CCOCc2cnccn2 7a_100011219627_100016995436 [0,1,0,0,0,1|2,0,0]=4 7855 B18R2.270 Clc1ccc(cc1)CCOCc2cncnc2 34a_100011219627_100015196519 [0,1,0,0,0,1|2,0,0]=4 7856 B18R2.270 Clc1ccc(cc1)CCOCc2cncnc2 7a_100011219627_100015196519 [0,1,0,0,0,1|2,0,0]=4 7857 B18R2.270 Clc1ccc(cc1)CCOCc2ncccn2 34a_100011219627_100000703007 [0,1,0,0,0,1|2,0,0]=4 7858 B18R2.270 Clc1ccc(cc1)CCOCc2ncccn2 7a_100011219627_100000703007 [0,1,0,0,0,1|2,0,0]=4 7859 B18R2.270 Clc1ccc(cc1)CCSCc2ccccc2 62a_100000211182_100011713675 [0,1,0,0,0,1|0,1,0]=3 7860 B18R2.270 Clc1ccc(cc1)CCSCc2ccccc2 62a_100011713675_100015291786 [0,1,0,0,0,1|0,1,0]=3 7861 B18R2.270 Clc1ccc(cc1)CCSCc2ccccn2 62a_100000721315_100011713675 [0,1,0,0,0,1|1,1,0]=4 7862 B18R2.270 Clc1ccc(cc1)CCSCc2ccccn2 62a_100011713675_100000721315 [0,1,0,0,0,1|1,1,0]=4 7863 B18R2.270 Clc1ccc(cc1)CCSCc2cccnc2 62a_100000741622_100011713675 [0,1,0,0,0,1|1,1,0]=4 7864 B18R2.270 Clc1ccc(cc1)CCSCc2cccnc2 62a_100011713675_100000741622 [0,1,0,0,0,1|1,1,0]=4 7865 B18R2.270 Clc1ccc(cc1)CCSCc2ccncc2 62a_100011713675_100015193705 [0,1,0,0,0,1|1,1,0]=4 7866 B18R2.270 Clc1ccc(cc1)CCSCc2ccncc2 62a_100015193705_100011713675 [0,1,0,0,0,1|1,1,0]=4 7867 B18R2.270 Clc1ccc(cc1)CNCCc2ccccc2 207a_100000106460_100000189385 [0,1,0,0,0,1|1,0,0]=3 7868 B18R2.270 Clc1ccc(cc1)CNCCc2ccccc2 2230a_100000106460_100000694040 [0,1,0,0,0,1|1,0,0]=3 7869 B18R2.270 Clc1ccc(cc1)CNCCc2ccccc2 2230a_100000174871_100000765856 [0,1,0,0,0,1|1,0,0]=3 7870 B18R2.270 Clc1ccc(cc1)CNCCc2ccccc2 270004a_100000106460_100000189385 [0,1,0,0,0,1|1,0,0]=3 7871 B18R2.270 Clc1ccc(cc1)CNCCc2ccccc2 34a_100000106460_100000694040 [0,1,0,0,0,1|1,0,0]=3 7872 B18R2.270 Clc1ccc(cc1)CNCCc2ccccc2 34a_100000174871_100000765856 [0,1,0,0,0,1|1,0,0]=3 7873 B18R2.270 Clc1ccc(cc1)CNCCc2ccccn2 207a_100000211156_100000189385 [0,1,0,0,0,1|2,0,0]=4 7874 B18R2.270 Clc1ccc(cc1)CNCCc2ccccn2 2230a_100000174871_100015183660 [0,1,0,0,0,1|2,0,0]=4 7875 B18R2.270 Clc1ccc(cc1)CNCCc2ccccn2 270004a_100000211156_100000189385 [0,1,0,0,0,1|2,0,0]=4 7876 B18R2.270 Clc1ccc(cc1)CNCCc2cccnc2 207a_100000736294_100000189385 [0,1,0,0,0,1|2,0,0]=4 7877 B18R2.270 Clc1ccc(cc1)CNCCc2cccnc2 2230a_100000174871_200011713674 [0,1,0,0,0,1|2,0,0]=4 7878 B18R2.270 Clc1ccc(cc1)CNCCc2cccnc2 2230a_100000736294_100000694040 [0,1,0,0,0,1|2,0,0]=4 7879 B18R2.270 Clc1ccc(cc1)CNCCc2cccnc2 270004a_100000736294_100000189385 [0,1,0,0,0,1|2,0,0]=4 7880 B18R2.270 Clc1ccc(cc1)CNCCc2ccncc2 207a_100000742849_100000189385 [0,1,0,0,0,1|2,0,0]=4 7881 B18R2.270 Clc1ccc(cc1)CNCCc2ccncc2 2230a_100000174871_100000723409 [0,1,0,0,0,1|2,0,0]=4 7882 B18R2.270 Clc1ccc(cc1)CNCCc2ccncc2 270004a_100000742849_100000189385 [0,1,0,0,0,1|2,0,0]=4 7883 B18R2.270 Clc1ccc(cc1)CNCSc2ccccc2 2230a_100000174871_100011218342 [0,1,0,0,0,1|1,0,0]=3 7884 B18R2.270 Clc1ccc(cc1)CNN=Cc2ccccc2 4a_100000689899_100015611070 [0,1,0,0,0,1|1,0,1]=4 7885 B18R2.270 Clc1ccc(cc1)COCCc2ccccc2 34a_100000210268_100000694040 [0,1,0,0,0,1|0,0,0]=2 7886 B18R2.270 Clc1ccc(cc1)COCCc2ccccc2 34a_100000211118_100000765856 [0,1,0,0,0,1|0,0,0]=2 7887 B18R2.270 Clc1ccc(cc1)COCCc2ccccc2 7a_100000210268_100000187161 [0,1,0,0,0,1|0,0,0]=2 7888 B18R2.270 Clc1ccc(cc1)COCCc2ccccc2 7a_100000211118_100000765856 [0,1,0,0,0,1|0,0,0]=2 7889 B18R2.270 Clc1ccc(cc1)COCCc2ccccn2 34a_100000210271_100000694040 [0,1,0,0,0,1|1,0,0]=3 7890 B18R2.270 Clc1ccc(cc1)COCCc2ccccn2 7a_100000211118_100015183660 [0,1,0,0,0,1|1,0,0]=3 7891 B18R2.270 Clc1ccc(cc1)COCCc2cccnc2 34a_100011217484_100000694040 [0,1,0,0,0,1|1,0,0]=3 7892 B18R2.270 Clc1ccc(cc1)COCCc2cccnc2 7a_100000211118_200011713674 [0,1,0,0,0,1|1,0,0]=3 7893 B18R2.270 Clc1ccc(cc1)COCCc2ccncc2 34a_100011216225_100000694040 [0,1,0,0,0,1|1,0,0]=3 7894 B18R2.270 Clc1ccc(cc1)COCCc2ccncc2 7a_100000211118_100000723409 [0,1,0,0,0,1|1,0,0]=3 7895 B18R2.270 Clc1ccc(cc1)COCCc2cnccn2 34a_100011349526_100000694040 [0,1,0,0,0,1|2,0,0]=4 7896 B18R2.270 Clc1ccc(cc1)COCCc2cncnc2 34a_100011709255_100000694040 [0,1,0,0,0,1|2,0,0]=4 7897 B18R2.270 Clc1ccc(cc1)CSCCc2ccccc2 62a_100000187161_100011218657 [0,1,0,0,0,1|0,1,0]=3 7898 B18R2.270 Clc1ccc(cc1)CSCCc2ccccc2 62a_100000765856_100000187161 [0,1,0,0,0,1|0,1,0]=3 7899 B18R2.270 Clc1ccc(cc1)CSCCc2ccccn2 62a_100000187161_100015183660 [0,1,0,0,0,1|1,1,0]=4 7900 B18R2.270 Clc1ccc(cc1)CSCCc2ccccn2 62a_100015183660_100000187161 [0,1,0,0,0,1|1,1,0]=4 7901 B18R2.270 Clc1ccc(cc1)CSCCc2cccnc2 62a_100000187161_200011713674 [0,1,0,0,0,1|1,1,0]=4 7902 B18R2.270 Clc1ccc(cc1)CSCCc2cccnc2 62a_200011713674_100000187161 [0,1,0,0,0,1|1,1,0]=4 7903 B18R2.270 Clc1ccc(cc1)CSCCc2ccncc2 62a_100000187161_100000723409 [0,1,0,0,0,1|1,1,0]=4 7904 B18R2.270 Clc1ccc(cc1)CSCCc2ccncc2 62a_100000723409_100000187161 [0,1,0,0,0,1|1,1,0]=4 7905 B18R2.270 Clc1ccc(cc1)CSCSc2ccccc2 62a_100000187161_100011218342 [0,1,0,0,0,1|0,1,0]=3 7906 B18R2.270 Clc1ccc(cc1)CSCSc2ccccc2 62a_100011218342_100000187161 [0,1,0,0,0,1|0,1,0]=3 7907 B18R2.270 Clc1ccc(cc1)NC/C=C/c2ccccc2 2230a_100000210052_100016265936 [0,1,0,0,0,1|1,0,1]=4 7908 B18R2.270 Clc1ccc(cc1)NC/C=C/c2ccccc2 34a_100000210052_100016265936 [0,1,0,0,0,1|1,0,1]=4 7909 B18R2.270 Clc1ccc(cc1)NCC#Cc2ccccc2 2230a_100000210052_100011352542 [0,1,0,0,0,1|1,0,1]=4 7910 B18R2.270 Clc1ccc(cc1)NCC#Cc2ccccc2 34a_100000210052_100011352542 [0,1,0,0,0,1|1,0,1]=4 7911 B18R2.270 Clc1ccc(cc1)NCCCc2ccccc2 2230a_100000210052_100000211621 [0,1,0,0,0,1|1,0,0]=3 7912 B18R2.270 Clc1ccc(cc1)NCCCc2ccccc2 34a_100000210052_100000211621 [0,1,0,0,0,1|1,0,0]=3 7913 B18R2.270 Clc1ccc(cc1)NCCOc2ccccc2 2230a_100000210052_100000184471 [0,1,0,0,0,1|2,0,0]=4 7914 B18R2.270 Clc1ccc(cc1)NCCOc2ccccc2 34a_100000210052_100000184471 [0,1,0,0,0,1|2,0,0]=4 7915 B18R2.270 Clc1ccc(cc1)NCCSc2ccccc2 2230a_100000210052_100000246102 [0,1,0,0,0,1|2,0,0]=4 7916 B18R2.270 Clc1ccc(cc1)NCCSc2ccccc2 34a_100000210052_100000246102 [0,1,0,0,0,1|2,0,0]=4 7917 B18R2.270 Clc1ccc(cc1)NCOCc2ccccc2 2230a_100000210052_100000763385 [0,1,0,0,0,1|0,0,0]=2 7918 B18R2.270 Clc1ccc(cc1)NCOCc2ccccc2 34a_100000210052_100000763385 [0,1,0,0,0,1|0,0,0]=2 7919 B18R2.270 Clc1ccc(cc1)NCSCc2ccccc2 2230a_100000210052_200011217039 [0,1,0,0,0,1|0,1,0]=3 7920 B18R2.270 Clc1ccc(cc1)NCSCc2ccccc2 34a_100000210052_200011217039 [0,1,0,0,0,1|0,1,0]=3 7921 B18R2.270 Clc1ccc(cc1)NN=CCc2ccccc2 4a_100000683521_100000209964 [0,1,0,0,0,1|2,0,0]=4 7922 B18R2.270 Clc1ccc(cc1)OC/C=C/c2ccccc2 34a_100000210216_100016265936 [0,1,0,0,0,1|1,0,1]=4 7923 B18R2.270 Clc1ccc(cc1)OC/C=C/c2ccccc2 7a_100000210216_100016265936 [0,1,0,0,0,1|1,0,1]=4 7924 B18R2.270 Clc1ccc(cc1)OCC#Cc2ccccc2 34a_100000210216_100011352542 [0,1,0,0,0,1|1,0,1]=4 7925 B18R2.270 Clc1ccc(cc1)OCC#Cc2ccccc2 7a_100000210216_100011352542 [0,1,0,0,0,1|1,0,1]=4 7926 B18R2.270 Clc1ccc(cc1)OCCCc2ccccc2 34a_100000210216_100000211621 [0,1,0,0,0,1|1,0,0]=3 7927 B18R2.270 Clc1ccc(cc1)OCCCc2ccccc2 7a_100000210216_100000211621 [0,1,0,0,0,1|1,0,0]=3 7928 B18R2.270 Clc1ccc(cc1)OCCNc2ccccc2 34a_100000106764_100000184122 [0,1,0,0,0,1|2,0,0]=4 7929 B18R2.270 Clc1ccc(cc1)OCCOc2ccccc2 34a_100000210216_100000184471 [0,1,0,0,0,1|2,0,0]=4 7930 B18R2.270 Clc1ccc(cc1)OCCOc2ccccc2 34a_100000210340_100000184122 [0,1,0,0,0,1|2,0,0]=4 7931 B18R2.270 Clc1ccc(cc1)OCCOc2ccccc2 7a_100000210216_100000184471 [0,1,0,0,0,1|2,0,0]=4 7932 B18R2.270 Clc1ccc(cc1)OCCOc2ccccc2 7a_100000210340_100000184122 [0,1,0,0,0,1|2,0,0]=4 7933 B18R2.270 Clc1ccc(cc1)OCCSc2ccccc2 34a_100000210216_100000246102 [0,1,0,0,0,1|2,0,0]=4 7934 B18R2.270 Clc1ccc(cc1)OCCSc2ccccc2 62a_100000184122_100000041952 [0,1,0,0,0,1|2,0,0]=4 7935 B18R2.270 Clc1ccc(cc1)OCCSc2ccccc2 62a_100000719477_100000184122 [0,1,0,0,0,1|2,0,0]=4 7936 B18R2.270 Clc1ccc(cc1)OCCSc2ccccc2 7a_100000210216_100000246102 [0,1,0,0,0,1|2,0,0]=4 7937 B18R2.270 Clc1ccc(cc1)OCOCc2ccccc2 34a_100000210216_100000763385 [0,1,0,0,0,1|0,0,0]=2 7938 B18R2.270 Clc1ccc(cc1)OCSCc2ccccc2 34a_100000210216_200011217039 [0,1,0,0,0,1|0,1,0]=3 7939 B18R2.270 Clc1ccc(cc1)SC/C=C/c2ccccc2 62a_100000755918_100016265936 [0,1,0,0,0,1|1,0,1]=4 7940 B18R2.270 Clc1ccc(cc1)SC/C=C/c2ccccc2 62a_100016265936_100000755918 [0,1,0,0,0,1|1,0,1]=4 7941 B18R2.270 Clc1ccc(cc1)SCC#Cc2ccccc2 62a_100000755918_100011352542 [0,1,0,0,0,1|1,0,1]=4 7942 B18R2.270 Clc1ccc(cc1)SCCCc2ccccc2 62a_100000211621_100000755918 [0,1,0,0,0,1|1,0,0]=3 7943 B18R2.270 Clc1ccc(cc1)SCCCc2ccccc2 62a_100000755918_100000211621 [0,1,0,0,0,1|1,0,0]=3 7944 B18R2.270 Clc1ccc(cc1)SCCOc2ccccc2 62a_100000184471_100000755918 [0,1,0,0,0,1|2,0,0]=4 7945 B18R2.270 Clc1ccc(cc1)SCCOc2ccccc2 62a_100000755918_100000184471 [0,1,0,0,0,1|2,0,0]=4 7946 B18R2.270 Clc1ccc(cc1)SCCSc2ccccc2 62a_100000246102_100000755918 [0,1,0,0,0,1|2,0,0]=4 7947 B18R2.270 Clc1ccc(cc1)SCCSc2ccccc2 62a_100000755918_100000246102 [0,1,0,0,0,1|2,0,0]=4 7948 B18R2.270 Clc1ccc(cc1)SCOCc2ccccc2 62a_100000755918_100000763385 [0,1,0,0,0,1|0,0,0]=2 7949 B18R2.270 Clc1ccc(cc1)SCOCc2ccccc2 62a_100000763385_100000755918 [0,1,0,0,0,1|0,0,0]=2 7950 B18R2.270 Clc1ccc(cc1)SCSCc2ccccc2 62a_100000755918_200011217039 [0,1,0,0,0,1|0,1,0]=3 7951 B18R2.270 Clc1ccc(cc1)SCSCc2ccccc2 62a_200011217039_100000755918 [0,1,0,0,0,1|0,1,0]=3 7952 B18R2.270 Clc1ccc(cn1)CCOCc2ccccc2 34a_100009880866_100015291786 [0,1,0,0,0,1|1,0,0]=3 7953 B18R2.270 Clc1ccc(cn1)CCOCc2ccccc2 7a_100009880866_100000211182 [0,1,0,0,0,1|1,0,0]=3 7954 B18R2.270 Clc1ccc(cn1)CCOCc2ccccn2 34a_100009880866_100000721315 [0,1,0,0,0,1|2,0,0]=4 7955 B18R2.270 Clc1ccc(cn1)CCOCc2ccccn2 7a_100009880866_100000721315 [0,1,0,0,0,1|2,0,0]=4 7956 B18R2.270 Clc1ccc(cn1)CCOCc2cccnc2 34a_100009880866_100000733263 [0,1,0,0,0,1|2,0,0]=4 7957 B18R2.270 Clc1ccc(cn1)CCOCc2cccnc2 7a_100009880866_100000741622 [0,1,0,0,0,1|2,0,0]=4 7958 B18R2.270 Clc1ccc(cn1)CCOCc2ccncc2 7a_100009880866_100015193705 [0,1,0,0,0,1|2,0,0]=4 7959 B18R2.270 Clc1ccc(cn1)CNCCc2ccccc2 2230a_100000106460_100000735431 [0,1,0,0,0,1|2,0,0]=4 7960 B18R2.270 Clc1ccc(cn1)CNCCc2ccccc2 2230a_100000735879_100000765856 [0,1,0,0,0,1|2,0,0]=4 7961 B18R2.270 Clc1ccc(cn1)CNCCc2ccccc2 34a_100000106460_100000735431 [0,1,0,0,0,1|2,0,0]=4 7962 B18R2.270 Clc1ccc(cn1)CNCCc2ccccc2 34a_100000735879_100000765856 [0,1,0,0,0,1|2,0,0]=4 7963 B18R2.270 Clc1ccc(cn1)CNCSc2ccccc2 2230a_100000735879_100011218342 [0,1,0,0,0,1|2,0,0]=4 7964 B18R2.270 Clc1ccc(cn1)COCCc2ccccc2 34a_100000210268_100000735431 [0,1,0,0,0,1|1,0,0]=3 7965 B18R2.270 Clc1ccc(cn1)COCCc2ccccc2 34a_100000755211_100000765856 [0,1,0,0,0,1|1,0,0]=3 7966 B18R2.270 Clc1ccc(cn1)COCCc2ccccc2 7a_100000210268_100000735431 [0,1,0,0,0,1|1,0,0]=3 7967 B18R2.270 Clc1ccc(cn1)COCCc2ccccc2 7a_100000755211_100000765856 [0,1,0,0,0,1|1,0,0]=3 7968 B18R2.270 Clc1ccc(cn1)COCCc2ccccn2 34a_100000210271_100000735431 [0,1,0,0,0,1|2,0,0]=4 7969 B18R2.270 Clc1ccc(cn1)COCCc2ccccn2 7a_100000755211_100015183660 [0,1,0,0,0,1|2,0,0]=4 7970 B18R2.270 Clc1ccc(cn1)COCCc2cccnc2 34a_100011217484_100000735431 [0,1,0,0,0,1|2,0,0]=4 7971 B18R2.270 Clc1ccc(cn1)COCCc2cccnc2 7a_100000755211_200011713674 [0,1,0,0,0,1|2,0,0]=4 7972 B18R2.270 Clc1ccc(cn1)COCCc2ccncc2 34a_100011216225_100000735431 [0,1,0,0,0,1|2,0,0]=4 7973 B18R2.270 Clc1ccc(cn1)COCCc2ccncc2 7a_100000755211_100000723409 [0,1,0,0,0,1|2,0,0]=4 7974 B18R2.270 Clc1ccc(cn1)CSCCc2ccccc2 62a_100000735431_100011218657 [0,1,0,0,0,1|1,1,0]=4 7975 B18R2.270 Clc1ccc(cn1)CSCCc2ccccc2 62a_100000765856_100000735431 [0,1,0,0,0,1|1,1,0]=4 7976 B18R2.270 Clc1ccc(cn1)CSCSc2ccccc2 62a_100000735431_100011218342 [0,1,0,0,0,1|1,1,0]=4 7977 B18R2.270 Clc1ccc(cn1)CSCSc2ccccc2 62a_100011218342_100000735431 [0,1,0,0,0,1|1,1,0]=4 7978 B18R2.270 Clc1ccc(cn1)OCCCc2ccccc2 34a_100000744096_100000211621 [0,1,0,0,0,1|2,0,0]=4 7979 B18R2.270 Clc1ccc(cn1)OCCCc2ccccc2 7a_100000744096_100000211621 [0,1,0,0,0,1|2,0,0]=4 7980 B18R2.270 Clc1ccc(cn1)OCOCc2ccccc2 34a_100000744096_100000763385 [0,1,0,0,0,1|1,0,0]=3 7981 B18R2.270 Clc1ccc(cn1)OCSCc2ccccc2 34a_100000744096_200011217039 [0,1,0,0,0,1|1,1,0]=4 7982 B18R2.270 Clc1ccc(cn1)SCCCc2ccccc2 62a_100000034144_100000211621 [0,1,0,0,0,1|2,0,0]=4 7983 B18R2.270 Clc1ccc(cn1)SCCCc2ccccc2 62a_100000211621_100000034144 [0,1,0,0,0,1|2,0,0]=4 7984 B18R2.270 Clc1ccc(cn1)SCOCc2ccccc2 62a_100000034144_100000763385 [0,1,0,0,0,1|1,0,0]=3 7985 B18R2.270 Clc1ccc(cn1)SCOCc2ccccc2 62a_100000763385_100000034144 [0,1,0,0,0,1|1,0,0]=3 7986 B18R2.270 Clc1ccc(cn1)SCSCc2ccccc2 62a_100000034144_200011217039 [0,1,0,0,0,1|1,1,0]=4 7987 B18R2.270 Clc1ccc(cn1)SCSCc2ccccc2 62a_200011217039_100000034144 [0,1,0,0,0,1|1,1,0]=4 7988 B18R2.270 Clc1ccc(nc1)CNCCc2ccccc2 207a_100000106460_100011361569 [0,1,0,0,0,1|2,0,0]=4 7989 B18R2.270 Clc1ccc(nc1)CNCCc2ccccc2 2230a_100000106460_100012066911 [0,1,0,0,0,1|2,0,0]=4 7990 B18R2.270 Clc1ccc(nc1)CNCCc2ccccc2 270004a_100000106460_100011361569 [0,1,0,0,0,1|2,0,0]=4 7991 B18R2.270 Clc1ccc(nc1)CNCCc2ccccc2 34a_100000106460_100012066911 [0,1,0,0,0,1|2,0,0]=4 7992 B18R2.270 Clc1ccc(nc1)CNCCc2ccccc2 34a_100000697193_100000765856 [0,1,0,0,0,1|2,0,0]=4 7993 B18R2.270 Clc1ccc(nc1)COCCc2ccccc2 34a_100000210268_100012066911 [0,1,0,0,0,1|1,0,0]=3 7994 B18R2.270 Clc1ccc(nc1)COCCc2ccccc2 34a_100000703999_100000765856 [0,1,0,0,0,1|1,0,0]=3 7995 B18R2.270 Clc1ccc(nc1)COCCc2ccccc2 7a_100000210268_100012066911 [0,1,0,0,0,1|1,0,0]=3 7996 B18R2.270 Clc1ccc(nc1)COCCc2ccccn2 34a_100000210271_100012066911 [0,1,0,0,0,1|2,0,0]=4 7997 B18R2.270 Clc1ccc(nc1)COCCc2cccnc2 34a_100011217484_100012066911 [0,1,0,0,0,1|2,0,0]=4 7998 B18R2.270 Clc1ccc(nc1)COCCc2ccncc2 34a_100011216225_100012066911 [0,1,0,0,0,1|2,0,0]=4 7999 B18R2.270 Clc1ccc(nc1)CSCCc2ccccc2 62a_100000765856_100000697101 [0,1,0,0,0,1|1,1,0]=4 8000 B18R2.270 Clc1ccc(nc1)CSCCc2ccccc2 62a_100012066911_100011218657 [0,1,0,0,0,1|1,1,0]=4 8001 B18R2.270 Clc1ccc(nc1)CSCSc2ccccc2 62a_100011218342_100000697101 [0,1,0,0,0,1|1,1,0]=4 8002 B18R2.270 Clc1ccc(nc1)CSCSc2ccccc2 62a_100012066911_100011218342 [0,1,0,0,0,1|1,1,0]=4 8003 B18R2.270 Clc1ccc(nc1)OCCCc2ccccc2 34a_100011215309_100000211621 [0,1,0,0,0,1|2,0,0]=4 8004 B18R2.270 Clc1ccc(nc1)OCOCc2ccccc2 34a_100011215309_100000763385 [0,1,0,0,0,1|1,0,0]=3 8005 B18R2.270 Clc1ccc(nc1)OCSCc2ccccc2 34a_100011215309_200011217039 [0,1,0,0,0,1|1,1,0]=4 8006 B18R2.270 Clc1ccc(nc1)SCCCc2ccccc2 62a_100000211621_100011356976 [0,1,0,0,0,1|2,0,0]=4 8007 B18R2.270 Clc1ccc(nc1)SCCCc2ccccc2 62a_100011356976_100000211621 [0,1,0,0,0,1|2,0,0]=4 8008 B18R2.270 Clc1ccc(nc1)SCOCc2ccccc2 62a_100000763385_100011356976 [0,1,0,0,0,1|1,0,0]=3 8009 B18R2.270 Clc1ccc(nc1)SCOCc2ccccc2 62a_100011356976_100000763385 [0,1,0,0,0,1|1,0,0]=3 8010 B18R2.270 Clc1ccc(nc1)SCSCc2ccccc2 62a_100011356976_200011217039 [0,1,0,0,0,1|1,1,0]=4 8011 B18R2.270 Clc1ccc(nc1)SCSCc2ccccc2 62a_200011217039_100011356976 [0,1,0,0,0,1|1,1,0]=4 8012 B18R2.270 Clc1ccc(nn1)COCCc2ccccc2 34a_100000210268_100016992710 [0,1,0,0,0,1|2,0,0]=4 8013 B18R2.270 Clc1ccc(nn1)COCCc2ccccc2 7a_100000210268_100016992710 [0,1,0,0,0,1|2,0,0]=4 8014 B18R2.270 Clc1ccc(nn1)SCOCc2ccccc2 62a_100000068654_100000763385 [0,1,0,0,0,1|2,0,0]=4 8015 B18R2.270 Clc1ccc(nn1)SCOCc2ccccc2 62a_100000763385_100000068654 [0,1,0,0,0,1|2,0,0]=4 8016 B18R2.270 Clc1cnc(cn1)COCCc2ccccc2 34a_100012002382_100000765856 [0,1,0,0,0,1|2,0,0]=4 8017 B18R2.270 Clc1cnc(cn1)OCOCc2ccccc2 34a_100015839800_100000763385 [0,1,0,0,0,1|2,0,0]=4 8018 B18R2.270 Clc1cnc(cn1)SCOCc2ccccc2 62a_100000763385_100010214907 [0,1,0,0,0,1|2,0,0]=4 8019 B18R2.270 Clc1cnc(cn1)SCOCc2ccccc2 62a_100010214907_100000763385 [0,1,0,0,0,1|2,0,0]=4 8020 B18R2.270 Clc1cnc(nc1)SCOCc2ccccc2 62a_100000763385_100011356929 [0,1,0,0,0,1|2,0,0]=4 8021 B18R2.270 Clc1cnc(nc1)SCOCc2ccccc2 62a_100011356929_100000763385 [0,1,0,0,0,1|2,0,0]=4 8022 B18R2.270 Clc1ncc(cn1)COCCc2ccccc2 34a_100009855073_100000765856 [0,1,0,0,0,1|2,0,0]=4 8023 B18R2.270 Clc1ncc(cn1)COCCc2ccccc2 7a_100009855073_100000765856 [0,1,0,0,0,1|2,0,0]=4 8024 B18R2.270 Clc1ncc(cn1)OCOCc2ccccc2 34a_100000092845_100000763385 [0,1,0,0,0,1|2,0,0]=4 8025 B18R2.270 Clc1ncc(cn1)SCOCc2ccccc2 62a_100000059775_100000763385 [0,1,0,0,0,1|2,0,0]=4 8026 B18R2.270 Clc1ncc(cn1)SCOCc2ccccc2 62a_100000763385_100000059775 [0,1,0,0,0,1|2,0,0]=4 8027 B18R2.270 Fc1ccc(cc1)C#CCNc2ccccc2 34a_100000106764_100010402171 [0,1,0,0,0,1|1,0,1]=4 8028 B18R2.270 Fc1ccc(cc1)C#CCOc2ccccc2 34a_100000210340_100010402171 [0,1,0,0,0,1|1,0,1]=4 8029 B18R2.270 Fc1ccc(cc1)C#CCOc2ccccc2 7a_100000210340_100010402171 [0,1,0,0,0,1|1,0,1]=4 8030 B18R2.270 Fc1ccc(cc1)C#CCSc2ccccc2 62a_100000719477_100010402171 [0,1,0,0,0,1|1,0,1]=4 8031 B18R2.270 Fc1ccc(cc1)C#CCSc2ccccc2 62a_100010402171_100000041952 [0,1,0,0,0,1|1,0,1]=4 8032 B18R2.270 Fc1ccc(cc1)C=NNCc2ccccc2 4a_100000007032_100000210084 [0,1,0,0,0,1|1,0,1]=4 8033 B18R2.270 Fc1ccc(cc1)CC=NNc2ccccc2 4a_100015195140_100000684651 [0,1,0,0,0,1|2,0,0]=4 8034 B18R2.270 Fc1ccc(cc1)CCCNc2ccccc2 34a_100000106764_200011713563 [0,1,0,0,0,1|1,0,0]=3 8035 B18R2.270 Fc1ccc(cc1)CCCOc2ccccc2 34a_100000210340_200011713563 [0,1,0,0,0,1|1,0,0]=3 8036 B18R2.270 Fc1ccc(cc1)CCCOc2ccccc2 7a_100000210340_200011713563 [0,1,0,0,0,1|1,0,0]=3 8037 B18R2.270 Fc1ccc(cc1)CCCOc2cccnc2 34a_100000210849_200011713563 [0,1,0,0,0,1|2,0,0]=4 8038 B18R2.270 Fc1ccc(cc1)CCCOc2cccnc2 7a_100000210849_200011713563 [0,1,0,0,0,1|2,0,0]=4 8039 B18R2.270 Fc1ccc(cc1)CCCOc2ccncc2 34a_100000212176_200011713563 [0,1,0,0,0,1|2,0,0]=4 8040 B18R2.270 Fc1ccc(cc1)CCCSc2ccccc2 62a_100000719477_200011713563 [0,1,0,0,0,1|1,0,0]=3 8041 B18R2.270 Fc1ccc(cc1)CCCSc2ccccc2 62a_200011713563_100000041952 [0,1,0,0,0,1|1,0,0]=3 8042 B18R2.270 Fc1ccc(cc1)CCCSc2ccccn2 62a_100011216584_200011713563 [0,1,0,0,0,1|2,0,0]=4 8043 B18R2.270 Fc1ccc(cc1)CCCSc2ccccn2 62a_200011713563_100011216584 [0,1,0,0,0,1|2,0,0]=4 8044 B18R2.270 Fc1ccc(cc1)CCCSc2cccnc2 62a_100000210063_200011713563 [0,1,0,0,0,1|2,0,0]=4 8045 B18R2.270 Fc1ccc(cc1)CCCSc2cccnc2 62a_200011713563_100000210063 [0,1,0,0,0,1|2,0,0]=4 8046 B18R2.270 Fc1ccc(cc1)CCCSc2ccncc2 62a_100000728582_200011713563 [0,1,0,0,0,1|2,0,0]=4 8047 B18R2.270 Fc1ccc(cc1)CCCSc2ccncc2 62a_200011713563_100000728582 [0,1,0,0,0,1|2,0,0]=4 8048 B18R2.270 Fc1ccc(cc1)CCNCc2ccccc2 207a_100000199005_100015611070 [0,1,0,0,0,1|1,0,0]=3 8049 B18R2.270 Fc1ccc(cc1)CCNCc2ccccc2 2230a_100000199005_100015291786 [0,1,0,0,0,1|1,0,0]=3 8050 B18R2.270 Fc1ccc(cc1)CCNCc2ccccc2 2230a_100015324214_100011217392 [0,1,0,0,0,1|1,0,0]=3 8051 B18R2.270 Fc1ccc(cc1)CCNCc2ccccc2 270004a_100000199005_100015611070 [0,1,0,0,0,1|1,0,0]=3 8052 B18R2.270 Fc1ccc(cc1)CCNCc2ccccc2 34a_100000199005_100015291786 [0,1,0,0,0,1|1,0,0]=3 8053 B18R2.270 Fc1ccc(cc1)CCNCc2ccccc2 34a_100015324214_100011217392 [0,1,0,0,0,1|1,0,0]=3 8054 B18R2.270 Fc1ccc(cc1)CCNCc2ccccn2 207a_100000199005_100000209966 [0,1,0,0,0,1|2,0,0]=4 8055 B18R2.270 Fc1ccc(cc1)CCNCc2ccccn2 2230a_100000199005_100000721315 [0,1,0,0,0,1|2,0,0]=4 8056 B18R2.270 Fc1ccc(cc1)CCNCc2ccccn2 270004a_100000199005_100000209966 [0,1,0,0,0,1|2,0,0]=4 8057 B18R2.270 Fc1ccc(cc1)CCNCc2ccccn2 34a_100000199005_100000721315 [0,1,0,0,0,1|2,0,0]=4 8058 B18R2.270 Fc1ccc(cc1)CCNCc2cccnc2 207a_100000199005_100000209961 [0,1,0,0,0,1|2,0,0]=4 8059 B18R2.270 Fc1ccc(cc1)CCNCc2cccnc2 2230a_100000199005_100000741622 [0,1,0,0,0,1|2,0,0]=4 8060 B18R2.270 Fc1ccc(cc1)CCNCc2cccnc2 270004a_100000199005_100000209961 [0,1,0,0,0,1|2,0,0]=4 8061 B18R2.270 Fc1ccc(cc1)CCNCc2cccnc2 34a_100000199005_100000733263 [0,1,0,0,0,1|2,0,0]=4 8062 B18R2.270 Fc1ccc(cc1)CCNCc2ccncc2 207a_100000199005_100000186114 [0,1,0,0,0,1|2,0,0]=4 8063 B18R2.270 Fc1ccc(cc1)CCNCc2ccncc2 2230a_100000199005_100015193705 [0,1,0,0,0,1|2,0,0]=4 8064 B18R2.270 Fc1ccc(cc1)CCOCc2ccccc2 34a_100000210790_100011217392 [0,1,0,0,0,1|0,0,0]=2 8065 B18R2.270 Fc1ccc(cc1)CCOCc2ccccc2 34a_100000754732_100015291786 [0,1,0,0,0,1|0,0,0]=2 8066 B18R2.270 Fc1ccc(cc1)CCOCc2ccccc2 7a_100000210790_100011217392 [0,1,0,0,0,1|0,0,0]=2 8067 B18R2.270 Fc1ccc(cc1)CCOCc2ccccc2 7a_100000754732_100000211182 [0,1,0,0,0,1|0,0,0]=2 8068 B18R2.270 Fc1ccc(cc1)CCOCc2ccccn2 34a_100000754732_100000721315 [0,1,0,0,0,1|1,0,0]=3 8069 B18R2.270 Fc1ccc(cc1)CCOCc2ccccn2 7a_100000754732_100000721315 [0,1,0,0,0,1|1,0,0]=3 8070 B18R2.270 Fc1ccc(cc1)CCOCc2cccnc2 34a_100000754732_100000733263 [0,1,0,0,0,1|1,0,0]=3 8071 B18R2.270 Fc1ccc(cc1)CCOCc2cccnc2 7a_100000754732_100000741622 [0,1,0,0,0,1|1,0,0]=3 8072 B18R2.270 Fc1ccc(cc1)CCOCc2cccnn2 34a_100000754732_100016990269 [0,1,0,0,0,1|2,0,0]=4 8073 B18R2.270 Fc1ccc(cc1)CCOCc2cccnn2 7a_100000754732_100016990269 [0,1,0,0,0,1|2,0,0]=4 8074 B18R2.270 Fc1ccc(cc1)CCOCc2ccncc2 7a_100000754732_100015193705 [0,1,0,0,0,1|1,0,0]=3 8075 B18R2.270 Fc1ccc(cc1)CCOCc2cnccn2 34a_100000754732_100016995436 [0,1,0,0,0,1|2,0,0]=4 8076 B18R2.270 Fc1ccc(cc1)CCOCc2cnccn2 7a_100000754732_100016995436 [0,1,0,0,0,1|2,0,0]=4 8077 B18R2.270 Fc1ccc(cc1)CCOCc2cncnc2 34a_100000754732_100015196519 [0,1,0,0,0,1|2,0,0]=4 8078 B18R2.270 Fc1ccc(cc1)CCOCc2cncnc2 7a_100000754732_100015196519 [0,1,0,0,0,1|2,0,0]=4 8079 B18R2.270 Fc1ccc(cc1)CCOCc2ncccn2 34a_100000754732_100000703007 [0,1,0,0,0,1|2,0,0]=4 8080 B18R2.270 Fc1ccc(cc1)CCOCc2ncccn2 7a_100000754732_100000703007 [0,1,0,0,0,1|2,0,0]=4 8081 B18R2.270 Fc1ccc(cc1)CCSCc2ccccc2 62a_100000211182_100011217392 [0,1,0,0,0,1|0,1,0]=3 8082 B18R2.270 Fc1ccc(cc1)CCSCc2ccccc2 62a_100011217392_100015291786 [0,1,0,0,0,1|0,1,0]=3 8083 B18R2.270 Fc1ccc(cc1)CCSCc2ccccn2 62a_100000721315_100011217392 [0,1,0,0,0,1|1,1,0]=4 8084 B18R2.270 Fc1ccc(cc1)CCSCc2ccccn2 62a_100011217392_100000721315 [0,1,0,0,0,1|1,1,0]=4 8085 B18R2.270 Fc1ccc(cc1)CCSCc2cccnc2 62a_100000741622_100011217392 [0,1,0,0,0,1|1,1,0]=4 8086 B18R2.270 Fc1ccc(cc1)CCSCc2cccnc2 62a_100011217392_100000741622 [0,1,0,0,0,1|1,1,0]=4 8087 B18R2.270 Fc1ccc(cc1)CCSCc2ccncc2 62a_100011217392_100015193705 [0,1,0,0,0,1|1,1,0]=4 8088 B18R2.270 Fc1ccc(cc1)CCSCc2ccncc2 62a_100015193705_100011217392 [0,1,0,0,0,1|1,1,0]=4 8089 B18R2.270 Fc1ccc(cc1)CNCCc2ccccc2 207a_100000106460_100000210084 [0,1,0,0,0,1|1,0,0]=3 8090 B18R2.270 Fc1ccc(cc1)CNCCc2ccccc2 2230a_100000106460_100000198546 [0,1,0,0,0,1|1,0,0]=3 8091 B18R2.270 Fc1ccc(cc1)CNCCc2ccccc2 2230a_100000174882_100000765856 [0,1,0,0,0,1|1,0,0]=3 8092 B18R2.270 Fc1ccc(cc1)CNCCc2ccccc2 270004a_100000106460_100000210084 [0,1,0,0,0,1|1,0,0]=3 8093 B18R2.270 Fc1ccc(cc1)CNCCc2ccccc2 34a_100000106460_100000198546 [0,1,0,0,0,1|1,0,0]=3 8094 B18R2.270 Fc1ccc(cc1)CNCCc2ccccc2 34a_100000174882_100000765856 [0,1,0,0,0,1|1,0,0]=3 8095 B18R2.270 Fc1ccc(cc1)CNCCc2ccccn2 207a_100000211156_100000210084 [0,1,0,0,0,1|2,0,0]=4 8096 B18R2.270 Fc1ccc(cc1)CNCCc2ccccn2 2230a_100000174882_100015183660 [0,1,0,0,0,1|2,0,0]=4 8097 B18R2.270 Fc1ccc(cc1)CNCCc2ccccn2 270004a_100000211156_100000210084 [0,1,0,0,0,1|2,0,0]=4 8098 B18R2.270 Fc1ccc(cc1)CNCCc2cccnc2 207a_100000736294_100000210084 [0,1,0,0,0,1|2,0,0]=4 8099 B18R2.270 Fc1ccc(cc1)CNCCc2cccnc2 2230a_100000174882_200011713674 [0,1,0,0,0,1|2,0,0]=4 8100 B18R2.270 Fc1ccc(cc1)CNCCc2cccnc2 2230a_100000736294_100000198546 [0,1,0,0,0,1|2,0,0]=4 8101 B18R2.270 Fc1ccc(cc1)CNCCc2cccnc2 270004a_100000736294_100000210084 [0,1,0,0,0,1|2,0,0]=4 8102 B18R2.270 Fc1ccc(cc1)CNCCc2ccncc2 207a_100000742849_100000210084 [0,1,0,0,0,1|2,0,0]=4 8103 B18R2.270 Fc1ccc(cc1)CNCCc2ccncc2 2230a_100000174882_100000723409 [0,1,0,0,0,1|2,0,0]=4 8104 B18R2.270 Fc1ccc(cc1)CNCCc2ccncc2 270004a_100000742849_100000210084 [0,1,0,0,0,1|2,0,0]=4 8105 B18R2.270 Fc1ccc(cc1)CNCSc2ccccc2 2230a_100000174882_100011218342 [0,1,0,0,0,1|1,0,0]=3 8106 B18R2.270 Fc1ccc(cc1)CNN=Cc2ccccc2 4a_100000689900_100015611070 [0,1,0,0,0,1|1,0,1]=4 8107 B18R2.270 Fc1ccc(cc1)COCCc2ccccc2 34a_100000210268_100000198546 [0,1,0,0,0,1|0,0,0]=2 8108 B18R2.270 Fc1ccc(cc1)COCCc2ccccc2 34a_100000210977_100000765856 [0,1,0,0,0,1|0,0,0]=2 8109 B18R2.270 Fc1ccc(cc1)COCCc2ccccc2 7a_100000210268_100000198546 [0,1,0,0,0,1|0,0,0]=2 8110 B18R2.270 Fc1ccc(cc1)COCCc2ccccc2 7a_100000210977_100000765856 [0,1,0,0,0,1|0,0,0]=2 8111 B18R2.270 Fc1ccc(cc1)COCCc2ccccn2 34a_100000210271_100000198546 [0,1,0,0,0,1|1,0,0]=3 8112 B18R2.270 Fc1ccc(cc1)COCCc2ccccn2 7a_100000210977_100015183660 [0,1,0,0,0,1|1,0,0]=3 8113 B18R2.270 Fc1ccc(cc1)COCCc2cccnc2 34a_100011217484_100000198546 [0,1,0,0,0,1|1,0,0]=3 8114 B18R2.270 Fc1ccc(cc1)COCCc2cccnc2 7a_100000210977_200011713674 [0,1,0,0,0,1|1,0,0]=3 8115 B18R2.270 Fc1ccc(cc1)COCCc2ccncc2 34a_100011216225_100000198546 [0,1,0,0,0,1|1,0,0]=3 8116 B18R2.270 Fc1ccc(cc1)COCCc2ccncc2 7a_100000210977_100000723409 [0,1,0,0,0,1|1,0,0]=3 8117 B18R2.270 Fc1ccc(cc1)COCCc2cnccn2 34a_100011349526_100000198546 [0,1,0,0,0,1|2,0,0]=4 8118 B18R2.270 Fc1ccc(cc1)COCCc2cncnc2 34a_100011709255_100000198546 [0,1,0,0,0,1|2,0,0]=4 8119 B18R2.270 Fc1ccc(cc1)CSCCc2ccccc2 62a_100000198546_100011218657 [0,1,0,0,0,1|0,1,0]=3 8120 B18R2.270 Fc1ccc(cc1)CSCCc2ccccc2 62a_100000765856_100000187164 [0,1,0,0,0,1|0,1,0]=3 8121 B18R2.270 Fc1ccc(cc1)CSCCc2ccccn2 62a_100000198546_100015183660 [0,1,0,0,0,1|1,1,0]=4 8122 B18R2.270 Fc1ccc(cc1)CSCCc2ccccn2 62a_100015183660_100000187164 [0,1,0,0,0,1|1,1,0]=4 8123 B18R2.270 Fc1ccc(cc1)CSCCc2cccnc2 62a_100000198546_200011713674 [0,1,0,0,0,1|1,1,0]=4 8124 B18R2.270 Fc1ccc(cc1)CSCCc2cccnc2 62a_200011713674_100000187164 [0,1,0,0,0,1|1,1,0]=4 8125 B18R2.270 Fc1ccc(cc1)CSCCc2ccncc2 62a_100000198546_100000723409 [0,1,0,0,0,1|1,1,0]=4 8126 B18R2.270 Fc1ccc(cc1)CSCCc2ccncc2 62a_100000723409_100000187164 [0,1,0,0,0,1|1,1,0]=4 8127 B18R2.270 Fc1ccc(cc1)CSCSc2ccccc2 62a_100000198546_100011218342 [0,1,0,0,0,1|0,1,0]=3 8128 B18R2.270 Fc1ccc(cc1)CSCSc2ccccc2 62a_100011218342_100000187164 [0,1,0,0,0,1|0,1,0]=3 8129 B18R2.270 Fc1ccc(cc1)NC/C=C/c2ccccc2 34a_100000185862_100016265936 [0,1,0,0,0,1|1,0,1]=4 8130 B18R2.270 Fc1ccc(cc1)NCC#Cc2ccccc2 34a_100000185862_100011352542 [0,1,0,0,0,1|1,0,1]=4 8131 B18R2.270 Fc1ccc(cc1)NCCCc2ccccc2 34a_100000185862_100000211621 [0,1,0,0,0,1|1,0,0]=3 8132 B18R2.270 Fc1ccc(cc1)NCCOc2ccccc2 34a_100000185862_100000184471 [0,1,0,0,0,1|2,0,0]=4 8133 B18R2.270 Fc1ccc(cc1)NCCSc2ccccc2 34a_100000185862_100000246102 [0,1,0,0,0,1|2,0,0]=4 8134 B18R2.270 Fc1ccc(cc1)NCOCc2ccccc2 34a_100000185862_100000763385 [0,1,0,0,0,1|0,0,0]=2 8135 B18R2.270 Fc1ccc(cc1)NCSCc2ccccc2 34a_100000185862_200011217039 [0,1,0,0,0,1|0,1,0]=3 8136 B18R2.270 Fc1ccc(cc1)NN=CCc2ccccc2 4a_100000728448_100000209964 [0,1,0,0,0,1|2,0,0]=4 8137 B18R2.270 Fc1ccc(cc1)OC/C=C/c2ccccc2 34a_100000210339_100016265936 [0,1,0,0,0,1|1,0,1]=4 8138 B18R2.270 Fc1ccc(cc1)OCC#Cc2ccccc2 34a_100000210339_100011352542 [0,1,0,0,0,1|1,0,1]=4 8139 B18R2.270 Fc1ccc(cc1)OCCCc2ccccc2 34a_100000210339_100000211621 [0,1,0,0,0,1|1,0,0]=3 8140 B18R2.270 Fc1ccc(cc1)OCCNc2ccccc2 34a_100000106764_100000184936 [0,1,0,0,0,1|2,0,0]=4 8141 B18R2.270 Fc1ccc(cc1)OCCOc2ccccc2 34a_100000210339_100000184471 [0,1,0,0,0,1|2,0,0]=4 8142 B18R2.270 Fc1ccc(cc1)OCCOc2ccccc2 34a_100000210340_100000184936 [0,1,0,0,0,1|2,0,0]=4 8143 B18R2.270 Fc1ccc(cc1)OCCOc2ccccc2 7a_100000210340_100000184936 [0,1,0,0,0,1|2,0,0]=4 8144 B18R2.270 Fc1ccc(cc1)OCCSc2ccccc2 34a_100000210339_100000246102 [0,1,0,0,0,1|2,0,0]=4 8145 B18R2.270 Fc1ccc(cc1)OCCSc2ccccc2 62a_100000184936_100000041952 [0,1,0,0,0,1|2,0,0]=4 8146 B18R2.270 Fc1ccc(cc1)OCCSc2ccccc2 62a_100000719477_100000184936 [0,1,0,0,0,1|2,0,0]=4 8147 B18R2.270 Fc1ccc(cc1)OCOCc2ccccc2 34a_100000210339_100000763385 [0,1,0,0,0,1|0,0,0]=2 8148 B18R2.270 Fc1ccc(cc1)OCSCc2ccccc2 34a_100000210339_200011217039 [0,1,0,0,0,1|0,1,0]=3 8149 B18R2.270 Fc1ccc(cc1)SC/C=C/c2ccccc2 62a_100000211213_100016265936 [0,1,0,0,0,1|1,0,1]=4 8150 B18R2.270 Fc1ccc(cc1)SC/C=C/c2ccccc2 62a_100016265936_100000211213 [0,1,0,0,0,1|1,0,1]=4 8151 B18R2.270 Fc1ccc(cc1)SCC#Cc2ccccc2 62a_100000211213_100011352542 [0,1,0,0,0,1|1,0,1]=4 8152 B18R2.270 Fc1ccc(cc1)SCCCc2ccccc2 62a_100000211213_100000211621 [0,1,0,0,0,1|1,0,0]=3 8153 B18R2.270 Fc1ccc(cc1)SCCCc2ccccc2 62a_100000211621_100000211213 [0,1,0,0,0,1|1,0,0]=3 8154 B18R2.270 Fc1ccc(cc1)SCCOc2ccccc2 62a_100000184471_100000211213 [0,1,0,0,0,1|2,0,0]=4 8155 B18R2.270 Fc1ccc(cc1)SCCOc2ccccc2 62a_100000211213_100000184471 [0,1,0,0,0,1|2,0,0]=4 8156 B18R2.270 Fc1ccc(cc1)SCCSc2ccccc2 62a_100000211213_100000246102 [0,1,0,0,0,1|2,0,0]=4 8157 B18R2.270 Fc1ccc(cc1)SCCSc2ccccc2 62a_100000246102_100000211213 [0,1,0,0,0,1|2,0,0]=4 8158 B18R2.270 Fc1ccc(cc1)SCOCc2ccccc2 62a_100000211213_100000763385 [0,1,0,0,0,1|0,0,0]=2 8159 B18R2.270 Fc1ccc(cc1)SCOCc2ccccc2 62a_100000763385_100000211213 [0,1,0,0,0,1|0,0,0]=2 8160 B18R2.270 Fc1ccc(cc1)SCSCc2ccccc2 62a_100000211213_200011217039 [0,1,0,0,0,1|0,1,0]=3 8161 B18R2.270 Fc1ccc(cc1)SCSCc2ccccc2 62a_200011217039_100000211213 [0,1,0,0,0,1|0,1,0]=3 8162 B18R2.270 Fc1ccc(cn1)CNCCc2ccccc2 2230a_100000101913_100000765856 [0,1,0,0,0,1|2,0,0]=4 8163 B18R2.270 Fc1ccc(cn1)CNCCc2ccccc2 2230a_100000106460_100009820150 [0,1,0,0,0,1|2,0,0]=4 8164 B18R2.270 Fc1ccc(cn1)CNCCc2ccccc2 34a_100000101913_100000765856 [0,1,0,0,0,1|2,0,0]=4 8165 B18R2.270 Fc1ccc(cn1)CNCCc2ccccc2 34a_100000106460_100000099788 [0,1,0,0,0,1|2,0,0]=4 8166 B18R2.270 Fc1ccc(cn1)CNCSc2ccccc2 2230a_100000101913_100011218342 [0,1,0,0,0,1|2,0,0]=4 8167 B18R2.270 Fc1ccc(cn1)COCCc2ccccc2 34a_100000079959_100000765856 [0,1,0,0,0,1|1,0,0]=3 8168 B18R2.270 Fc1ccc(cn1)COCCc2ccccc2 34a_100000210268_100000099788 [0,1,0,0,0,1|1,0,0]=3 8169 B18R2.270 Fc1ccc(cn1)COCCc2ccccc2 7a_100000210268_100009820150 [0,1,0,0,0,1|1,0,0]=3 8170 B18R2.270 Fc1ccc(cn1)COCCc2ccccn2 34a_100000210271_100000099788 [0,1,0,0,0,1|2,0,0]=4 8171 B18R2.270 Fc1ccc(cn1)COCCc2cccnc2 34a_100011217484_100000099788 [0,1,0,0,0,1|2,0,0]=4 8172 B18R2.270 Fc1ccc(cn1)COCCc2ccncc2 34a_100011216225_100000099788 [0,1,0,0,0,1|2,0,0]=4 8173 B18R2.270 Fc1ccc(cn1)CSCCc2ccccc2 62a_100000765856_100000099788 [0,1,0,0,0,1|1,1,0]=4 8174 B18R2.270 Fc1ccc(cn1)CSCCc2ccccc2 62a_100009820150_100011218657 [0,1,0,0,0,1|1,1,0]=4 8175 B18R2.270 Fc1ccc(cn1)CSCSc2ccccc2 62a_100009820150_100011218342 [0,1,0,0,0,1|1,1,0]=4 8176 B18R2.270 Fc1ccc(cn1)CSCSc2ccccc2 62a_100011218342_100000099788 [0,1,0,0,0,1|1,1,0]=4 8177 B18R2.270 Fc1ccc(cn1)OCCCc2ccccc2 34a_100000688820_100000211621 [0,1,0,0,0,1|2,0,0]=4 8178 B18R2.270 Fc1ccc(cn1)OCCCc2ccccc2 7a_100000688820_100000211621 [0,1,0,0,0,1|2,0,0]=4 8179 B18R2.270 Fc1ccc(cn1)OCOCc2ccccc2 34a_100000688820_100000763385 [0,1,0,0,0,1|1,0,0]=3 8180 B18R2.270 Fc1ccc(cn1)OCSCc2ccccc2 34a_100000688820_200011217039 [0,1,0,0,0,1|1,1,0]=4 8181 B18R2.270 Fc1ccc(cn1)SCCCc2ccccc2 62a_100000042367_100000211621 [0,1,0,0,0,1|2,0,0]=4 8182 B18R2.270 Fc1ccc(cn1)SCCCc2ccccc2 62a_100000211621_100000042367 [0,1,0,0,0,1|2,0,0]=4 8183 B18R2.270 Fc1ccc(cn1)SCOCc2ccccc2 62a_100000042367_100000763385 [0,1,0,0,0,1|1,0,0]=3 8184 B18R2.270 Fc1ccc(cn1)SCOCc2ccccc2 62a_100000763385_100000042367 [0,1,0,0,0,1|1,0,0]=3 8185 B18R2.270 Fc1ccc(cn1)SCSCc2ccccc2 62a_100000042367_200011217039 [0,1,0,0,0,1|1,1,0]=4 8186 B18R2.270 Fc1ccc(cn1)SCSCc2ccccc2 62a_200011217039_100000042367 [0,1,0,0,0,1|1,1,0]=4 8187 B18R2.270 Fc1ccc(nc1)CNCCc2ccccc2 207a_100000106460_100011934744 [0,1,0,0,0,1|2,0,0]=4 8188 B18R2.270 Fc1ccc(nc1)CNCCc2ccccc2 2230a_100000106460_100000703193 [0,1,0,0,0,1|2,0,0]=4 8189 B18R2.270 Fc1ccc(nc1)CNCCc2ccccc2 270004a_100000106460_100011934744 [0,1,0,0,0,1|2,0,0]=4 8190 B18R2.270 Fc1ccc(nc1)CNCCc2ccccc2 34a_100000106460_100000703193 [0,1,0,0,0,1|2,0,0]=4 8191 B18R2.270 Fc1ccc(nc1)CNCCc2ccccc2 34a_100020620131_100000765856 [0,1,0,0,0,1|2,0,0]=4 8192 B18R2.270 Fc1ccc(nc1)COCCc2ccccc2 34a_100000210268_100000703193 [0,1,0,0,0,1|1,0,0]=3 8193 B18R2.270 Fc1ccc(nc1)COCCc2ccccc2 34a_100011999454_100000765856 [0,1,0,0,0,1|1,0,0]=3 8194 B18R2.270 Fc1ccc(nc1)COCCc2ccccc2 7a_100000210268_100000703193 [0,1,0,0,0,1|1,0,0]=3 8195 B18R2.270 Fc1ccc(nc1)COCCc2ccccn2 34a_100000210271_100000703193 [0,1,0,0,0,1|2,0,0]=4 8196 B18R2.270 Fc1ccc(nc1)COCCc2cccnc2 34a_100011217484_100000703193 [0,1,0,0,0,1|2,0,0]=4 8197 B18R2.270 Fc1ccc(nc1)COCCc2ccncc2 34a_100011216225_100000703193 [0,1,0,0,0,1|2,0,0]=4 8198 B18R2.270 Fc1ccc(nc1)CSCCc2ccccc2 62a_100000703193_100011218657 [0,1,0,0,0,1|1,1,0]=4 8199 B18R2.270 Fc1ccc(nc1)CSCCc2ccccc2 62a_100000765856_100000703193 [0,1,0,0,0,1|1,1,0]=4 8200 B18R2.270 Fc1ccc(nc1)CSCSc2ccccc2 62a_100000703193_100011218342 [0,1,0,0,0,1|1,1,0]=4 8201 B18R2.270 Fc1ccc(nc1)CSCSc2ccccc2 62a_100011218342_100000703193 [0,1,0,0,0,1|1,1,0]=4 8202 B18R2.270 Fc1ccc(nc1)OCCCc2ccccc2 34a_100000742473_100000211621 [0,1,0,0,0,1|2,0,0]=4 8203 B18R2.270 Fc1ccc(nc1)OCOCc2ccccc2 34a_100000742473_100000763385 [0,1,0,0,0,1|1,0,0]=3 8204 B18R2.270 Fc1ccc(nc1)OCSCc2ccccc2 34a_100000742473_200011217039 [0,1,0,0,0,1|1,1,0]=4 8205 B18R2.270 Fc1ccc(nc1)SCCCc2ccccc2 62a_100000211621_100000744514 [0,1,0,0,0,1|2,0,0]=4 8206 B18R2.270 Fc1ccc(nc1)SCCCc2ccccc2 62a_100000744514_100000211621 [0,1,0,0,0,1|2,0,0]=4 8207 B18R2.270 Fc1ccc(nc1)SCOCc2ccccc2 62a_100000744514_100000763385 [0,1,0,0,0,1|1,0,0]=3 8208 B18R2.270 Fc1ccc(nc1)SCOCc2ccccc2 62a_100000763385_100000744514 [0,1,0,0,0,1|1,0,0]=3 8209 B18R2.270 Fc1ccc(nc1)SCSCc2ccccc2 62a_100000744514_200011217039 [0,1,0,0,0,1|1,1,0]=4 8210 B18R2.270 Fc1ccc(nc1)SCSCc2ccccc2 62a_200011217039_100000744514 [0,1,0,0,0,1|1,1,0]=4 8211 B18R2.270 Fc1cnc(cn1)SCOCc2ccccc2 62a_100000763385_100009856528 [0,1,0,0,0,1|2,0,0]=4 8212 B18R2.270 Fc1cnc(cn1)SCOCc2ccccc2 62a_100009856528_100000763385 [0,1,0,0,0,1|2,0,0]=4 8213 B18R2.270 Fc1cnc(nc1)OCOCc2ccccc2 34a_100011934040_100000763385 [0,1,0,0,0,1|2,0,0]=4 8214 B18R2.270 Fc1cnc(nc1)SCOCc2ccccc2 62a_100000685220_100000763385 [0,1,0,0,0,1|2,0,0]=4 8215 B18R2.270 Fc1cnc(nc1)SCOCc2ccccc2 62a_100000763385_100000685220 [0,1,0,0,0,1|2,0,0]=4 8216 B18R2.270 Fc1ncc(cn1)OCOCc2ccccc2 34a_200009874573_100000763385 [0,1,0,0,0,1|2,0,0]=4 8217 B18R2.270 Fc1ncc(cn1)SCOCc2ccccc2 62a_100000685262_100000763385 [0,1,0,0,0,1|2,0,0]=4 8218 B18R2.270 Fc1ncc(cn1)SCOCc2ccccc2 62a_100000763385_100000685262 [0,1,0,0,0,1|2,0,0]=4 8219 B18R2.270 Ic1ccc(cc1)C=NNCc2ccccc2 4a_100000007032_100000188517 [0,1,0,0,0,1|1,0,1]=4 8220 B18R2.270 Ic1ccc(cc1)CCOCc2ccccc2 34a_100012291149_100015291786 [0,1,0,0,0,1|0,0,0]=2 8221 B18R2.270 Ic1ccc(cc1)CCOCc2ccccc2 7a_100012291149_100000211182 [0,1,0,0,0,1|0,0,0]=2 8222 B18R2.270 Ic1ccc(cc1)CCOCc2ccccn2 34a_100012291149_100000721315 [0,1,0,0,0,1|1,0,0]=3 8223 B18R2.270 Ic1ccc(cc1)CCOCc2ccccn2 7a_100012291149_100000721315 [0,1,0,0,0,1|1,0,0]=3 8224 B18R2.270 Ic1ccc(cc1)CCOCc2cccnc2 34a_100012291149_100000733263 [0,1,0,0,0,1|1,0,0]=3 8225 B18R2.270 Ic1ccc(cc1)CCOCc2cccnc2 7a_100012291149_100000741622 [0,1,0,0,0,1|1,0,0]=3 8226 B18R2.270 Ic1ccc(cc1)CCOCc2cccnn2 34a_100012291149_100016990269 [0,1,0,0,0,1|2,0,0]=4 8227 B18R2.270 Ic1ccc(cc1)CCOCc2cccnn2 7a_100012291149_100016990269 [0,1,0,0,0,1|2,0,0]=4 8228 B18R2.270 Ic1ccc(cc1)CCOCc2ccncc2 7a_100012291149_100015193705 [0,1,0,0,0,1|1,0,0]=3 8229 B18R2.270 Ic1ccc(cc1)CCOCc2cnccn2 34a_100012291149_100016995436 [0,1,0,0,0,1|2,0,0]=4 8230 B18R2.270 Ic1ccc(cc1)CCOCc2cnccn2 7a_100012291149_100016995436 [0,1,0,0,0,1|2,0,0]=4 8231 B18R2.270 Ic1ccc(cc1)CCOCc2cncnc2 34a_100012291149_100015196519 [0,1,0,0,0,1|2,0,0]=4 8232 B18R2.270 Ic1ccc(cc1)CCOCc2cncnc2 7a_100012291149_100015196519 [0,1,0,0,0,1|2,0,0]=4 8233 B18R2.270 Ic1ccc(cc1)CCOCc2ncccn2 34a_100012291149_100000703007 [0,1,0,0,0,1|2,0,0]=4 8234 B18R2.270 Ic1ccc(cc1)CCOCc2ncccn2 7a_100012291149_100000703007 [0,1,0,0,0,1|2,0,0]=4 8235 B18R2.270 Ic1ccc(cc1)CNCCc2ccccc2 207a_100000106460_100000188517 [0,1,0,0,0,1|1,0,0]=3 8236 B18R2.270 Ic1ccc(cc1)CNCCc2ccccc2 2230a_100000106460_100000189116 [0,1,0,0,0,1|1,0,0]=3 8237 B18R2.270 Ic1ccc(cc1)CNCCc2ccccc2 2230a_100016989417_100000765856 [0,1,0,0,0,1|1,0,0]=3 8238 B18R2.270 Ic1ccc(cc1)CNCCc2ccccc2 34a_100000106460_100000189116 [0,1,0,0,0,1|1,0,0]=3 8239 B18R2.270 Ic1ccc(cc1)CNCCc2ccccc2 34a_100016989417_100000765856 [0,1,0,0,0,1|1,0,0]=3 8240 B18R2.270 Ic1ccc(cc1)CNCCc2ccccn2 207a_100000211156_100000188517 [0,1,0,0,0,1|2,0,0]=4 8241 B18R2.270 Ic1ccc(cc1)CNCCc2ccccn2 2230a_100016989417_100015183660 [0,1,0,0,0,1|2,0,0]=4 8242 B18R2.270 Ic1ccc(cc1)CNCCc2cccnc2 207a_100000736294_100000188517 [0,1,0,0,0,1|2,0,0]=4 8243 B18R2.270 Ic1ccc(cc1)CNCCc2cccnc2 2230a_100000736294_100000189116 [0,1,0,0,0,1|2,0,0]=4 8244 B18R2.270 Ic1ccc(cc1)CNCCc2cccnc2 2230a_100016989417_200011713674 [0,1,0,0,0,1|2,0,0]=4 8245 B18R2.270 Ic1ccc(cc1)CNCCc2ccncc2 207a_100000742849_100000188517 [0,1,0,0,0,1|2,0,0]=4 8246 B18R2.270 Ic1ccc(cc1)CNCCc2ccncc2 2230a_100016989417_100000723409 [0,1,0,0,0,1|2,0,0]=4 8247 B18R2.270 Ic1ccc(cc1)CNCSc2ccccc2 2230a_100016989417_100011218342 [0,1,0,0,0,1|1,0,0]=3 8248 B18R2.270 Ic1ccc(cc1)CNN=Cc2ccccc2 4a_102495363730_100015611070 [0,1,0,0,0,1|1,0,1]=4 8249 B18R2.270 Ic1ccc(cc1)COCCc2ccccc2 34a_100000210268_100000189116 [0,1,0,0,0,1|0,0,0]=2 8250 B18R2.270 Ic1ccc(cc1)COCCc2ccccc2 34a_100000690907_100000765856 [0,1,0,0,0,1|0,0,0]=2 8251 B18R2.270 Ic1ccc(cc1)COCCc2ccccc2 7a_100000210268_100000189116 [0,1,0,0,0,1|0,0,0]=2 8252 B18R2.270 Ic1ccc(cc1)COCCc2ccccc2 7a_100000690907_100000765856 [0,1,0,0,0,1|0,0,0]=2 8253 B18R2.270 Ic1ccc(cc1)COCCc2ccccn2 34a_100000210271_100000189116 [0,1,0,0,0,1|1,0,0]=3 8254 B18R2.270 Ic1ccc(cc1)COCCc2ccccn2 7a_100000690907_100015183660 [0,1,0,0,0,1|1,0,0]=3 8255 B18R2.270 Ic1ccc(cc1)COCCc2cccnc2 34a_100011217484_100000189116 [0,1,0,0,0,1|1,0,0]=3 8256 B18R2.270 Ic1ccc(cc1)COCCc2cccnc2 7a_100000690907_200011713674 [0,1,0,0,0,1|1,0,0]=3 8257 B18R2.270 Ic1ccc(cc1)COCCc2ccncc2 34a_100011216225_100000189116 [0,1,0,0,0,1|1,0,0]=3 8258 B18R2.270 Ic1ccc(cc1)COCCc2ccncc2 7a_100000690907_100000723409 [0,1,0,0,0,1|1,0,0]=3 8259 B18R2.270 Ic1ccc(cc1)COCCc2cnccn2 34a_100011349526_100000189116 [0,1,0,0,0,1|2,0,0]=4 8260 B18R2.270 Ic1ccc(cc1)COCCc2cncnc2 34a_100011709255_100000189116 [0,1,0,0,0,1|2,0,0]=4 8261 B18R2.270 Ic1ccc(cc1)CSCCc2ccccc2 62a_100000189116_100011218657 [0,1,0,0,0,1|0,1,0]=3 8262 B18R2.270 Ic1ccc(cc1)CSCCc2ccccc2 62a_100000765856_100000189116 [0,1,0,0,0,1|0,1,0]=3 8263 B18R2.270 Ic1ccc(cc1)CSCCc2ccccn2 62a_100000189116_100015183660 [0,1,0,0,0,1|1,1,0]=4 8264 B18R2.270 Ic1ccc(cc1)CSCCc2ccccn2 62a_100015183660_100000189116 [0,1,0,0,0,1|1,1,0]=4 8265 B18R2.270 Ic1ccc(cc1)CSCCc2cccnc2 62a_100000189116_200011713674 [0,1,0,0,0,1|1,1,0]=4 8266 B18R2.270 Ic1ccc(cc1)CSCCc2cccnc2 62a_200011713674_100000189116 [0,1,0,0,0,1|1,1,0]=4 8267 B18R2.270 Ic1ccc(cc1)CSCCc2ccncc2 62a_100000189116_100000723409 [0,1,0,0,0,1|1,1,0]=4 8268 B18R2.270 Ic1ccc(cc1)CSCCc2ccncc2 62a_100000723409_100000189116 [0,1,0,0,0,1|1,1,0]=4 8269 B18R2.270 Ic1ccc(cc1)CSCSc2ccccc2 62a_100000189116_100011218342 [0,1,0,0,0,1|0,1,0]=3 8270 B18R2.270 Ic1ccc(cc1)CSCSc2ccccc2 62a_100011218342_100000189116 [0,1,0,0,0,1|0,1,0]=3 8271 B18R2.270 Ic1ccc(cc1)NC/C=C/c2ccccc2 34a_100000185761_100016265936 [0,1,0,0,0,1|1,0,1]=4 8272 B18R2.270 Ic1ccc(cc1)NCC#Cc2ccccc2 34a_100000185761_100011352542 [0,1,0,0,0,1|1,0,1]=4 8273 B18R2.270 Ic1ccc(cc1)NCCCc2ccccc2 34a_100000185761_100000211621 [0,1,0,0,0,1|1,0,0]=3 8274 B18R2.270 Ic1ccc(cc1)NCCOc2ccccc2 34a_100000185761_100000184471 [0,1,0,0,0,1|2,0,0]=4 8275 B18R2.270 Ic1ccc(cc1)NCCSc2ccccc2 34a_100000185761_100000246102 [0,1,0,0,0,1|2,0,0]=4 8276 B18R2.270 Ic1ccc(cc1)NCOCc2ccccc2 34a_100000185761_100000763385 [0,1,0,0,0,1|0,0,0]=2 8277 B18R2.270 Ic1ccc(cc1)NCSCc2ccccc2 34a_100000185761_200011217039 [0,1,0,0,0,1|0,1,0]=3 8278 B18R2.270 Ic1ccc(cc1)NN=CCc2ccccc2 4a_100016988836_100000209964 [0,1,0,0,0,1|2,0,0]=4 8279 B18R2.270 Ic1ccc(cc1)OC/C=C/c2ccccc2 34a_100000212066_100016265936 [0,1,0,0,0,1|1,0,1]=4 8280 B18R2.270 Ic1ccc(cc1)OC/C=C/c2ccccc2 7a_100000212066_100016265936 [0,1,0,0,0,1|1,0,1]=4 8281 B18R2.270 Ic1ccc(cc1)OCC#Cc2ccccc2 34a_100000212066_100011352542 [0,1,0,0,0,1|1,0,1]=4 8282 B18R2.270 Ic1ccc(cc1)OCC#Cc2ccccc2 7a_100000212066_100011352542 [0,1,0,0,0,1|1,0,1]=4 8283 B18R2.270 Ic1ccc(cc1)OCCCc2ccccc2 34a_100000212066_100000211621 [0,1,0,0,0,1|1,0,0]=3 8284 B18R2.270 Ic1ccc(cc1)OCCCc2ccccc2 7a_100000212066_100000211621 [0,1,0,0,0,1|1,0,0]=3 8285 B18R2.270 Ic1ccc(cc1)OCCOc2ccccc2 34a_100000212066_100000184471 [0,1,0,0,0,1|2,0,0]=4 8286 B18R2.270 Ic1ccc(cc1)OCCOc2ccccc2 7a_100000212066_100000184471 [0,1,0,0,0,1|2,0,0]=4 8287 B18R2.270 Ic1ccc(cc1)OCCSc2ccccc2 34a_100000212066_100000246102 [0,1,0,0,0,1|2,0,0]=4 8288 B18R2.270 Ic1ccc(cc1)OCCSc2ccccc2 7a_100000212066_100000246102 [0,1,0,0,0,1|2,0,0]=4 8289 B18R2.270 Ic1ccc(cc1)OCOCc2ccccc2 34a_100000212066_100000763385 [0,1,0,0,0,1|0,0,0]=2 8290 B18R2.270 Ic1ccc(cc1)OCSCc2ccccc2 34a_100000212066_200011217039 [0,1,0,0,0,1|0,1,0]=3 8291 B18R2.270 Ic1ccc(cn1)OCCCc2ccccc2 34a_100000687607_100000211621 [0,1,0,0,0,1|2,0,0]=4 8292 B18R2.270 Ic1ccc(cn1)OCCCc2ccccc2 7a_100000687607_100000211621 [0,1,0,0,0,1|2,0,0]=4 8293 B18R2.270 Ic1ccc(cn1)OCOCc2ccccc2 34a_100000687607_100000763385 [0,1,0,0,0,1|1,0,0]=3 8294 B18R2.270 Ic1ccc(cn1)OCSCc2ccccc2 34a_100000687607_200011217039 [0,1,0,0,0,1|1,1,0]=4 8295 B18R2.270 Nc1ccc(cc1)CCOCc2ccccc2 34a_100011204434_100015291786 [0,1,0,0,0,1|0,0,0]=2 8296 B18R2.270 Nc1ccc(cc1)CCOCc2ccccn2 34a_100011204434_100000721315 [0,1,0,0,0,1|1,0,0]=3 8297 B18R2.270 Nc1ccc(cc1)CCOCc2cccnc2 34a_100011204434_100000733263 [0,1,0,0,0,1|1,0,0]=3 8298 B18R2.270 Nc1ccc(cc1)CCOCc2cccnn2 34a_100011204434_100016990269 [0,1,0,0,0,1|2,0,0]=4 8299 B18R2.270 Nc1ccc(cc1)CCOCc2cnccn2 34a_100011204434_100016995436 [0,1,0,0,0,1|2,0,0]=4 8300 B18R2.270 Nc1ccc(cc1)CCOCc2cncnc2 34a_100011204434_100015196519 [0,1,0,0,0,1|2,0,0]=4 8301 B18R2.270 Nc1ccc(cc1)CCOCc2ncccn2 34a_100011204434_100000703007 [0,1,0,0,0,1|2,0,0]=4 8302 B18R2.270 Nc1ccc(cc1)COCCc2ccccc2 34a_100011215238_100000765856 [0,1,0,0,0,1|0,0,0]=2 8303 B18R2.270 Nc1ccc(cc1)OC/C=C/c2ccccc2 34a_100000185829_100016265936 [0,1,0,0,0,1|1,0,1]=4 8304 B18R2.270 Nc1ccc(cc1)OCC#Cc2ccccc2 34a_100000185829_100011352542 [0,1,0,0,0,1|1,0,1]=4 8305 B18R2.270 Nc1ccc(cc1)OCCCc2ccccc2 34a_100000185829_100000211621 [0,1,0,0,0,1|1,0,0]=3 8306 B18R2.270 Nc1ccc(cc1)OCCOc2ccccc2 34a_100000185829_100000184471 [0,1,0,0,0,1|2,0,0]=4 8307 B18R2.270 Nc1ccc(cc1)OCCSc2ccccc2 34a_100000185829_100000246102 [0,1,0,0,0,1|2,0,0]=4 8308 B18R2.270 Nc1ccc(cc1)OCOCc2ccccc2 34a_100000185829_100000763385 [0,1,0,0,0,1|0,0,0]=2 8309 B18R2.270 Nc1ccc(cc1)OCSCc2ccccc2 34a_100000185829_200011217039 [0,1,0,0,0,1|0,1,0]=3 8310 B18R2.270 Nc1ccc(cc1)SC/C=C/c2ccccc2 62a_100000185761_100016265936 [0,1,0,0,0,1|1,0,1]=4 8311 B18R2.270 Nc1ccc(cc1)SC/C=C/c2ccccc2 62a_100016265936_100000185761 [0,1,0,0,0,1|1,0,1]=4 8312 B18R2.270 Nc1ccc(cc1)SCC#Cc2ccccc2 62a_100000185761_100011352542 [0,1,0,0,0,1|1,0,1]=4 8313 B18R2.270 Nc1ccc(cc1)SCCCc2ccccc2 62a_100000185761_100000211621 [0,1,0,0,0,1|1,0,0]=3 8314 B18R2.270 Nc1ccc(cc1)SCCCc2ccccc2 62a_100000211621_100000185761 [0,1,0,0,0,1|1,0,0]=3 8315 B18R2.270 Nc1ccc(cc1)SCCOc2ccccc2 62a_100000184471_100000185761 [0,1,0,0,0,1|2,0,0]=4 8316 B18R2.270 Nc1ccc(cc1)SCCOc2ccccc2 62a_100000185761_100000184471 [0,1,0,0,0,1|2,0,0]=4 8317 B18R2.270 Nc1ccc(cc1)SCCSc2ccccc2 62a_100000185761_100000246102 [0,1,0,0,0,1|2,0,0]=4 8318 B18R2.270 Nc1ccc(cc1)SCCSc2ccccc2 62a_100000246102_100000185761 [0,1,0,0,0,1|2,0,0]=4 8319 B18R2.270 Nc1ccc(cc1)SCOCc2ccccc2 62a_100000185761_100000763385 [0,1,0,0,0,1|0,0,0]=2 8320 B18R2.270 Nc1ccc(cc1)SCOCc2ccccc2 62a_100000763385_100000185761 [0,1,0,0,0,1|0,0,0]=2 8321 B18R2.270 Nc1ccc(cc1)SCSCc2ccccc2 62a_100000185761_200011217039 [0,1,0,0,0,1|0,1,0]=3 8322 B18R2.270 Nc1ccc(cc1)SCSCc2ccccc2 62a_200011217039_100000185761 [0,1,0,0,0,1|0,1,0]=3 8323 B18R2.270 Nc1ccc(cn1)COCCc2ccccc2 34a_100000704267_100000765856 [0,1,0,0,0,1|1,0,0]=3 8324 B18R2.270 Nc1ccc(cn1)OCCCc2ccccc2 34a_100015188713_100000211621 [0,1,0,0,0,1|2,0,0]=4 8325 B18R2.270 Nc1ccc(cn1)OCCCc2ccccc2 7a_100015188713_100000211621 [0,1,0,0,0,1|2,0,0]=4 8326 B18R2.270 Nc1ccc(cn1)OCOCc2ccccc2 34a_100015188713_100000763385 [0,1,0,0,0,1|1,0,0]=3 8327 B18R2.270 Nc1ccc(cn1)OCSCc2ccccc2 34a_100015188713_200011217039 [0,1,0,0,0,1|1,1,0]=4 8328 B18R2.270 Nc1ccc(cn1)SCCCc2ccccc2 62a_100000187370_100000211621 [0,1,0,0,0,1|2,0,0]=4 8329 B18R2.270 Nc1ccc(cn1)SCCCc2ccccc2 62a_100000211621_100000187370 [0,1,0,0,0,1|2,0,0]=4 8330 B18R2.270 Nc1ccc(cn1)SCOCc2ccccc2 62a_100000187370_100000763385 [0,1,0,0,0,1|1,0,0]=3 8331 B18R2.270 Nc1ccc(cn1)SCOCc2ccccc2 62a_100000763385_100000187370 [0,1,0,0,0,1|1,0,0]=3 8332 B18R2.270 Nc1ccc(cn1)SCSCc2ccccc2 62a_100000187370_200011217039 [0,1,0,0,0,1|1,1,0]=4 8333 B18R2.270 Nc1ccc(cn1)SCSCc2ccccc2 62a_200011217039_100000187370 [0,1,0,0,0,1|1,1,0]=4 8334 B18R2.270 Nc1ccc(nc1)COCCc2ccccc2 34a_100011998161_100000765856 [0,1,0,0,0,1|1,0,0]=3 8335 B18R2.270 Nc1ccc(nc1)OCCCc2ccccc2 34a_100000729260_100000211621 [0,1,0,0,0,1|2,0,0]=4 8336 B18R2.270 Nc1ccc(nc1)OCOCc2ccccc2 34a_100000729260_100000763385 [0,1,0,0,0,1|1,0,0]=3 8337 B18R2.270 Nc1ccc(nc1)OCSCc2ccccc2 34a_100000729260_200011217039 [0,1,0,0,0,1|1,1,0]=4 8338 B18R2.270 Nc1ccc(nc1)SCCCc2ccccc2 62a_100000211621_100000737798 [0,1,0,0,0,1|2,0,0]=4 8339 B18R2.270 Nc1ccc(nc1)SCCCc2ccccc2 62a_100000737798_100000211621 [0,1,0,0,0,1|2,0,0]=4 8340 B18R2.270 Nc1ccc(nc1)SCOCc2ccccc2 62a_100000737798_100000763385 [0,1,0,0,0,1|1,0,0]=3 8341 B18R2.270 Nc1ccc(nc1)SCOCc2ccccc2 62a_100000763385_100000737798 [0,1,0,0,0,1|1,0,0]=3 8342 B18R2.270 Nc1ccc(nc1)SCSCc2ccccc2 62a_100000737798_200011217039 [0,1,0,0,0,1|1,1,0]=4 8343 B18R2.270 Nc1ccc(nc1)SCSCc2ccccc2 62a_200011217039_100000737798 [0,1,0,0,0,1|1,1,0]=4 8344 B18R2.270 Nc1ccc(nn1)SCOCc2ccccc2 62a_100000763385_100010219413 [0,1,0,0,0,1|2,0,0]=4 8345 B18R2.270 Nc1ccc(nn1)SCOCc2ccccc2 62a_100010219413_100000763385 [0,1,0,0,0,1|2,0,0]=4 8346 B18R2.270 Nc1cnc(cn1)SCOCc2ccccc2 62a_100000744751_100000763385 [0,1,0,0,0,1|2,0,0]=4 8347 B18R2.270 Nc1cnc(cn1)SCOCc2ccccc2 62a_100000763385_100000744751 [0,1,0,0,0,1|2,0,0]=4 8348 B18R2.270 Nc1cnc(nc1)SCOCc2ccccc2 62a_100000068403_100000763385 [0,1,0,0,0,1|2,0,0]=4 8349 B18R2.270 Nc1cnc(nc1)SCOCc2ccccc2 62a_100000763385_100000068403 [0,1,0,0,0,1|2,0,0]=4 8350 B18R2.270 Nc1ncc(cn1)OCOCc2ccccc2 34a_100000087137_100000763385 [0,1,0,0,0,1|2,0,0]=4 8351 B18R2.270 Nc1ncc(cn1)SCOCc2ccccc2 62a_100000763385_100000766020 [0,1,0,0,0,1|2,0,0]=4 8352 B18R2.270 Nc1ncc(cn1)SCOCc2ccccc2 62a_100000766020_100000763385 [0,1,0,0,0,1|2,0,0]=4 8353 B18R2.270 O=c1ccc(c[nH]1)COCCc2ccccc2 34a_100011999846_100000765856 [0,1,0,0,0,1|1,0,0]=3 8354 B18R2.270 O=c1ccc(c[nH]1)OCCCc2ccccc2 34a_100000075641_100000211621 [0,1,0,0,0,1|2,0,0]=4 8355 B18R2.270 O=c1ccc(c[nH]1)OCOCc2ccccc2 34a_100000075641_100000763385 [0,1,0,0,0,1|1,0,0]=3 8356 B18R2.270 O=c1ccc(c[nH]1)OCSCc2ccccc2 34a_100000075641_200011217039 [0,1,0,0,0,1|1,1,0]=4 8357 B18R2.270 O=c1ccc(c[nH]1)SCCCc2ccccc2 62a_100000211621_100000212171 [0,1,0,0,0,1|2,0,0]=4 8358 B18R2.270 O=c1ccc(c[nH]1)SCCCc2ccccc2 62a_100000212171_100000211621 [0,1,0,0,0,1|2,0,0]=4 8359 B18R2.270 O=c1ccc(c[nH]1)SCOCc2ccccc2 62a_100000212171_100000763385 [0,1,0,0,0,1|1,0,0]=3 8360 B18R2.270 O=c1ccc(c[nH]1)SCOCc2ccccc2 62a_100000763385_100000212171 [0,1,0,0,0,1|1,0,0]=3 8361 B18R2.270 O=c1ccc(c[nH]1)SCSCc2ccccc2 62a_100000212171_200011217039 [0,1,0,0,0,1|1,1,0]=4 8362 B18R2.270 O=c1ccc(c[nH]1)SCSCc2ccccc2 62a_200011217039_100000212171 [0,1,0,0,0,1|1,1,0]=4 8363 B18R2.270 O=c1ccc(n[nH]1)SCOCc2ccccc2 62a_100000763385_100009820020 [0,1,0,0,0,1|2,0,0]=4 8364 B18R2.270 O=c1ccc(n[nH]1)SCOCc2ccccc2 62a_100009820020_100000763385 [0,1,0,0,0,1|2,0,0]=4 8365 B18R2.270 O=c1ncc(c[nH]1)SCOCc2ccccc2 62a_100000763385_102495366499 [0,1,0,0,0,1|2,0,0]=4 8366 B18R2.270 O=c1ncc(c[nH]1)SCOCc2ccccc2 62a_102495366499_100000763385 [0,1,0,0,0,1|2,0,0]=4 8367 B18R2.270 Oc1ccc(cc1)C=NNCc2ccccc2 4a_100000007032_100000185832 [0,1,0,0,0,1|1,0,1]=4 8368 B18R2.270 Oc1ccc(cc1)CCNCc2ccccc2 207a_100000743037_100015611070 [0,1,0,0,0,1|1,0,0]=3 8369 B18R2.270 Oc1ccc(cc1)CCNCc2ccccc2 2230a_100015324214_100009816426 [0,1,0,0,0,1|1,0,0]=3 8370 B18R2.270 Oc1ccc(cc1)CCNCc2ccccc2 270004a_100000743037_100015611070 [0,1,0,0,0,1|1,0,0]=3 8371 B18R2.270 Oc1ccc(cc1)CCNCc2ccccc2 34a_100000743037_100015291786 [0,1,0,0,0,1|1,0,0]=3 8372 B18R2.270 Oc1ccc(cc1)CCNCc2ccccn2 207a_100000743037_100000209966 [0,1,0,0,0,1|2,0,0]=4 8373 B18R2.270 Oc1ccc(cc1)CCNCc2ccccn2 270004a_100000743037_100000209966 [0,1,0,0,0,1|2,0,0]=4 8374 B18R2.270 Oc1ccc(cc1)CCNCc2ccccn2 34a_100000743037_100000721315 [0,1,0,0,0,1|2,0,0]=4 8375 B18R2.270 Oc1ccc(cc1)CCNCc2cccnc2 207a_100000743037_100000209961 [0,1,0,0,0,1|2,0,0]=4 8376 B18R2.270 Oc1ccc(cc1)CCNCc2cccnc2 270004a_100000743037_100000209961 [0,1,0,0,0,1|2,0,0]=4 8377 B18R2.270 Oc1ccc(cc1)CCNCc2cccnc2 34a_100000743037_100000733263 [0,1,0,0,0,1|2,0,0]=4 8378 B18R2.270 Oc1ccc(cc1)CCNCc2ccncc2 207a_100000743037_100000186114 [0,1,0,0,0,1|2,0,0]=4 8379 B18R2.270 Oc1ccc(cc1)CCOCc2ccccc2 7a_100000210790_100009816426 [0,1,0,0,0,1|0,0,0]=2 8380 B18R2.270 Oc1ccc(cc1)CCSCc2ccccc2 62a_100000211182_100009816426 [0,1,0,0,0,1|0,1,0]=3 8381 B18R2.270 Oc1ccc(cc1)CCSCc2ccccc2 62a_100009816426_100015291786 [0,1,0,0,0,1|0,1,0]=3 8382 B18R2.270 Oc1ccc(cc1)CCSCc2ccccn2 62a_100000721315_100009816426 [0,1,0,0,0,1|1,1,0]=4 8383 B18R2.270 Oc1ccc(cc1)CCSCc2ccccn2 62a_100009816426_100000721315 [0,1,0,0,0,1|1,1,0]=4 8384 B18R2.270 Oc1ccc(cc1)CCSCc2cccnc2 62a_100000741622_100009816426 [0,1,0,0,0,1|1,1,0]=4 8385 B18R2.270 Oc1ccc(cc1)CCSCc2cccnc2 62a_100009816426_100000741622 [0,1,0,0,0,1|1,1,0]=4 8386 B18R2.270 Oc1ccc(cc1)CCSCc2ccncc2 62a_100009816426_100015193705 [0,1,0,0,0,1|1,1,0]=4 8387 B18R2.270 Oc1ccc(cc1)CCSCc2ccncc2 62a_100015193705_100009816426 [0,1,0,0,0,1|1,1,0]=4 8388 B18R2.270 Oc1ccc(cc1)CNCCc2ccccc2 34a_100000185549_100000765856 [0,1,0,0,0,1|1,0,0]=3 8389 B18R2.270 Oc1ccc(cc1)NC/C=C/c2ccccc2 34a_100000185829_100016265936 [0,1,0,0,0,1|1,0,1]=4 8390 B18R2.270 Oc1ccc(cc1)NCC#Cc2ccccc2 34a_100000185829_100011352542 [0,1,0,0,0,1|1,0,1]=4 8391 B18R2.270 Oc1ccc(cc1)NCCCc2ccccc2 34a_100000185829_100000211621 [0,1,0,0,0,1|1,0,0]=3 8392 B18R2.270 Oc1ccc(cc1)NCCOc2ccccc2 34a_100000185829_100000184471 [0,1,0,0,0,1|2,0,0]=4 8393 B18R2.270 Oc1ccc(cc1)NCCSc2ccccc2 34a_100000185829_100000246102 [0,1,0,0,0,1|2,0,0]=4 8394 B18R2.270 Oc1ccc(cc1)NCOCc2ccccc2 34a_100000185829_100000763385 [0,1,0,0,0,1|0,0,0]=2 8395 B18R2.270 Oc1ccc(cc1)NCSCc2ccccc2 34a_100000185829_200011217039 [0,1,0,0,0,1|0,1,0]=3 8396 B18R2.270 Oc1ccc(cc1)SC/C=C/c2ccccc2 62a_100016265936_100000185759 [0,1,0,0,0,1|1,0,1]=4 8397 B18R2.270 Oc1ccc(cc1)SCCCc2ccccc2 62a_100000211621_100000185759 [0,1,0,0,0,1|1,0,0]=3 8398 B18R2.270 Oc1ccc(cc1)SCCOc2ccccc2 62a_100000184471_100000185759 [0,1,0,0,0,1|2,0,0]=4 8399 B18R2.270 Oc1ccc(cc1)SCCSc2ccccc2 62a_100000246102_100000185759 [0,1,0,0,0,1|2,0,0]=4 8400 B18R2.270 Oc1ccc(cc1)SCOCc2ccccc2 62a_100000763385_100000185759 [0,1,0,0,0,1|0,0,0]=2 8401 B18R2.270 Oc1ccc(cc1)SCSCc2ccccc2 62a_200011217039_100000185759 [0,1,0,0,0,1|0,1,0]=3 8402 B18R2.270 Oc1ccc(cn1)CNCCc2ccccc2 207a_100000106460_100011361521 [0,1,0,0,0,1|2,0,0]=4 8403 B18R2.270 Oc1ccc(cn1)CNCCc2ccccc2 2230a_100000757128_100000765856 [0,1,0,0,0,1|2,0,0]=4 8404 B18R2.270 Oc1ccc(cn1)CNCSc2ccccc2 2230a_100000757128_100011218342 [0,1,0,0,0,1|2,0,0]=4 8405 B18R2.270 Oc1ccc(nc1)SCCCc2ccccc2 62a_100000211621_100000744096 [0,1,0,0,0,1|2,0,0]=4 8406 B18R2.270 Oc1ccc(nc1)SCCCc2ccccc2 62a_100000685995_100000211621 [0,1,0,0,0,1|2,0,0]=4 8407 B18R2.270 Oc1ccc(nc1)SCOCc2ccccc2 62a_100000685995_100000763385 [0,1,0,0,0,1|1,0,0]=3 8408 B18R2.270 Oc1ccc(nc1)SCOCc2ccccc2 62a_100000763385_100000744096 [0,1,0,0,0,1|1,0,0]=3 8409 B18R2.270 Oc1ccc(nc1)SCSCc2ccccc2 62a_100000685995_200011217039 [0,1,0,0,0,1|1,1,0]=4 8410 B18R2.270 Oc1ccc(nc1)SCSCc2ccccc2 62a_200011217039_100000744096 [0,1,0,0,0,1|1,1,0]=4 8411 B18R2.270 Oc1cnc(cn1)SCOCc2ccccc2 62a_100000763385_100015839800 [0,1,0,0,0,1|2,0,0]=4 8412 B18R2.270 Oc1cnc(cn1)SCOCc2ccccc2 62a_100011934580_100000763385 [0,1,0,0,0,1|2,0,0]=4 8413 B18R2.270 Oc1cnc(nc1)SCOCc2ccccc2 62a_100000730009_100000763385 [0,1,0,0,0,1|2,0,0]=4 8414 B18R2.270 Oc1cnc(nc1)SCOCc2ccccc2 62a_100000763385_100000092845 [0,1,0,0,0,1|2,0,0]=4 8415 B18R2.270 [O-][n+]1ccc(cc1)COCCc2ccccc2 34a_100000031831_100000765856 [0,1,0,0,0,1|1,0,0]=3 8416 B18R2.270 [O-][n+]1ccc(cc1)COCCc2ccccc2 7a_100000031831_100000765856 [0,1,0,0,0,1|1,0,0]=3 8417 B18R2.270 [O-][n+]1ccc(cc1)COCCc2ccccn2 7a_100000031831_100015183660 [0,1,0,0,0,1|2,0,0]=4 8418 B18R2.270 [O-][n+]1ccc(cc1)COCCc2cccnc2 7a_100000031831_200011713674 [0,1,0,0,0,1|2,0,0]=4 8419 B18R2.270 [O-][n+]1ccc(cc1)COCCc2ccncc2 7a_100000031831_100000723409 [0,1,0,0,0,1|2,0,0]=4 8420 B18R2.270 [O-][n+]1ccc(cc1)SCCCc2ccccc2 62a_100000211621_100000039755 [0,1,0,0,0,1|2,0,0]=4 8421 B18R2.270 [O-][n+]1ccc(cc1)SCOCc2ccccc2 62a_100000763385_100000039755 [0,1,0,0,0,1|1,0,0]=3 8422 B18R2.270 [O-][n+]1ccc(cc1)SCSCc2ccccc2 62a_200011217039_100000039755 [0,1,0,0,0,1|1,1,0]=4 8423 B18R2.2429 CC(C[n+]1ccccc1)NCc2ccccc2 270004a_100015324214_100000034229 [0,1,0,0,0,1|2,0,0]=4 8424 B18R2.2429 CC(Cc1ccccc1)NCc2ccccc2 34a_100015324214_200011218536 [0,1,0,0,0,1|1,0,0]=3 8425 B18R2.2429 CC(Cc1ccccc1)OCc2ccccc2 34a_100000210790_200011218536 [0,1,0,0,0,1|0,0,0]=2 8426 B18R2.2429 CC(Cc1ccccc1)OCc2ccccc2 34a_100000748627_100015291786 [0,1,0,0,0,1|0,0,0]=2 8427 B18R2.2429 CC(Cc1ccccc1)OCc2ccccc2 7a_100000210790_200011218536 [0,1,0,0,0,1|0,0,0]=2 8428 B18R2.2429 CC(Cc1ccccc1)OCc2ccccc2 7a_100000748627_100000211182 [0,1,0,0,0,1|0,0,0]=2 8429 B18R2.2429 CC(Cc1ccccc1)OCc2ccccn2 34a_100000748627_100000721315 [0,1,0,0,0,1|1,0,0]=3 8430 B18R2.2429 CC(Cc1ccccc1)OCc2ccccn2 7a_100000748627_100000721315 [0,1,0,0,0,1|1,0,0]=3 8431 B18R2.2429 CC(Cc1ccccc1)OCc2cccnc2 34a_100000748627_100000733263 [0,1,0,0,0,1|1,0,0]=3 8432 B18R2.2429 CC(Cc1ccccc1)OCc2cccnc2 7a_100000748627_100000741622 [0,1,0,0,0,1|1,0,0]=3 8433 B18R2.2429 CC(Cc1ccccc1)OCc2cccnn2 34a_100000748627_100016990269 [0,1,0,0,0,1|2,0,0]=4 8434 B18R2.2429 CC(Cc1ccccc1)OCc2cccnn2 7a_100000748627_100016990269 [0,1,0,0,0,1|2,0,0]=4 8435 B18R2.2429 CC(Cc1ccccc1)OCc2ccncc2 7a_100000748627_100015193705 [0,1,0,0,0,1|1,0,0]=3 8436 B18R2.2429 CC(Cc1ccccc1)OCc2cnccn2 34a_100000748627_100016995436 [0,1,0,0,0,1|2,0,0]=4 8437 B18R2.2429 CC(Cc1ccccc1)OCc2cnccn2 7a_100000748627_100016995436 [0,1,0,0,0,1|2,0,0]=4 8438 B18R2.2429 CC(Cc1ccccc1)OCc2cncnc2 34a_100000748627_100015196519 [0,1,0,0,0,1|2,0,0]=4 8439 B18R2.2429 CC(Cc1ccccc1)OCc2cncnc2 7a_100000748627_100015196519 [0,1,0,0,0,1|2,0,0]=4 8440 B18R2.2429 CC(Cc1ccccc1)OCc2ncccn2 34a_100000748627_100000703007 [0,1,0,0,0,1|2,0,0]=4 8441 B18R2.2429 CC(Cc1ccccc1)OCc2ncccn2 7a_100000748627_100000703007 [0,1,0,0,0,1|2,0,0]=4 8442 B18R2.2429 CC(Cc1ccccc1)SCc2ccccc2 62a_100000211182_200011218536 [0,1,0,0,0,1|0,1,0]=3 8443 B18R2.2429 CC(Cc1ccccc1)SCc2ccccc2 62a_200011218536_100015291786 [0,1,0,0,0,1|0,1,0]=3 8444 B18R2.2429 CC(Cc1ccccc1)SCc2ccccn2 62a_100000721315_200011218536 [0,1,0,0,0,1|1,1,0]=4 8445 B18R2.2429 CC(Cc1ccccc1)SCc2ccccn2 62a_200011218536_100000721315 [0,1,0,0,0,1|1,1,0]=4 8446 B18R2.2429 CC(Cc1ccccc1)SCc2cccnc2 62a_100000741622_200011218536 [0,1,0,0,0,1|1,1,0]=4 8447 B18R2.2429 CC(Cc1ccccc1)SCc2cccnc2 62a_200011218536_100000741622 [0,1,0,0,0,1|1,1,0]=4 8448 B18R2.2429 CC(Cc1ccccc1)SCc2ccncc2 62a_100015193705_200011218536 [0,1,0,0,0,1|1,1,0]=4 8449 B18R2.2429 CC(Cc1ccccc1)SCc2ccncc2 62a_200011218536_100015193705 [0,1,0,0,0,1|1,1,0]=4 8450 B18R2.2429 CC(Cc1ccccn1)NCc2ccccc2 207a_100000238496_100015611070 [0,1,0,0,0,1|2,0,0]=4 8451 B18R2.2429 CC(Cc1ccccn1)NCc2ccccc2 2230a_100000238496_100015291786 [0,1,0,0,0,1|2,0,0]=4 8452 B18R2.2429 CC(Cc1ccccn1)NCc2ccccc2 270004a_100000238496_100015611070 [0,1,0,0,0,1|2,0,0]=4 8453 B18R2.2429 CC(Cc1cccnc1)NCc2ccccc2 207a_100011207255_100015611070 [0,1,0,0,0,1|2,0,0]=4 8454 B18R2.2429 CC(Cc1cccnc1)NCc2ccccc2 2230a_100011207255_100015291786 [0,1,0,0,0,1|2,0,0]=4 8455 B18R2.2429 CC(Cc1cccnc1)NCc2ccccc2 270004a_100011207255_100015611070 [0,1,0,0,0,1|2,0,0]=4 8456 B18R2.2429 CC(Cc1cccnc1)NCc2ccccc2 270004a_100015324214_100015187140 [0,1,0,0,0,1|2,0,0]=4 8457 B18R2.2429 CC(Cc1ccncc1)NCc2ccccc2 270004a_100015324214_100000238508 [0,1,0,0,0,1|2,0,0]=4 8458 B18R2.2429 CN(CCc1ccccc1)Cc2ccccc2 2230a_100000186898_100000765856 [0,1,0,0,0,1|1,0,0]=3 8459 B18R2.2429 CN(CCc1ccccc1)Cc2ccccc2 2230a_100000207497_100015291786 [0,1,0,0,0,1|1,0,0]=3 8460 B18R2.2429 CN(CCc1ccccc1)Cc2ccccc2 2230a_100000736570_200000210301 [0,1,0,0,0,1|1,0,0]=3 8461 B18R2.2429 CN(CCc1ccccc1)Cc2ccccc2 269982a_100000186898_100000765856 [0,1,0,0,0,1|1,0,0]=3 8462 B18R2.2429 CN(CCc1ccccc1)Cc2ccccc2 269982a_100000207497_100000211182 [0,1,0,0,0,1|1,0,0]=3 8463 B18R2.2429 CN(CCc1ccccc1)Cc2ccccc2 269982a_100000736570_200000210301 [0,1,0,0,0,1|1,0,0]=3 8464 B18R2.2429 CN(CCc1ccccc1)Cc2ccccc2 270004a_100000207497_100015611070 [0,1,0,0,0,1|1,0,0]=3 8465 B18R2.2429 CN(CCc1ccccc1)Cc2ccccc2 34a_100000736570_200000210301 [0,1,0,0,0,1|1,0,0]=3 8466 B18R2.2429 CN(CCc1ccccc1)Cc2ccccn2 2230a_100000207497_100000721315 [0,1,0,0,0,1|2,0,0]=4 8467 B18R2.2429 CN(CCc1ccccc1)Cc2ccccn2 2230a_100000207498_100000765856 [0,1,0,0,0,1|2,0,0]=4 8468 B18R2.2429 CN(CCc1ccccc1)Cc2ccccn2 2230a_100025718201_200000210301 [0,1,0,0,0,1|2,0,0]=4 8469 B18R2.2429 CN(CCc1ccccc1)Cc2ccccn2 269982a_100000207497_100000721315 [0,1,0,0,0,1|2,0,0]=4 8470 B18R2.2429 CN(CCc1ccccc1)Cc2ccccn2 269982a_100000207498_100000765856 [0,1,0,0,0,1|2,0,0]=4 8471 B18R2.2429 CN(CCc1ccccc1)Cc2ccccn2 269982a_100025718201_200000210301 [0,1,0,0,0,1|2,0,0]=4 8472 B18R2.2429 CN(CCc1ccccc1)Cc2ccccn2 270004a_100000207497_100000209966 [0,1,0,0,0,1|2,0,0]=4 8473 B18R2.2429 CN(CCc1ccccc1)Cc2cccnc2 2230a_100000184577_100000765856 [0,1,0,0,0,1|2,0,0]=4 8474 B18R2.2429 CN(CCc1ccccc1)Cc2cccnc2 2230a_100000207497_100000741622 [0,1,0,0,0,1|2,0,0]=4 8475 B18R2.2429 CN(CCc1ccccc1)Cc2cccnc2 2230a_100000261739_200000210301 [0,1,0,0,0,1|2,0,0]=4 8476 B18R2.2429 CN(CCc1ccccc1)Cc2cccnc2 269982a_100000184577_100000765856 [0,1,0,0,0,1|2,0,0]=4 8477 B18R2.2429 CN(CCc1ccccc1)Cc2cccnc2 269982a_100000207497_100000733263 [0,1,0,0,0,1|2,0,0]=4 8478 B18R2.2429 CN(CCc1ccccc1)Cc2cccnc2 269982a_100000261739_200000210301 [0,1,0,0,0,1|2,0,0]=4 8479 B18R2.2429 CN(CCc1ccccc1)Cc2cccnc2 270004a_100000207497_100000209961 [0,1,0,0,0,1|2,0,0]=4 8480 B18R2.2429 CN(CCc1ccccc1)Cc2ccncc2 2230a_100000187231_100000765856 [0,1,0,0,0,1|2,0,0]=4 8481 B18R2.2429 CN(CCc1ccccc1)Cc2ccncc2 2230a_100000207497_100015193705 [0,1,0,0,0,1|2,0,0]=4 8482 B18R2.2429 CN(CCc1ccccc1)Cc2ccncc2 269982a_100000187231_100000765856 [0,1,0,0,0,1|2,0,0]=4 8483 B18R2.2429 CN(CCc1ccccc1)Cc2ccncc2 269982a_100000207497_100015193705 [0,1,0,0,0,1|2,0,0]=4 8484 B18R2.2429 CN(CCc1ccccn1)Cc2ccccc2 2230a_100000186898_100015183660 [0,1,0,0,0,1|2,0,0]=4 8485 B18R2.2429 CN(CCc1ccccn1)Cc2ccccc2 2230a_100000737206_100015291786 [0,1,0,0,0,1|2,0,0]=4 8486 B18R2.2429 CN(CCc1ccccn1)Cc2ccccc2 269982a_100000186898_100015183660 [0,1,0,0,0,1|2,0,0]=4 8487 B18R2.2429 CN(CCc1ccccn1)Cc2ccccc2 269982a_100000737206_100000211182 [0,1,0,0,0,1|2,0,0]=4 8488 B18R2.2429 CN(CCc1ccccn1)Cc2ccccc2 270004a_100000737206_100015611070 [0,1,0,0,0,1|2,0,0]=4 8489 B18R2.2429 CN(CCc1cccnc1)Cc2ccccc2 2230a_100000186898_200011713674 [0,1,0,0,0,1|2,0,0]=4 8490 B18R2.2429 CN(CCc1cccnc1)Cc2ccccc2 2230a_100000763209_100015291786 [0,1,0,0,0,1|2,0,0]=4 8491 B18R2.2429 CN(CCc1cccnc1)Cc2ccccc2 269982a_100000186898_200011713674 [0,1,0,0,0,1|2,0,0]=4 8492 B18R2.2429 CN(CCc1cccnc1)Cc2ccccc2 269982a_100000763209_100000211182 [0,1,0,0,0,1|2,0,0]=4 8493 B18R2.2429 CN(CCc1cccnc1)Cc2ccccc2 270004a_100000763209_100015611070 [0,1,0,0,0,1|2,0,0]=4 8494 B18R2.2429 CN(CCc1ccncc1)Cc2ccccc2 2230a_100000186898_100000723409 [0,1,0,0,0,1|2,0,0]=4 8495 B18R2.2429 CN(CCc1ccncc1)Cc2ccccc2 2230a_100000742850_100015291786 [0,1,0,0,0,1|2,0,0]=4 8496 B18R2.2429 CN(CCc1ccncc1)Cc2ccccc2 269982a_100000186898_100000723409 [0,1,0,0,0,1|2,0,0]=4 8497 B18R2.2429 CN(CCc1ccncc1)Cc2ccccc2 269982a_100000742850_100000211182 [0,1,0,0,0,1|2,0,0]=4 8498 B18R2.2429 CN(CCc1ccncc1)Cc2ccccc2 270004a_100000742850_100015611070 [0,1,0,0,0,1|2,0,0]=4 8499 B18R2.2429 CN(CSc1ccccc1)Cc2ccccc2 2230a_100000186898_100011218342 [0,1,0,0,0,1|1,0,0]=3 8500 B18R2.2429 CN(CSc1ccccc1)Cc2ccccc2 269982a_100000186898_100011218342 [0,1,0,0,0,1|1,0,0]=3 8501 B18R2.2429 CN(CSc1ccccc1)Cc2ccccn2 2230a_100000207498_100011218342 [0,1,0,0,0,1|2,0,0]=4 8502 B18R2.2429 CN(CSc1ccccc1)Cc2ccccn2 269982a_100000207498_100011218342 [0,1,0,0,0,1|2,0,0]=4 8503 B18R2.2429 CN(CSc1ccccc1)Cc2cccnc2 2230a_100000184577_100011218342 [0,1,0,0,0,1|2,0,0]=4 8504 B18R2.2429 CN(CSc1ccccc1)Cc2cccnc2 269982a_100000184577_100011218342 [0,1,0,0,0,1|2,0,0]=4 8505 B18R2.2429 CN(CSc1ccccc1)Cc2ccncc2 2230a_100000187231_100011218342 [0,1,0,0,0,1|2,0,0]=4 8506 B18R2.2429 CN(CSc1ccccc1)Cc2ccncc2 269982a_100000187231_100011218342 [0,1,0,0,0,1|2,0,0]=4 8507 B18R2.2429 O=C(C#Cc1ccccc1)Cc2ccccc2 1458a_100000736102_100015291786 [0,1,0,0,0,1|1,0,1]=4 8508 B18R2.2429 O=C(C=Cc1ccccc1)Cc2ccccc2 1458a_100000210462_100015291786 [0,1,0,0,0,1|1,0,1]=4 8509 B18R2.2429 O=C(CCc1ccccc1)C[n+]2ccccc2 1458a_200000086051_100000765856 [0,1,0,0,0,1|2,0,0]=4 8510 B18R2.2429 O=C(CCc1ccccc1)Cc2ccccc2 1458a_100000185753_100015291786 [0,1,0,0,0,1|1,0,0]=3 8511 B18R2.2429 O=C(CCc1ccccc1)Cc2ccccn2 1458a_100000185753_100000721315 [0,1,0,0,0,1|2,0,0]=4 8512 B18R2.2429 O=C(CCc1ccccc1)Cc2ccccn2 1458a_100000233486_100000765856 [0,1,0,0,0,1|2,0,0]=4 8513 B18R2.2429 O=C(CCc1ccccc1)Cc2cccnc2 1458a_100000185753_100000733263 [0,1,0,0,0,1|2,0,0]=4 8514 B18R2.2429 O=C(CCc1ccccc1)Cc2cccnc2 1458a_100000737805_100000765856 [0,1,0,0,0,1|2,0,0]=4 8515 B18R2.2429 O=C(CCc1ccccc1)Cc2ccncc2 1458a_100000185753_100000705612 [0,1,0,0,0,1|2,0,0]=4 8516 B18R2.2429 O=C(CCc1ccccc1)Nc2ccccc2 11a_100000106764_100000185753 [0,1,0,0,0,1|1,0,1]=4 8517 B18R2.2429 O=C(CCc1ccccc1)Nc2ccccc2 1626a_100000106764_100000185753 [0,1,0,0,0,1|1,0,1]=4 8518 B18R2.2429 O=C(CCc1ccccc1)Nc2ccccc2 22a_100000106764_100000185753 [0,1,0,0,0,1|1,0,1]=4 8519 B18R2.2429 O=C(CCc1ccccc1)Nc2ccccc2 527a_100000106764_100000185753 [0,1,0,0,0,1|1,0,1]=4 8520 B18R2.2429 O=C(CCc1ccccn1)Cc2ccccc2 1458a_100015195070_100015291786 [0,1,0,0,0,1|2,0,0]=4 8521 B18R2.2429 O=C(CCc1cccnc1)Cc2ccccc2 1458a_100000198484_100015291786 [0,1,0,0,0,1|2,0,0]=4 8522 B18R2.2429 O=C(CCc1ccncc1)Cc2ccccc2 1458a_100011225043_100015291786 [0,1,0,0,0,1|2,0,0]=4 8523 B18R2.2429 O=C(CNc1ccccc1)Nc2ccccc2 34a_100000106764_100000182850 [0,1,0,0,0,1|2,0,0]=4 8524 B18R2.2429 O=C(CNc1ccccc1)Oc2ccccc2 34a_100000106764_100009813826 [0,1,0,0,0,1|2,0,0]=4 8525 B18R2.2429 O=C(COc1ccccc1)Cc2ccccc2 1458a_100000186222_100015291786 [0,1,0,0,0,1|1,0,0]=3 8526 B18R2.2429 O=C(COc1ccccc1)Cc2ccccc2 7a_100000210340_100000233483 [0,1,0,0,0,1|1,0,0]=3 8527 B18R2.2429 O=C(COc1ccccc1)Cc2ccccn2 1458a_100000186222_100000721315 [0,1,0,0,0,1|2,0,0]=4 8528 B18R2.2429 O=C(COc1ccccc1)Cc2cccnc2 1458a_100000186222_100000733263 [0,1,0,0,0,1|2,0,0]=4 8529 B18R2.2429 O=C(COc1ccccc1)Cc2ccncc2 1458a_100000186222_100000705612 [0,1,0,0,0,1|2,0,0]=4 8530 B18R2.2429 O=C(COc1ccccc1)Nc2ccccc2 11a_100000106764_100000186222 [0,1,0,0,0,1|2,0,0]=4 8531 B18R2.2429 O=C(COc1ccccc1)Nc2ccccc2 1626a_100000106764_100000186222 [0,1,0,0,0,1|2,0,0]=4 8532 B18R2.2429 O=C(COc1ccccc1)Nc2ccccc2 22a_100000106764_100000186222 [0,1,0,0,0,1|2,0,0]=4 8533 B18R2.2429 O=C(COc1ccccc1)Nc2ccccc2 34a_100000210340_100000182850 [0,1,0,0,0,1|2,0,0]=4 8534 B18R2.2429 O=C(COc1ccccc1)Nc2ccccc2 527a_100000106764_100000186222 [0,1,0,0,0,1|2,0,0]=4 8535 B18R2.2429 O=C(COc1ccccc1)Nc2ccccc2 7a_100000210340_100000182850 [0,1,0,0,0,1|2,0,0]=4 8536 B18R2.2429 O=C(COc1ccccc1)Oc2ccccc2 34a_100000210340_100009813826 [0,1,0,0,0,1|2,0,0]=4 8537 B18R2.2429 O=C(COc1ccccc1)Oc2ccccc2 7a_100000210340_100009813826 [0,1,0,0,0,1|2,0,0]=4 8538 B18R2.2429 O=C(COc1ccccn1)Cc2ccccc2 1458a_100102699861_100015291786 [0,1,0,0,0,1|2,0,0]=4 8539 B18R2.2429 O=C(COc1cccnc1)Cc2ccccc2 1458a_100015207166_100015291786 [0,1,0,0,0,1|2,0,0]=4 8540 B18R2.2429 O=C(COc1cccnc1)Cc2ccccc2 7a_100000210849_100000233483 [0,1,0,0,0,1|2,0,0]=4 8541 B18R2.2429 O=C(CSc1ccccc1)Cc2ccccc2 1458a_100000211596_100015291786 [0,1,0,0,0,1|1,0,0]=3 8542 B18R2.2429 O=C(CSc1ccccc1)Cc2ccccc2 62a_100000233483_100000041952 [0,1,0,0,0,1|1,0,0]=3 8543 B18R2.2429 O=C(CSc1ccccc1)Cc2ccccc2 62a_100000719477_100000233483 [0,1,0,0,0,1|1,0,0]=3 8544 B18R2.2429 O=C(CSc1ccccc1)Cc2ccccn2 1458a_100000211596_100000721315 [0,1,0,0,0,1|2,0,0]=4 8545 B18R2.2429 O=C(CSc1ccccc1)Cc2cccnc2 1458a_100000211596_100000733263 [0,1,0,0,0,1|2,0,0]=4 8546 B18R2.2429 O=C(CSc1ccccc1)Cc2ccncc2 1458a_100000211596_100000705612 [0,1,0,0,0,1|2,0,0]=4 8547 B18R2.2429 O=C(CSc1ccccc1)Nc2ccccc2 11a_100000106764_100000211596 [0,1,0,0,0,1|2,0,0]=4 8548 B18R2.2429 O=C(CSc1ccccc1)Nc2ccccc2 1626a_100000106764_100000211596 [0,1,0,0,0,1|2,0,0]=4 8549 B18R2.2429 O=C(CSc1ccccc1)Nc2ccccc2 22a_100000106764_100000211596 [0,1,0,0,0,1|2,0,0]=4 8550 B18R2.2429 O=C(CSc1ccccc1)Nc2ccccc2 527a_100000106764_100000211596 [0,1,0,0,0,1|2,0,0]=4 8551 B18R2.2429 O=C(CSc1ccccc1)Nc2ccccc2 62a_100000719477_100000182850 [0,1,0,0,0,1|2,0,0]=4 8552 B18R2.2429 O=C(CSc1ccccc1)Nc2ccccc2 62a_100012148978_100000041952 [0,1,0,0,0,1|2,0,0]=4 8553 B18R2.2429 O=C(CSc1ccccc1)Oc2ccccc2 62a_100000719477_100009813826 [0,1,0,0,0,1|2,0,0]=4 8554 B18R2.2429 O=C(CSc1ccccc1)Oc2ccccc2 62a_100009813826_100000041952 [0,1,0,0,0,1|2,0,0]=4 8555 B18R2.2429 O=C(CSc1ccccn1)Cc2ccccc2 1458a_100000156281_100015291786 [0,1,0,0,0,1|2,0,0]=4 8556 B18R2.2429 O=C(CSc1ccccn1)Cc2ccccc2 62a_100000233483_100011216584 [0,1,0,0,0,1|2,0,0]=4 8557 B18R2.2429 O=C(CSc1ccccn1)Cc2ccccc2 62a_100011216584_100000233483 [0,1,0,0,0,1|2,0,0]=4 8558 B18R2.2429 O=C(CSc1cccnc1)Cc2ccccc2 62a_100000210063_100000233483 [0,1,0,0,0,1|2,0,0]=4 8559 B18R2.2429 O=C(CSc1cccnc1)Cc2ccccc2 62a_100000233483_100000210063 [0,1,0,0,0,1|2,0,0]=4 8560 B18R2.2429 O=C(CSc1ccncc1)Cc2ccccc2 1458a_100000211328_100015291786 [0,1,0,0,0,1|2,0,0]=4 8561 B18R2.2429 O=C(CSc1ccncc1)Cc2ccccc2 62a_100000233483_100000728582 [0,1,0,0,0,1|2,0,0]=4 8562 B18R2.2429 O=C(CSc1ccncc1)Cc2ccccc2 62a_100000728582_100000233483 [0,1,0,0,0,1|2,0,0]=4 8563 B18R2.2429 O=C(C[n+]1ccccc1)NCc2ccccc2 11a_100015324214_200000086051 [0,1,0,0,0,1|2,0,0]=4 8564 B18R2.2429 O=C(C[n+]1ccccc1)NCc2ccccc2 240690a_100015324214_200000086051 [0,1,0,0,0,1|2,0,0]=4 8565 B18R2.2429 O=C(C[n+]1ccccc1)NCc2ccccc2 527a_100015324214_200000086051 [0,1,0,0,0,1|2,0,0]=4 8566 B18R2.2429 O=C(Cc1ccccn1)NCc2ccccc2 11a_100015324214_100000233486 [0,1,0,0,0,1|2,0,0]=4 8567 B18R2.2429 O=C(Cc1cccnc1)NCc2ccccc2 11a_100015324214_100000737805 [0,1,0,0,0,1|2,0,0]=4 8568 B18R2.2429 O=C(Cc1cccnc1)NCc2ccccc2 240690a_100015324214_100000737805 [0,1,0,0,0,1|2,0,0]=4 8569 B18R2.2429 O=C(Cc1cccnc1)NCc2ccccc2 527a_100015324214_100000737805 [0,1,0,0,0,1|2,0,0]=4 8570 B18R2.2429 O=C(Cc1ccncc1)NCc2ccccc2 11a_100015324214_100011201483 [0,1,0,0,0,1|2,0,0]=4 8571 B18R2.2429 O=C(Cc1ccncc1)NCc2ccccc2 240690a_100015324214_100011201483 [0,1,0,0,0,1|2,0,0]=4 8572 B18R2.2429 O=C(NCc1ccccc1)Nc2ccccc2 2430a_100000106764_100015324214 [0,1,0,0,0,1|1,0,1]=4 8573 B18R2.2429 O[C@H](CNc1ccccc1)Cc2ccccc2 34a_100000106764_100000729385 [0,1,0,0,0,1|1,0,0]=3 8574 B18R2.2429 O[C@H](COc1ccccc1)Cc2ccccc2 34a_100000210340_100000729385 [0,1,0,0,0,1|1,0,0]=3 8575 B18R2.2429 O[C@H](COc1ccccc1)Cc2ccccc2 7a_100000210340_100000729385 [0,1,0,0,0,1|1,0,0]=3 8576 B18R2.2429 O[C@H](COc1cccnc1)Cc2ccccc2 34a_100000210849_100000729385 [0,1,0,0,0,1|2,0,0]=4 8577 B18R2.2429 O[C@H](COc1cccnc1)Cc2ccccc2 7a_100000210849_100000729385 [0,1,0,0,0,1|2,0,0]=4 8578 B18R2.2429 O[C@H](COc1ccncc1)Cc2ccccc2 34a_100000212176_100000729385 [0,1,0,0,0,1|2,0,0]=4 8579 B18R2.2429 O[C@H](CSc1ccccc1)Cc2ccccc2 62a_100000719477_100000729385 [0,1,0,0,0,1|1,0,0]=3 8580 B18R2.2429 O[C@H](CSc1ccccc1)Cc2ccccc2 62a_100000729385_100000041952 [0,1,0,0,0,1|1,0,0]=3 8581 B18R2.2429 O[C@H](CSc1ccccn1)Cc2ccccc2 62a_100000729385_100011216584 [0,1,0,0,0,1|2,0,0]=4 8582 B18R2.2429 O[C@H](CSc1ccccn1)Cc2ccccc2 62a_100011216584_100000729385 [0,1,0,0,0,1|2,0,0]=4 8583 B18R2.2429 O[C@H](CSc1cccnc1)Cc2ccccc2 62a_100000210063_100000729385 [0,1,0,0,0,1|2,0,0]=4 8584 B18R2.2429 O[C@H](CSc1cccnc1)Cc2ccccc2 62a_100000729385_100000210063 [0,1,0,0,0,1|2,0,0]=4 8585 B18R2.2429 O[C@H](CSc1ccncc1)Cc2ccccc2 62a_100000728582_100000729385 [0,1,0,0,0,1|2,0,0]=4 8586 B18R2.2429 O[C@H](CSc1ccncc1)Cc2ccccc2 62a_100000729385_100000728582 [0,1,0,0,0,1|2,0,0]=4 8587 B18R2.2429 [13CH3]N(CCc1ccccc1)Cc2ccccc2 2230a_100000736570_200025704644 [0,1,0,0,0,1|1,0,0]=3 8588 B18R2.2429 [13CH3]N(CCc1ccccc1)Cc2ccccc2 269982a_100000736570_200025704644 [0,1,0,0,0,1|1,0,0]=3 8589 B18R2.2429 [13CH3]N(CCc1ccccc1)Cc2ccccc2 34a_100000736570_200025704644 [0,1,0,0,0,1|1,0,0]=3 8590 B18R2.2429 [13CH3]N(CCc1ccccc1)Cc2ccccn2 2230a_100025718201_200025704644 [0,1,0,0,0,1|2,0,0]=4 8591 B18R2.2429 [13CH3]N(CCc1ccccc1)Cc2ccccn2 269982a_100025718201_200025704644 [0,1,0,0,0,1|2,0,0]=4 8592 B18R2.2429 [13CH3]N(CCc1ccccc1)Cc2cccnc2 2230a_100000261739_200025704644 [0,1,0,0,0,1|2,0,0]=4 8593 B18R2.2429 [13CH3]N(CCc1ccccc1)Cc2cccnc2 269982a_100000261739_200025704644 [0,1,0,0,0,1|2,0,0]=4 8594 B18R2.3984 Brc1ccccc1C#CCNc2ccccc2 34a_100000106764_100010706765 [0,1,0,0,0,1|1,0,1]=4 8595 B18R2.3984 Brc1ccccc1C#CCOc2ccccc2 34a_100000210340_100010706765 [0,1,0,0,0,1|1,0,1]=4 8596 B18R2.3984 Brc1ccccc1C#CCOc2ccccc2 7a_100000210340_100010706765 [0,1,0,0,0,1|1,0,1]=4 8597 B18R2.3984 Brc1ccccc1C#CCSc2ccccc2 62a_100000719477_100010706765 [0,1,0,0,0,1|1,0,1]=4 8598 B18R2.3984 Brc1ccccc1C#CCSc2ccccc2 62a_100010706765_100000041952 [0,1,0,0,0,1|1,0,1]=4 8599 B18R2.3984 Brc1ccccc1C=NNCc2ccccc2 4a_100000007032_100000211189 [0,1,0,0,0,1|1,0,1]=4 8600 B18R2.3984 Brc1ccccc1CCCNc2ccccc2 34a_100000106764_200011713681 [0,1,0,0,0,1|1,0,0]=3 8601 B18R2.3984 Brc1ccccc1CCCOc2ccccc2 34a_100000210340_200011713681 [0,1,0,0,0,1|1,0,0]=3 8602 B18R2.3984 Brc1ccccc1CCCOc2ccccc2 7a_100000210340_200011713681 [0,1,0,0,0,1|1,0,0]=3 8603 B18R2.3984 Brc1ccccc1CCCOc2cccnc2 34a_100000210849_200011713681 [0,1,0,0,0,1|2,0,0]=4 8604 B18R2.3984 Brc1ccccc1CCCOc2cccnc2 7a_100000210849_200011713681 [0,1,0,0,0,1|2,0,0]=4 8605 B18R2.3984 Brc1ccccc1CCCOc2ccncc2 34a_100000212176_200011713681 [0,1,0,0,0,1|2,0,0]=4 8606 B18R2.3984 Brc1ccccc1CCCSc2ccccc2 62a_100000719477_200011713681 [0,1,0,0,0,1|1,0,0]=3 8607 B18R2.3984 Brc1ccccc1CCCSc2ccccc2 62a_200011713681_100000041952 [0,1,0,0,0,1|1,0,0]=3 8608 B18R2.3984 Brc1ccccc1CCCSc2ccccn2 62a_100011216584_200011713681 [0,1,0,0,0,1|2,0,0]=4 8609 B18R2.3984 Brc1ccccc1CCCSc2ccccn2 62a_200011713681_100011216584 [0,1,0,0,0,1|2,0,0]=4 8610 B18R2.3984 Brc1ccccc1CCCSc2cccnc2 62a_100000210063_200011713681 [0,1,0,0,0,1|2,0,0]=4 8611 B18R2.3984 Brc1ccccc1CCCSc2cccnc2 62a_200011713681_100000210063 [0,1,0,0,0,1|2,0,0]=4 8612 B18R2.3984 Brc1ccccc1CCCSc2ccncc2 62a_100000728582_200011713681 [0,1,0,0,0,1|2,0,0]=4 8613 B18R2.3984 Brc1ccccc1CCCSc2ccncc2 62a_200011713681_100000728582 [0,1,0,0,0,1|2,0,0]=4 8614 B18R2.3984 Brc1ccccc1CCNCc2ccccc2 207a_100000747383_100015611070 [0,1,0,0,0,1|1,0,0]=3 8615 B18R2.3984 Brc1ccccc1CCNCc2ccccc2 2230a_100000747383_100015291786 [0,1,0,0,0,1|1,0,0]=3 8616 B18R2.3984 Brc1ccccc1CCNCc2ccccc2 2230a_100015324214_100012161201 [0,1,0,0,0,1|1,0,0]=3 8617 B18R2.3984 Brc1ccccc1CCNCc2ccccc2 270004a_100000747383_100015611070 [0,1,0,0,0,1|1,0,0]=3 8618 B18R2.3984 Brc1ccccc1CCNCc2ccccc2 34a_100000747383_100015291786 [0,1,0,0,0,1|1,0,0]=3 8619 B18R2.3984 Brc1ccccc1CCNCc2ccccc2 34a_100015324214_100012161201 [0,1,0,0,0,1|1,0,0]=3 8620 B18R2.3984 Brc1ccccc1CCNCc2ccccn2 207a_100000747383_100000209966 [0,1,0,0,0,1|2,0,0]=4 8621 B18R2.3984 Brc1ccccc1CCNCc2ccccn2 2230a_100000747383_100000721315 [0,1,0,0,0,1|2,0,0]=4 8622 B18R2.3984 Brc1ccccc1CCNCc2ccccn2 270004a_100000747383_100000209966 [0,1,0,0,0,1|2,0,0]=4 8623 B18R2.3984 Brc1ccccc1CCNCc2ccccn2 34a_100000747383_100000721315 [0,1,0,0,0,1|2,0,0]=4 8624 B18R2.3984 Brc1ccccc1CCNCc2cccnc2 207a_100000747383_100000209961 [0,1,0,0,0,1|2,0,0]=4 8625 B18R2.3984 Brc1ccccc1CCNCc2cccnc2 2230a_100000747383_100000741622 [0,1,0,0,0,1|2,0,0]=4 8626 B18R2.3984 Brc1ccccc1CCNCc2cccnc2 270004a_100000747383_100000209961 [0,1,0,0,0,1|2,0,0]=4 8627 B18R2.3984 Brc1ccccc1CCNCc2cccnc2 34a_100000747383_100000733263 [0,1,0,0,0,1|2,0,0]=4 8628 B18R2.3984 Brc1ccccc1CCNCc2ccncc2 207a_100000747383_100000186114 [0,1,0,0,0,1|2,0,0]=4 8629 B18R2.3984 Brc1ccccc1CCNCc2ccncc2 2230a_100000747383_100015193705 [0,1,0,0,0,1|2,0,0]=4 8630 B18R2.3984 Brc1ccccc1CCOCc2ccccc2 34a_100000210790_100012161201 [0,1,0,0,0,1|0,0,0]=2 8631 B18R2.3984 Brc1ccccc1CCOCc2ccccc2 34a_100000731337_100015291786 [0,1,0,0,0,1|0,0,0]=2 8632 B18R2.3984 Brc1ccccc1CCOCc2ccccc2 7a_100000210790_100012161201 [0,1,0,0,0,1|0,0,0]=2 8633 B18R2.3984 Brc1ccccc1CCOCc2ccccc2 7a_100000731337_100000211182 [0,1,0,0,0,1|0,0,0]=2 8634 B18R2.3984 Brc1ccccc1CCOCc2ccccn2 34a_100000731337_100000721315 [0,1,0,0,0,1|1,0,0]=3 8635 B18R2.3984 Brc1ccccc1CCOCc2ccccn2 7a_100000731337_100000721315 [0,1,0,0,0,1|1,0,0]=3 8636 B18R2.3984 Brc1ccccc1CCOCc2cccnc2 34a_100000731337_100000733263 [0,1,0,0,0,1|1,0,0]=3 8637 B18R2.3984 Brc1ccccc1CCOCc2cccnc2 7a_100000731337_100000741622 [0,1,0,0,0,1|1,0,0]=3 8638 B18R2.3984 Brc1ccccc1CCOCc2cccnn2 34a_100000731337_100016990269 [0,1,0,0,0,1|2,0,0]=4 8639 B18R2.3984 Brc1ccccc1CCOCc2cccnn2 7a_100000731337_100016990269 [0,1,0,0,0,1|2,0,0]=4 8640 B18R2.3984 Brc1ccccc1CCOCc2ccncc2 7a_100000731337_100015193705 [0,1,0,0,0,1|1,0,0]=3 8641 B18R2.3984 Brc1ccccc1CCOCc2cnccn2 34a_100000731337_100016995436 [0,1,0,0,0,1|2,0,0]=4 8642 B18R2.3984 Brc1ccccc1CCOCc2cnccn2 7a_100000731337_100016995436 [0,1,0,0,0,1|2,0,0]=4 8643 B18R2.3984 Brc1ccccc1CCOCc2cncnc2 34a_100000731337_100015196519 [0,1,0,0,0,1|2,0,0]=4 8644 B18R2.3984 Brc1ccccc1CCOCc2cncnc2 7a_100000731337_100015196519 [0,1,0,0,0,1|2,0,0]=4 8645 B18R2.3984 Brc1ccccc1CCOCc2ncccn2 34a_100000731337_100000703007 [0,1,0,0,0,1|2,0,0]=4 8646 B18R2.3984 Brc1ccccc1CCOCc2ncccn2 7a_100000731337_100000703007 [0,1,0,0,0,1|2,0,0]=4 8647 B18R2.3984 Brc1ccccc1CCSCc2ccccc2 62a_100000211182_100012161201 [0,1,0,0,0,1|0,1,0]=3 8648 B18R2.3984 Brc1ccccc1CCSCc2ccccc2 62a_100012161201_100015291786 [0,1,0,0,0,1|0,1,0]=3 8649 B18R2.3984 Brc1ccccc1CCSCc2ccccn2 62a_100000721315_100012161201 [0,1,0,0,0,1|1,1,0]=4 8650 B18R2.3984 Brc1ccccc1CCSCc2ccccn2 62a_100012161201_100000721315 [0,1,0,0,0,1|1,1,0]=4 8651 B18R2.3984 Brc1ccccc1CCSCc2cccnc2 62a_100000741622_100012161201 [0,1,0,0,0,1|1,1,0]=4 8652 B18R2.3984 Brc1ccccc1CCSCc2cccnc2 62a_100012161201_100000741622 [0,1,0,0,0,1|1,1,0]=4 8653 B18R2.3984 Brc1ccccc1CCSCc2ccncc2 62a_100012161201_100015193705 [0,1,0,0,0,1|1,1,0]=4 8654 B18R2.3984 Brc1ccccc1CCSCc2ccncc2 62a_100015193705_100012161201 [0,1,0,0,0,1|1,1,0]=4 8655 B18R2.3984 Brc1ccccc1CNCCc2ccccc2 207a_100000106460_100000211189 [0,1,0,0,0,1|1,0,0]=3 8656 B18R2.3984 Brc1ccccc1CNCCc2ccccc2 2230a_100000106460_100000184730 [0,1,0,0,0,1|1,0,0]=3 8657 B18R2.3984 Brc1ccccc1CNCCc2ccccc2 2230a_100000689332_100000765856 [0,1,0,0,0,1|1,0,0]=3 8658 B18R2.3984 Brc1ccccc1CNCCc2ccccc2 270004a_100000106460_100000211189 [0,1,0,0,0,1|1,0,0]=3 8659 B18R2.3984 Brc1ccccc1CNCCc2ccccc2 34a_100000106460_100000184730 [0,1,0,0,0,1|1,0,0]=3 8660 B18R2.3984 Brc1ccccc1CNCCc2ccccc2 34a_100000689332_100000765856 [0,1,0,0,0,1|1,0,0]=3 8661 B18R2.3984 Brc1ccccc1CNCCc2ccccn2 207a_100000211156_100000211189 [0,1,0,0,0,1|2,0,0]=4 8662 B18R2.3984 Brc1ccccc1CNCCc2ccccn2 2230a_100000689332_100015183660 [0,1,0,0,0,1|2,0,0]=4 8663 B18R2.3984 Brc1ccccc1CNCCc2ccccn2 270004a_100000211156_100000211189 [0,1,0,0,0,1|2,0,0]=4 8664 B18R2.3984 Brc1ccccc1CNCCc2cccnc2 207a_100000736294_100000211189 [0,1,0,0,0,1|2,0,0]=4 8665 B18R2.3984 Brc1ccccc1CNCCc2cccnc2 2230a_100000689332_200011713674 [0,1,0,0,0,1|2,0,0]=4 8666 B18R2.3984 Brc1ccccc1CNCCc2cccnc2 2230a_100000736294_100000184730 [0,1,0,0,0,1|2,0,0]=4 8667 B18R2.3984 Brc1ccccc1CNCCc2cccnc2 270004a_100000736294_100000211189 [0,1,0,0,0,1|2,0,0]=4 8668 B18R2.3984 Brc1ccccc1CNCCc2ccncc2 207a_100000742849_100000211189 [0,1,0,0,0,1|2,0,0]=4 8669 B18R2.3984 Brc1ccccc1CNCCc2ccncc2 2230a_100000689332_100000723409 [0,1,0,0,0,1|2,0,0]=4 8670 B18R2.3984 Brc1ccccc1CNCCc2ccncc2 270004a_100000742849_100000211189 [0,1,0,0,0,1|2,0,0]=4 8671 B18R2.3984 Brc1ccccc1CNCSc2ccccc2 2230a_100000689332_100011218342 [0,1,0,0,0,1|1,0,0]=3 8672 B18R2.3984 Brc1ccccc1CNN=Cc2ccccc2 4a_200016993956_100015611070 [0,1,0,0,0,1|1,0,1]=4 8673 B18R2.3984 Brc1ccccc1COCCc2ccccc2 34a_100000210268_100000184730 [0,1,0,0,0,1|0,0,0]=2 8674 B18R2.3984 Brc1ccccc1COCCc2ccccc2 34a_100000756307_100000765856 [0,1,0,0,0,1|0,0,0]=2 8675 B18R2.3984 Brc1ccccc1COCCc2ccccc2 7a_100000210268_100000184730 [0,1,0,0,0,1|0,0,0]=2 8676 B18R2.3984 Brc1ccccc1COCCc2ccccc2 7a_100000756307_100000765856 [0,1,0,0,0,1|0,0,0]=2 8677 B18R2.3984 Brc1ccccc1COCCc2ccccn2 34a_100000210271_100000184730 [0,1,0,0,0,1|1,0,0]=3 8678 B18R2.3984 Brc1ccccc1COCCc2ccccn2 7a_100000756307_100015183660 [0,1,0,0,0,1|1,0,0]=3 8679 B18R2.3984 Brc1ccccc1COCCc2cccnc2 34a_100011217484_100000184730 [0,1,0,0,0,1|1,0,0]=3 8680 B18R2.3984 Brc1ccccc1COCCc2cccnc2 7a_100000756307_200011713674 [0,1,0,0,0,1|1,0,0]=3 8681 B18R2.3984 Brc1ccccc1COCCc2ccncc2 34a_100011216225_100000184730 [0,1,0,0,0,1|1,0,0]=3 8682 B18R2.3984 Brc1ccccc1COCCc2ccncc2 7a_100000756307_100000723409 [0,1,0,0,0,1|1,0,0]=3 8683 B18R2.3984 Brc1ccccc1COCCc2cnccn2 34a_100011349526_100000184730 [0,1,0,0,0,1|2,0,0]=4 8684 B18R2.3984 Brc1ccccc1COCCc2cncnc2 34a_100011709255_100000184730 [0,1,0,0,0,1|2,0,0]=4 8685 B18R2.3984 Brc1ccccc1CSCCc2ccccc2 62a_100000184730_100011218657 [0,1,0,0,0,1|0,1,0]=3 8686 B18R2.3984 Brc1ccccc1CSCCc2ccccc2 62a_100000765856_100000184730 [0,1,0,0,0,1|0,1,0]=3 8687 B18R2.3984 Brc1ccccc1CSCCc2ccccn2 62a_100000184730_100015183660 [0,1,0,0,0,1|1,1,0]=4 8688 B18R2.3984 Brc1ccccc1CSCCc2ccccn2 62a_100015183660_100000184730 [0,1,0,0,0,1|1,1,0]=4 8689 B18R2.3984 Brc1ccccc1CSCCc2cccnc2 62a_100000184730_200011713674 [0,1,0,0,0,1|1,1,0]=4 8690 B18R2.3984 Brc1ccccc1CSCCc2cccnc2 62a_200011713674_100000184730 [0,1,0,0,0,1|1,1,0]=4 8691 B18R2.3984 Brc1ccccc1CSCCc2ccncc2 62a_100000184730_100000723409 [0,1,0,0,0,1|1,1,0]=4 8692 B18R2.3984 Brc1ccccc1CSCCc2ccncc2 62a_100000723409_100000184730 [0,1,0,0,0,1|1,1,0]=4 8693 B18R2.3984 Brc1ccccc1CSCSc2ccccc2 62a_100000184730_100011218342 [0,1,0,0,0,1|0,1,0]=3 8694 B18R2.3984 Brc1ccccc1CSCSc2ccccc2 62a_100011218342_100000184730 [0,1,0,0,0,1|0,1,0]=3 8695 B18R2.3984 Brc1ccccc1NC/C=C/c2ccccc2 34a_100000210017_100016265936 [0,1,0,0,0,1|1,0,1]=4 8696 B18R2.3984 Brc1ccccc1NCC#Cc2ccccc2 34a_100000210017_100011352542 [0,1,0,0,0,1|1,0,1]=4 8697 B18R2.3984 Brc1ccccc1NCCCc2ccccc2 34a_100000210017_100000211621 [0,1,0,0,0,1|1,0,0]=3 8698 B18R2.3984 Brc1ccccc1NCCOc2ccccc2 34a_100000210017_100000184471 [0,1,0,0,0,1|2,0,0]=4 8699 B18R2.3984 Brc1ccccc1NCCSc2ccccc2 34a_100000210017_100000246102 [0,1,0,0,0,1|2,0,0]=4 8700 B18R2.3984 Brc1ccccc1NCOCc2ccccc2 34a_100000210017_100000763385 [0,1,0,0,0,1|0,0,0]=2 8701 B18R2.3984 Brc1ccccc1NCSCc2ccccc2 34a_100000210017_200011217039 [0,1,0,0,0,1|0,1,0]=3 8702 B18R2.3984 Brc1ccccc1NN=CCc2ccccc2 4a_100000241748_100000209964 [0,1,0,0,0,1|2,0,0]=4 8703 B18R2.3984 Brc1ccccc1OC/C=C/c2ccccc2 34a_100000181306_100016265936 [0,1,0,0,0,1|1,0,1]=4 8704 B18R2.3984 Brc1ccccc1OC/C=C/c2ccccc2 7a_100000181306_100016265936 [0,1,0,0,0,1|1,0,1]=4 8705 B18R2.3984 Brc1ccccc1OCC#Cc2ccccc2 34a_100000181306_100011352542 [0,1,0,0,0,1|1,0,1]=4 8706 B18R2.3984 Brc1ccccc1OCC#Cc2ccccc2 7a_100000181306_100011352542 [0,1,0,0,0,1|1,0,1]=4 8707 B18R2.3984 Brc1ccccc1OCCCc2ccccc2 34a_100000181306_100000211621 [0,1,0,0,0,1|1,0,0]=3 8708 B18R2.3984 Brc1ccccc1OCCCc2ccccc2 7a_100000181306_100000211621 [0,1,0,0,0,1|1,0,0]=3 8709 B18R2.3984 Brc1ccccc1OCCNc2ccccc2 34a_100000106764_100000695877 [0,1,0,0,0,1|2,0,0]=4 8710 B18R2.3984 Brc1ccccc1OCCOc2ccccc2 34a_100000181306_100000184471 [0,1,0,0,0,1|2,0,0]=4 8711 B18R2.3984 Brc1ccccc1OCCOc2ccccc2 34a_100000210340_100000695877 [0,1,0,0,0,1|2,0,0]=4 8712 B18R2.3984 Brc1ccccc1OCCOc2ccccc2 7a_100000181306_100000184471 [0,1,0,0,0,1|2,0,0]=4 8713 B18R2.3984 Brc1ccccc1OCCOc2ccccc2 7a_100000210340_100000695877 [0,1,0,0,0,1|2,0,0]=4 8714 B18R2.3984 Brc1ccccc1OCCSc2ccccc2 34a_100000181306_100000246102 [0,1,0,0,0,1|2,0,0]=4 8715 B18R2.3984 Brc1ccccc1OCCSc2ccccc2 62a_100000695877_100000041952 [0,1,0,0,0,1|2,0,0]=4 8716 B18R2.3984 Brc1ccccc1OCCSc2ccccc2 62a_100000719477_100000695877 [0,1,0,0,0,1|2,0,0]=4 8717 B18R2.3984 Brc1ccccc1OCCSc2ccccc2 7a_100000181306_100000246102 [0,1,0,0,0,1|2,0,0]=4 8718 B18R2.3984 Brc1ccccc1OCOCc2ccccc2 34a_100000181306_100000763385 [0,1,0,0,0,1|0,0,0]=2 8719 B18R2.3984 Brc1ccccc1OCSCc2ccccc2 34a_100000181306_200011217039 [0,1,0,0,0,1|0,1,0]=3 8720 B18R2.3984 Brc1ccccc1SC/C=C/c2ccccc2 62a_100000695589_100016265936 [0,1,0,0,0,1|1,0,1]=4 8721 B18R2.3984 Brc1ccccc1SC/C=C/c2ccccc2 62a_100016265936_100000695589 [0,1,0,0,0,1|1,0,1]=4 8722 B18R2.3984 Brc1ccccc1SCC#Cc2ccccc2 62a_100000695589_100011352542 [0,1,0,0,0,1|1,0,1]=4 8723 B18R2.3984 Brc1ccccc1SCCCc2ccccc2 62a_100000211621_100000695589 [0,1,0,0,0,1|1,0,0]=3 8724 B18R2.3984 Brc1ccccc1SCCCc2ccccc2 62a_100000695589_100000211621 [0,1,0,0,0,1|1,0,0]=3 8725 B18R2.3984 Brc1ccccc1SCCOc2ccccc2 62a_100000184471_100000695589 [0,1,0,0,0,1|2,0,0]=4 8726 B18R2.3984 Brc1ccccc1SCCOc2ccccc2 62a_100000695589_100000184471 [0,1,0,0,0,1|2,0,0]=4 8727 B18R2.3984 Brc1ccccc1SCCSc2ccccc2 62a_100000246102_100000695589 [0,1,0,0,0,1|2,0,0]=4 8728 B18R2.3984 Brc1ccccc1SCCSc2ccccc2 62a_100000695589_100000246102 [0,1,0,0,0,1|2,0,0]=4 8729 B18R2.3984 Brc1ccccc1SCOCc2ccccc2 62a_100000695589_100000763385 [0,1,0,0,0,1|0,0,0]=2 8730 B18R2.3984 Brc1ccccc1SCOCc2ccccc2 62a_100000763385_100000695589 [0,1,0,0,0,1|0,0,0]=2 8731 B18R2.3984 Brc1ccccc1SCSCc2ccccc2 62a_100000695589_200011217039 [0,1,0,0,0,1|0,1,0]=3 8732 B18R2.3984 Brc1ccccc1SCSCc2ccccc2 62a_200011217039_100000695589 [0,1,0,0,0,1|0,1,0]=3 8733 B18R2.3984 Brc1cccnc1CNCCc2ccccc2 207a_100000106460_100011934733 [0,1,0,0,0,1|2,0,0]=4 8734 B18R2.3984 Brc1cccnc1CNCCc2ccccc2 2230a_100000106460_100025702911 [0,1,0,0,0,1|2,0,0]=4 8735 B18R2.3984 Brc1cccnc1CNCCc2ccccc2 270004a_100000106460_100011934733 [0,1,0,0,0,1|2,0,0]=4 8736 B18R2.3984 Brc1cccnc1CNCCc2ccccc2 34a_100000106460_100025702911 [0,1,0,0,0,1|2,0,0]=4 8737 B18R2.3984 Brc1cccnc1COCCc2ccccc2 34a_100000210268_100025702911 [0,1,0,0,0,1|1,0,0]=3 8738 B18R2.3984 Brc1cccnc1COCCc2ccccc2 34a_100011996772_100000765856 [0,1,0,0,0,1|1,0,0]=3 8739 B18R2.3984 Brc1cccnc1COCCc2ccccc2 7a_100000210268_100025702911 [0,1,0,0,0,1|1,0,0]=3 8740 B18R2.3984 Brc1cccnc1COCCc2ccccn2 34a_100000210271_100025702911 [0,1,0,0,0,1|2,0,0]=4 8741 B18R2.3984 Brc1cccnc1COCCc2cccnc2 34a_100011217484_100025702911 [0,1,0,0,0,1|2,0,0]=4 8742 B18R2.3984 Brc1cccnc1COCCc2ccncc2 34a_100011216225_100025702911 [0,1,0,0,0,1|2,0,0]=4 8743 B18R2.3984 Brc1cccnc1CSCCc2ccccc2 62a_100000765856_100025702911 [0,1,0,0,0,1|1,1,0]=4 8744 B18R2.3984 Brc1cccnc1CSCCc2ccccc2 62a_100025702911_100011218657 [0,1,0,0,0,1|1,1,0]=4 8745 B18R2.3984 Brc1cccnc1CSCSc2ccccc2 62a_100011218342_100025702911 [0,1,0,0,0,1|1,1,0]=4 8746 B18R2.3984 Brc1cccnc1CSCSc2ccccc2 62a_100025702911_100011218342 [0,1,0,0,0,1|1,1,0]=4 8747 B18R2.3984 Brc1cccnc1NCCCc2ccccc2 27a_100000211184_100000696092 [0,1,0,0,0,1|2,0,0]=4 8748 B18R2.3984 Brc1cccnc1SCCCc2ccccc2 62a_100000211621_100000696092 [0,1,0,0,0,1|2,0,0]=4 8749 B18R2.3984 Brc1cccnc1SCCCc2ccccc2 62a_100000696092_100000211621 [0,1,0,0,0,1|2,0,0]=4 8750 B18R2.3984 Brc1cccnc1SCOCc2ccccc2 62a_100000696092_100000763385 [0,1,0,0,0,1|1,0,0]=3 8751 B18R2.3984 Brc1cccnc1SCOCc2ccccc2 62a_100000763385_100000696092 [0,1,0,0,0,1|1,0,0]=3 8752 B18R2.3984 Brc1cccnc1SCSCc2ccccc2 62a_100000696092_200011217039 [0,1,0,0,0,1|1,1,0]=4 8753 B18R2.3984 Brc1cccnc1SCSCc2ccccc2 62a_200011217039_100000696092 [0,1,0,0,0,1|1,1,0]=4 8754 B18R2.3984 Brc1ccncc1CNCCc2ccccc2 270004a_100000106460_100009816821 [0,1,0,0,0,1|2,0,0]=4 8755 B18R2.3984 Brc1ccncc1SCCCc2ccccc2 62a_100000211621_100010138639 [0,1,0,0,0,1|2,0,0]=4 8756 B18R2.3984 Brc1ccncc1SCCCc2ccccc2 62a_100010138639_100000211621 [0,1,0,0,0,1|2,0,0]=4 8757 B18R2.3984 Brc1ccncc1SCOCc2ccccc2 62a_100000763385_100010138639 [0,1,0,0,0,1|1,0,0]=3 8758 B18R2.3984 Brc1ccncc1SCOCc2ccccc2 62a_100010138639_100000763385 [0,1,0,0,0,1|1,0,0]=3 8759 B18R2.3984 Brc1ccncc1SCSCc2ccccc2 62a_100010138639_200011217039 [0,1,0,0,0,1|1,1,0]=4 8760 B18R2.3984 Brc1ccncc1SCSCc2ccccc2 62a_200011217039_100010138639 [0,1,0,0,0,1|1,1,0]=4 8761 B18R2.3984 Brc1cnccc1CNCCc2ccccc2 270004a_100000106460_100000755692 [0,1,0,0,0,1|2,0,0]=4 8762 B18R2.3984 Brc1cnccc1NCCCc2ccccc2 27a_100000211184_100000726257 [0,1,0,0,0,1|2,0,0]=4 8763 B18R2.3984 Brc1cnccc1OCCCc2ccccc2 34a_100011996408_100000211621 [0,1,0,0,0,1|2,0,0]=4 8764 B18R2.3984 Brc1cnccc1OCOCc2ccccc2 34a_100011996408_100000763385 [0,1,0,0,0,1|1,0,0]=3 8765 B18R2.3984 Brc1cnccc1OCSCc2ccccc2 34a_100011996408_200011217039 [0,1,0,0,0,1|1,1,0]=4 8766 B18R2.3984 Brc1cnccc1SCCCc2ccccc2 62a_100000211621_100000726257 [0,1,0,0,0,1|2,0,0]=4 8767 B18R2.3984 Brc1cnccc1SCCCc2ccccc2 62a_100000726257_100000211621 [0,1,0,0,0,1|2,0,0]=4 8768 B18R2.3984 Brc1cnccc1SCOCc2ccccc2 62a_100000726257_100000763385 [0,1,0,0,0,1|1,0,0]=3 8769 B18R2.3984 Brc1cnccc1SCOCc2ccccc2 62a_100000763385_100000726257 [0,1,0,0,0,1|1,0,0]=3 8770 B18R2.3984 Brc1cnccc1SCSCc2ccccc2 62a_100000726257_200011217039 [0,1,0,0,0,1|1,1,0]=4 8771 B18R2.3984 Brc1cnccc1SCSCc2ccccc2 62a_200011217039_100000726257 [0,1,0,0,0,1|1,1,0]=4 8772 B18R2.3984 Brc1ncccc1CNCCc2ccccc2 2230a_100000106460_100010140945 [0,1,0,0,0,1|2,0,0]=4 8773 B18R2.3984 Brc1ncccc1CNCCc2ccccc2 2230a_100009818023_100000765856 [0,1,0,0,0,1|2,0,0]=4 8774 B18R2.3984 Brc1ncccc1CNCCc2ccccc2 34a_100000106460_100010140945 [0,1,0,0,0,1|2,0,0]=4 8775 B18R2.3984 Brc1ncccc1CNCCc2ccccc2 34a_100009818023_100000765856 [0,1,0,0,0,1|2,0,0]=4 8776 B18R2.3984 Brc1ncccc1CNCSc2ccccc2 2230a_100009818023_100011218342 [0,1,0,0,0,1|2,0,0]=4 8777 B18R2.3984 Brc1ncccc1COCCc2ccccc2 34a_100000210268_100010140945 [0,1,0,0,0,1|1,0,0]=3 8778 B18R2.3984 Brc1ncccc1COCCc2ccccc2 34a_100000719692_100000765856 [0,1,0,0,0,1|1,0,0]=3 8779 B18R2.3984 Brc1ncccc1COCCc2ccccc2 7a_100000210268_100010140945 [0,1,0,0,0,1|1,0,0]=3 8780 B18R2.3984 Brc1ncccc1COCCc2ccccc2 7a_100000719692_100000765856 [0,1,0,0,0,1|1,0,0]=3 8781 B18R2.3984 Brc1ncccc1COCCc2ccccn2 34a_100000210271_100010140945 [0,1,0,0,0,1|2,0,0]=4 8782 B18R2.3984 Brc1ncccc1COCCc2ccccn2 7a_100000719692_100015183660 [0,1,0,0,0,1|2,0,0]=4 8783 B18R2.3984 Brc1ncccc1COCCc2cccnc2 34a_100011217484_100010140945 [0,1,0,0,0,1|2,0,0]=4 8784 B18R2.3984 Brc1ncccc1COCCc2cccnc2 7a_100000719692_200011713674 [0,1,0,0,0,1|2,0,0]=4 8785 B18R2.3984 Brc1ncccc1COCCc2ccncc2 34a_100011216225_100010140945 [0,1,0,0,0,1|2,0,0]=4 8786 B18R2.3984 Brc1ncccc1COCCc2ccncc2 7a_100000719692_100000723409 [0,1,0,0,0,1|2,0,0]=4 8787 B18R2.3984 Brc1ncccc1CSCCc2ccccc2 62a_100000765856_100010140945 [0,1,0,0,0,1|1,1,0]=4 8788 B18R2.3984 Brc1ncccc1CSCCc2ccccc2 62a_100010140945_100011218657 [0,1,0,0,0,1|1,1,0]=4 8789 B18R2.3984 Brc1ncccc1CSCSc2ccccc2 62a_100010140945_100011218342 [0,1,0,0,0,1|1,1,0]=4 8790 B18R2.3984 Brc1ncccc1CSCSc2ccccc2 62a_100011218342_100010140945 [0,1,0,0,0,1|1,1,0]=4 8791 B18R2.3984 Brc1ncccc1OCCCc2ccccc2 34a_100000744436_100000211621 [0,1,0,0,0,1|2,0,0]=4 8792 B18R2.3984 Brc1ncccc1OCCCc2ccccc2 7a_100000744436_100000211621 [0,1,0,0,0,1|2,0,0]=4 8793 B18R2.3984 Brc1ncccc1OCOCc2ccccc2 34a_100000744436_100000763385 [0,1,0,0,0,1|1,0,0]=3 8794 B18R2.3984 Brc1ncccc1OCSCc2ccccc2 34a_100000744436_200011217039 [0,1,0,0,0,1|1,1,0]=4 8795 B18R2.3984 Brc1ncccc1SCCCc2ccccc2 62a_100000211621_100010202626 [0,1,0,0,0,1|2,0,0]=4 8796 B18R2.3984 Brc1ncccc1SCCCc2ccccc2 62a_100010202626_100000211621 [0,1,0,0,0,1|2,0,0]=4 8797 B18R2.3984 Brc1ncccc1SCOCc2ccccc2 62a_100000763385_100010202626 [0,1,0,0,0,1|1,0,0]=3 8798 B18R2.3984 Brc1ncccc1SCOCc2ccccc2 62a_100010202626_100000763385 [0,1,0,0,0,1|1,0,0]=3 8799 B18R2.3984 Brc1ncccc1SCSCc2ccccc2 62a_100010202626_200011217039 [0,1,0,0,0,1|1,1,0]=4 8800 B18R2.3984 Brc1ncccc1SCSCc2ccccc2 62a_200011217039_100010202626 [0,1,0,0,0,1|1,1,0]=4 8801 B18R2.3984 Brc1ncncc1SCOCc2ccccc2 62a_100000763385_200012461658 [0,1,0,0,0,1|2,0,0]=4 8802 B18R2.3984 Brc1ncncc1SCOCc2ccccc2 62a_200012461658_100000763385 [0,1,0,0,0,1|2,0,0]=4 8803 B18R2.3984 C[n+]1ccccc1SCCCc2ccccc2 62a_100000211621_100000212160 [0,1,0,0,0,1|2,0,0]=4 8804 B18R2.3984 C[n+]1ccccc1SCOCc2ccccc2 62a_100000763385_100000212160 [0,1,0,0,0,1|1,0,0]=3 8805 B18R2.3984 C[n+]1ccccc1SCSCc2ccccc2 62a_200011217039_100000212160 [0,1,0,0,0,1|1,1,0]=4 8806 B18R2.3984 Cc1ccccc1C=NNCc2ccccc2 4a_100000007032_100000211143 [0,1,0,0,0,1|1,0,1]=4 8807 B18R2.3984 Cc1ccccc1CCNCc2ccccc2 207a_100000685071_100015611070 [0,1,0,0,0,1|1,0,0]=3 8808 B18R2.3984 Cc1ccccc1CCNCc2ccccc2 2230a_100000685071_100015291786 [0,1,0,0,0,1|1,0,0]=3 8809 B18R2.3984 Cc1ccccc1CCNCc2ccccc2 2230a_100015324214_100011713688 [0,1,0,0,0,1|1,0,0]=3 8810 B18R2.3984 Cc1ccccc1CCNCc2ccccc2 270004a_100000685071_100015611070 [0,1,0,0,0,1|1,0,0]=3 8811 B18R2.3984 Cc1ccccc1CCNCc2ccccc2 34a_100000685071_100015291786 [0,1,0,0,0,1|1,0,0]=3 8812 B18R2.3984 Cc1ccccc1CCNCc2ccccc2 34a_100015324214_100011713688 [0,1,0,0,0,1|1,0,0]=3 8813 B18R2.3984 Cc1ccccc1CCNCc2ccccn2 207a_100000685071_100000209966 [0,1,0,0,0,1|2,0,0]=4 8814 B18R2.3984 Cc1ccccc1CCNCc2ccccn2 2230a_100000685071_100000721315 [0,1,0,0,0,1|2,0,0]=4 8815 B18R2.3984 Cc1ccccc1CCNCc2ccccn2 270004a_100000685071_100000209966 [0,1,0,0,0,1|2,0,0]=4 8816 B18R2.3984 Cc1ccccc1CCNCc2ccccn2 34a_100000685071_100000721315 [0,1,0,0,0,1|2,0,0]=4 8817 B18R2.3984 Cc1ccccc1CCNCc2cccnc2 207a_100000685071_100000209961 [0,1,0,0,0,1|2,0,0]=4 8818 B18R2.3984 Cc1ccccc1CCNCc2cccnc2 2230a_100000685071_100000741622 [0,1,0,0,0,1|2,0,0]=4 8819 B18R2.3984 Cc1ccccc1CCNCc2cccnc2 270004a_100000685071_100000209961 [0,1,0,0,0,1|2,0,0]=4 8820 B18R2.3984 Cc1ccccc1CCNCc2cccnc2 34a_100000685071_100000733263 [0,1,0,0,0,1|2,0,0]=4 8821 B18R2.3984 Cc1ccccc1CCNCc2ccncc2 207a_100000685071_100000186114 [0,1,0,0,0,1|2,0,0]=4 8822 B18R2.3984 Cc1ccccc1CCNCc2ccncc2 2230a_100000685071_100015193705 [0,1,0,0,0,1|2,0,0]=4 8823 B18R2.3984 Cc1ccccc1CCOCc2ccccc2 34a_100000210790_100011713688 [0,1,0,0,0,1|0,0,0]=2 8824 B18R2.3984 Cc1ccccc1CCOCc2ccccc2 34a_100011220023_100015291786 [0,1,0,0,0,1|0,0,0]=2 8825 B18R2.3984 Cc1ccccc1CCOCc2ccccc2 7a_100000210790_100011713688 [0,1,0,0,0,1|0,0,0]=2 8826 B18R2.3984 Cc1ccccc1CCOCc2ccccc2 7a_100011220023_100000211182 [0,1,0,0,0,1|0,0,0]=2 8827 B18R2.3984 Cc1ccccc1CCOCc2ccccn2 34a_100011220023_100000721315 [0,1,0,0,0,1|1,0,0]=3 8828 B18R2.3984 Cc1ccccc1CCOCc2ccccn2 7a_100011220023_100000721315 [0,1,0,0,0,1|1,0,0]=3 8829 B18R2.3984 Cc1ccccc1CCOCc2cccnc2 34a_100011220023_100000733263 [0,1,0,0,0,1|1,0,0]=3 8830 B18R2.3984 Cc1ccccc1CCOCc2cccnc2 7a_100011220023_100000741622 [0,1,0,0,0,1|1,0,0]=3 8831 B18R2.3984 Cc1ccccc1CCOCc2cccnn2 34a_100011220023_100016990269 [0,1,0,0,0,1|2,0,0]=4 8832 B18R2.3984 Cc1ccccc1CCOCc2cccnn2 7a_100011220023_100016990269 [0,1,0,0,0,1|2,0,0]=4 8833 B18R2.3984 Cc1ccccc1CCOCc2ccncc2 7a_100011220023_100015193705 [0,1,0,0,0,1|1,0,0]=3 8834 B18R2.3984 Cc1ccccc1CCOCc2cnccn2 34a_100011220023_100016995436 [0,1,0,0,0,1|2,0,0]=4 8835 B18R2.3984 Cc1ccccc1CCOCc2cnccn2 7a_100011220023_100016995436 [0,1,0,0,0,1|2,0,0]=4 8836 B18R2.3984 Cc1ccccc1CCOCc2cncnc2 34a_100011220023_100015196519 [0,1,0,0,0,1|2,0,0]=4 8837 B18R2.3984 Cc1ccccc1CCOCc2cncnc2 7a_100011220023_100015196519 [0,1,0,0,0,1|2,0,0]=4 8838 B18R2.3984 Cc1ccccc1CCOCc2ncccn2 34a_100011220023_100000703007 [0,1,0,0,0,1|2,0,0]=4 8839 B18R2.3984 Cc1ccccc1CCOCc2ncccn2 7a_100011220023_100000703007 [0,1,0,0,0,1|2,0,0]=4 8840 B18R2.3984 Cc1ccccc1CCSCc2ccccc2 62a_100000211182_100011713688 [0,1,0,0,0,1|0,1,0]=3 8841 B18R2.3984 Cc1ccccc1CCSCc2ccccc2 62a_100011713688_100015291786 [0,1,0,0,0,1|0,1,0]=3 8842 B18R2.3984 Cc1ccccc1CCSCc2ccccn2 62a_100000721315_100011713688 [0,1,0,0,0,1|1,1,0]=4 8843 B18R2.3984 Cc1ccccc1CCSCc2ccccn2 62a_100011713688_100000721315 [0,1,0,0,0,1|1,1,0]=4 8844 B18R2.3984 Cc1ccccc1CCSCc2cccnc2 62a_100000741622_100011713688 [0,1,0,0,0,1|1,1,0]=4 8845 B18R2.3984 Cc1ccccc1CCSCc2cccnc2 62a_100011713688_100000741622 [0,1,0,0,0,1|1,1,0]=4 8846 B18R2.3984 Cc1ccccc1CCSCc2ccncc2 62a_100011713688_100015193705 [0,1,0,0,0,1|1,1,0]=4 8847 B18R2.3984 Cc1ccccc1CCSCc2ccncc2 62a_100015193705_100011713688 [0,1,0,0,0,1|1,1,0]=4 8848 B18R2.3984 Cc1ccccc1CNCCc2ccccc2 207a_100000106460_100000211143 [0,1,0,0,0,1|1,0,0]=3 8849 B18R2.3984 Cc1ccccc1CNCCc2ccccc2 2230a_100000106460_100000211839 [0,1,0,0,0,1|1,0,0]=3 8850 B18R2.3984 Cc1ccccc1CNCCc2ccccc2 270004a_100000106460_100000211143 [0,1,0,0,0,1|1,0,0]=3 8851 B18R2.3984 Cc1ccccc1CNCCc2ccccc2 34a_100000106460_100000211839 [0,1,0,0,0,1|1,0,0]=3 8852 B18R2.3984 Cc1ccccc1CNCCc2ccccc2 34a_100000174972_100000765856 [0,1,0,0,0,1|1,0,0]=3 8853 B18R2.3984 Cc1ccccc1CNCCc2ccccn2 207a_100000211156_100000211143 [0,1,0,0,0,1|2,0,0]=4 8854 B18R2.3984 Cc1ccccc1CNCCc2ccccn2 270004a_100000211156_100000211143 [0,1,0,0,0,1|2,0,0]=4 8855 B18R2.3984 Cc1ccccc1CNCCc2cccnc2 207a_100000736294_100000211143 [0,1,0,0,0,1|2,0,0]=4 8856 B18R2.3984 Cc1ccccc1CNCCc2cccnc2 2230a_100000736294_100000211839 [0,1,0,0,0,1|2,0,0]=4 8857 B18R2.3984 Cc1ccccc1CNCCc2cccnc2 270004a_100000736294_100000211143 [0,1,0,0,0,1|2,0,0]=4 8858 B18R2.3984 Cc1ccccc1CNCCc2ccncc2 207a_100000742849_100000211143 [0,1,0,0,0,1|2,0,0]=4 8859 B18R2.3984 Cc1ccccc1CNCCc2ccncc2 270004a_100000742849_100000211143 [0,1,0,0,0,1|2,0,0]=4 8860 B18R2.3984 Cc1ccccc1CNN=Cc2ccccc2 4a_100000737298_100015611070 [0,1,0,0,0,1|1,0,1]=4 8861 B18R2.3984 Cc1ccccc1COCCc2ccccc2 34a_100000210268_100000211839 [0,1,0,0,0,1|0,0,0]=2 8862 B18R2.3984 Cc1ccccc1COCCc2ccccc2 34a_100000698903_100000765856 [0,1,0,0,0,1|0,0,0]=2 8863 B18R2.3984 Cc1ccccc1COCCc2ccccc2 7a_100000210268_100000211839 [0,1,0,0,0,1|0,0,0]=2 8864 B18R2.3984 Cc1ccccc1COCCc2ccccc2 7a_100000698903_100000765856 [0,1,0,0,0,1|0,0,0]=2 8865 B18R2.3984 Cc1ccccc1COCCc2ccccn2 34a_100000210271_100000211839 [0,1,0,0,0,1|1,0,0]=3 8866 B18R2.3984 Cc1ccccc1COCCc2ccccn2 7a_100000698903_100015183660 [0,1,0,0,0,1|1,0,0]=3 8867 B18R2.3984 Cc1ccccc1COCCc2cccnc2 34a_100011217484_100000211839 [0,1,0,0,0,1|1,0,0]=3 8868 B18R2.3984 Cc1ccccc1COCCc2cccnc2 7a_100000698903_200011713674 [0,1,0,0,0,1|1,0,0]=3 8869 B18R2.3984 Cc1ccccc1COCCc2ccncc2 34a_100011216225_100000211839 [0,1,0,0,0,1|1,0,0]=3 8870 B18R2.3984 Cc1ccccc1COCCc2ccncc2 7a_100000698903_100000723409 [0,1,0,0,0,1|1,0,0]=3 8871 B18R2.3984 Cc1ccccc1COCCc2cnccn2 34a_100011349526_100000211839 [0,1,0,0,0,1|2,0,0]=4 8872 B18R2.3984 Cc1ccccc1COCCc2cncnc2 34a_100011709255_100000211839 [0,1,0,0,0,1|2,0,0]=4 8873 B18R2.3984 Cc1ccccc1CSCCc2ccccc2 62a_100000211839_100011218657 [0,1,0,0,0,1|0,1,0]=3 8874 B18R2.3984 Cc1ccccc1CSCCc2ccccc2 62a_100000765856_100000211839 [0,1,0,0,0,1|0,1,0]=3 8875 B18R2.3984 Cc1ccccc1CSCCc2ccccn2 62a_100000211839_100015183660 [0,1,0,0,0,1|1,1,0]=4 8876 B18R2.3984 Cc1ccccc1CSCCc2ccccn2 62a_100015183660_100000211839 [0,1,0,0,0,1|1,1,0]=4 8877 B18R2.3984 Cc1ccccc1CSCCc2cccnc2 62a_100000211839_200011713674 [0,1,0,0,0,1|1,1,0]=4 8878 B18R2.3984 Cc1ccccc1CSCCc2cccnc2 62a_200011713674_100000211839 [0,1,0,0,0,1|1,1,0]=4 8879 B18R2.3984 Cc1ccccc1CSCCc2ccncc2 62a_100000211839_100000723409 [0,1,0,0,0,1|1,1,0]=4 8880 B18R2.3984 Cc1ccccc1CSCCc2ccncc2 62a_100000723409_100000211839 [0,1,0,0,0,1|1,1,0]=4 8881 B18R2.3984 Cc1ccccc1CSCSc2ccccc2 62a_100000211839_100011218342 [0,1,0,0,0,1|0,1,0]=3 8882 B18R2.3984 Cc1ccccc1CSCSc2ccccc2 62a_100011218342_100000211839 [0,1,0,0,0,1|0,1,0]=3 8883 B18R2.3984 Cc1ccccc1NC/C=C/c2ccccc2 34a_100015192222_100016265936 [0,1,0,0,0,1|1,0,1]=4 8884 B18R2.3984 Cc1ccccc1NCC#Cc2ccccc2 34a_100015192222_100011352542 [0,1,0,0,0,1|1,0,1]=4 8885 B18R2.3984 Cc1ccccc1NCCCc2ccccc2 34a_100015192222_100000211621 [0,1,0,0,0,1|1,0,0]=3 8886 B18R2.3984 Cc1ccccc1NCCOc2ccccc2 34a_100015192222_100000184471 [0,1,0,0,0,1|2,0,0]=4 8887 B18R2.3984 Cc1ccccc1NCCSc2ccccc2 34a_100015192222_100000246102 [0,1,0,0,0,1|2,0,0]=4 8888 B18R2.3984 Cc1ccccc1NCOCc2ccccc2 34a_100015192222_100000763385 [0,1,0,0,0,1|0,0,0]=2 8889 B18R2.3984 Cc1ccccc1NCSCc2ccccc2 34a_100015192222_200011217039 [0,1,0,0,0,1|0,1,0]=3 8890 B18R2.3984 Cc1ccccc1NN=CCc2ccccc2 4a_100000184220_100000209964 [0,1,0,0,0,1|2,0,0]=4 8891 B18R2.3984 Cc1ccccc1OC/C=C/c2ccccc2 34a_100000210338_100016265936 [0,1,0,0,0,1|1,0,1]=4 8892 B18R2.3984 Cc1ccccc1OC/C=C/c2ccccc2 7a_100000210338_100016265936 [0,1,0,0,0,1|1,0,1]=4 8893 B18R2.3984 Cc1ccccc1OCC#Cc2ccccc2 34a_100000210338_100011352542 [0,1,0,0,0,1|1,0,1]=4 8894 B18R2.3984 Cc1ccccc1OCC#Cc2ccccc2 7a_100000210338_100011352542 [0,1,0,0,0,1|1,0,1]=4 8895 B18R2.3984 Cc1ccccc1OCCCc2ccccc2 34a_100000210338_100000211621 [0,1,0,0,0,1|1,0,0]=3 8896 B18R2.3984 Cc1ccccc1OCCCc2ccccc2 7a_100000210338_100000211621 [0,1,0,0,0,1|1,0,0]=3 8897 B18R2.3984 Cc1ccccc1OCCNc2ccccc2 34a_100000106764_100000184434 [0,1,0,0,0,1|2,0,0]=4 8898 B18R2.3984 Cc1ccccc1OCCOc2ccccc2 34a_100000210338_100000184471 [0,1,0,0,0,1|2,0,0]=4 8899 B18R2.3984 Cc1ccccc1OCCOc2ccccc2 34a_100000210340_100000184434 [0,1,0,0,0,1|2,0,0]=4 8900 B18R2.3984 Cc1ccccc1OCCOc2ccccc2 7a_100000210338_100000184471 [0,1,0,0,0,1|2,0,0]=4 8901 B18R2.3984 Cc1ccccc1OCCOc2ccccc2 7a_100000210340_100000184434 [0,1,0,0,0,1|2,0,0]=4 8902 B18R2.3984 Cc1ccccc1OCCSc2ccccc2 34a_100000210338_100000246102 [0,1,0,0,0,1|2,0,0]=4 8903 B18R2.3984 Cc1ccccc1OCCSc2ccccc2 62a_100000184434_100000041952 [0,1,0,0,0,1|2,0,0]=4 8904 B18R2.3984 Cc1ccccc1OCCSc2ccccc2 62a_100000719477_100000184434 [0,1,0,0,0,1|2,0,0]=4 8905 B18R2.3984 Cc1ccccc1OCCSc2ccccc2 7a_100000210338_100000246102 [0,1,0,0,0,1|2,0,0]=4 8906 B18R2.3984 Cc1ccccc1OCOCc2ccccc2 34a_100000210338_100000763385 [0,1,0,0,0,1|0,0,0]=2 8907 B18R2.3984 Cc1ccccc1OCSCc2ccccc2 34a_100000210338_200011217039 [0,1,0,0,0,1|0,1,0]=3 8908 B18R2.3984 Cc1ccccc1SC/C=C/c2ccccc2 62a_100000210755_100016265936 [0,1,0,0,0,1|1,0,1]=4 8909 B18R2.3984 Cc1ccccc1SC/C=C/c2ccccc2 62a_100016265936_100000210755 [0,1,0,0,0,1|1,0,1]=4 8910 B18R2.3984 Cc1ccccc1SCC#Cc2ccccc2 62a_100000210755_100011352542 [0,1,0,0,0,1|1,0,1]=4 8911 B18R2.3984 Cc1ccccc1SCCCc2ccccc2 62a_100000210755_100000211621 [0,1,0,0,0,1|1,0,0]=3 8912 B18R2.3984 Cc1ccccc1SCCCc2ccccc2 62a_100000211621_100000210755 [0,1,0,0,0,1|1,0,0]=3 8913 B18R2.3984 Cc1ccccc1SCCOc2ccccc2 62a_100000184471_100000210755 [0,1,0,0,0,1|2,0,0]=4 8914 B18R2.3984 Cc1ccccc1SCCOc2ccccc2 62a_100000210755_100000184471 [0,1,0,0,0,1|2,0,0]=4 8915 B18R2.3984 Cc1ccccc1SCCSc2ccccc2 62a_100000210755_100000246102 [0,1,0,0,0,1|2,0,0]=4 8916 B18R2.3984 Cc1ccccc1SCCSc2ccccc2 62a_100000246102_100000210755 [0,1,0,0,0,1|2,0,0]=4 8917 B18R2.3984 Cc1ccccc1SCOCc2ccccc2 62a_100000210755_100000763385 [0,1,0,0,0,1|0,0,0]=2 8918 B18R2.3984 Cc1ccccc1SCOCc2ccccc2 62a_100000763385_100000210755 [0,1,0,0,0,1|0,0,0]=2 8919 B18R2.3984 Cc1ccccc1SCSCc2ccccc2 62a_100000210755_200011217039 [0,1,0,0,0,1|0,1,0]=3 8920 B18R2.3984 Cc1ccccc1SCSCc2ccccc2 62a_200011217039_100000210755 [0,1,0,0,0,1|0,1,0]=3 8921 B18R2.3984 Cc1cccnc1CCOCc2ccccc2 34a_100011997706_100015291786 [0,1,0,0,0,1|1,0,0]=3 8922 B18R2.3984 Cc1cccnc1CCOCc2ccccc2 7a_100011997706_100000211182 [0,1,0,0,0,1|1,0,0]=3 8923 B18R2.3984 Cc1cccnc1CCOCc2ccccn2 34a_100011997706_100000721315 [0,1,0,0,0,1|2,0,0]=4 8924 B18R2.3984 Cc1cccnc1CCOCc2ccccn2 7a_100011997706_100000721315 [0,1,0,0,0,1|2,0,0]=4 8925 B18R2.3984 Cc1cccnc1CCOCc2cccnc2 34a_100011997706_100000733263 [0,1,0,0,0,1|2,0,0]=4 8926 B18R2.3984 Cc1cccnc1CCOCc2cccnc2 7a_100011997706_100000741622 [0,1,0,0,0,1|2,0,0]=4 8927 B18R2.3984 Cc1cccnc1CCOCc2ccncc2 7a_100011997706_100015193705 [0,1,0,0,0,1|2,0,0]=4 8928 B18R2.3984 Cc1cccnc1CNCCc2ccccc2 207a_100000106460_100000698913 [0,1,0,0,0,1|2,0,0]=4 8929 B18R2.3984 Cc1cccnc1CNCCc2ccccc2 2230a_100000106460_100000696600 [0,1,0,0,0,1|2,0,0]=4 8930 B18R2.3984 Cc1cccnc1CNCCc2ccccc2 270004a_100000106460_100000698913 [0,1,0,0,0,1|2,0,0]=4 8931 B18R2.3984 Cc1cccnc1CNCCc2ccccc2 34a_100000106460_100000696600 [0,1,0,0,0,1|2,0,0]=4 8932 B18R2.3984 Cc1cccnc1CNCCc2ccccc2 34a_100011223789_100000765856 [0,1,0,0,0,1|2,0,0]=4 8933 B18R2.3984 Cc1cccnc1COCCc2ccccc2 34a_100000210268_100000696600 [0,1,0,0,0,1|1,0,0]=3 8934 B18R2.3984 Cc1cccnc1COCCc2ccccc2 34a_100000698912_100000765856 [0,1,0,0,0,1|1,0,0]=3 8935 B18R2.3984 Cc1cccnc1COCCc2ccccc2 7a_100000210268_100000696600 [0,1,0,0,0,1|1,0,0]=3 8936 B18R2.3984 Cc1cccnc1COCCc2ccccn2 34a_100000210271_100000696600 [0,1,0,0,0,1|2,0,0]=4 8937 B18R2.3984 Cc1cccnc1COCCc2cccnc2 34a_100011217484_100000696600 [0,1,0,0,0,1|2,0,0]=4 8938 B18R2.3984 Cc1cccnc1COCCc2ccncc2 34a_100011216225_100000696600 [0,1,0,0,0,1|2,0,0]=4 8939 B18R2.3984 Cc1cccnc1CSCCc2ccccc2 62a_100000696600_100011218657 [0,1,0,0,0,1|1,1,0]=4 8940 B18R2.3984 Cc1cccnc1CSCCc2ccccc2 62a_100000765856_100000696600 [0,1,0,0,0,1|1,1,0]=4 8941 B18R2.3984 Cc1cccnc1CSCSc2ccccc2 62a_100000696600_100011218342 [0,1,0,0,0,1|1,1,0]=4 8942 B18R2.3984 Cc1cccnc1CSCSc2ccccc2 62a_100011218342_100000696600 [0,1,0,0,0,1|1,1,0]=4 8943 B18R2.3984 Cc1cccnc1SCCCc2ccccc2 62a_100000211621_100000751373 [0,1,0,0,0,1|2,0,0]=4 8944 B18R2.3984 Cc1cccnc1SCCCc2ccccc2 62a_100000751373_100000211621 [0,1,0,0,0,1|2,0,0]=4 8945 B18R2.3984 Cc1cccnc1SCOCc2ccccc2 62a_100000751373_100000763385 [0,1,0,0,0,1|1,0,0]=3 8946 B18R2.3984 Cc1cccnc1SCOCc2ccccc2 62a_100000763385_100000751373 [0,1,0,0,0,1|1,0,0]=3 8947 B18R2.3984 Cc1cccnc1SCSCc2ccccc2 62a_100000751373_200011217039 [0,1,0,0,0,1|1,1,0]=4 8948 B18R2.3984 Cc1cccnc1SCSCc2ccccc2 62a_200011217039_100000751373 [0,1,0,0,0,1|1,1,0]=4 8949 B18R2.3984 Cc1ccncc1CNCCc2ccccc2 207a_100000106460_100000685662 [0,1,0,0,0,1|2,0,0]=4 8950 B18R2.3984 Cc1ccncc1CNCCc2ccccc2 2230a_100000106460_100000690890 [0,1,0,0,0,1|2,0,0]=4 8951 B18R2.3984 Cc1ccncc1CNCCc2ccccc2 270004a_100000106460_100000685662 [0,1,0,0,0,1|2,0,0]=4 8952 B18R2.3984 Cc1ccncc1CNCCc2ccccc2 34a_100000106460_100000690890 [0,1,0,0,0,1|2,0,0]=4 8953 B18R2.3984 Cc1ccncc1COCCc2ccccc2 34a_100000210268_100000690890 [0,1,0,0,0,1|1,0,0]=3 8954 B18R2.3984 Cc1ccncc1COCCc2ccccc2 34a_100011996381_100000765856 [0,1,0,0,0,1|1,0,0]=3 8955 B18R2.3984 Cc1ccncc1COCCc2ccccc2 7a_100000210268_100000690890 [0,1,0,0,0,1|1,0,0]=3 8956 B18R2.3984 Cc1ccncc1COCCc2ccccn2 34a_100000210271_100000690890 [0,1,0,0,0,1|2,0,0]=4 8957 B18R2.3984 Cc1ccncc1COCCc2cccnc2 34a_100011217484_100000690890 [0,1,0,0,0,1|2,0,0]=4 8958 B18R2.3984 Cc1ccncc1COCCc2ccncc2 34a_100011216225_100000690890 [0,1,0,0,0,1|2,0,0]=4 8959 B18R2.3984 Cc1ccncc1CSCCc2ccccc2 62a_100000690890_100011218657 [0,1,0,0,0,1|1,1,0]=4 8960 B18R2.3984 Cc1ccncc1CSCCc2ccccc2 62a_100000765856_100000690890 [0,1,0,0,0,1|1,1,0]=4 8961 B18R2.3984 Cc1ccncc1CSCSc2ccccc2 62a_100000690890_100011218342 [0,1,0,0,0,1|1,1,0]=4 8962 B18R2.3984 Cc1ccncc1CSCSc2ccccc2 62a_100011218342_100000690890 [0,1,0,0,0,1|1,1,0]=4 8963 B18R2.3984 Cc1ccncc1OCCCc2ccccc2 34a_100011997053_100000211621 [0,1,0,0,0,1|2,0,0]=4 8964 B18R2.3984 Cc1ccncc1OCCCc2ccccc2 7a_100011997053_100000211621 [0,1,0,0,0,1|2,0,0]=4 8965 B18R2.3984 Cc1ccncc1OCOCc2ccccc2 34a_100011997053_100000763385 [0,1,0,0,0,1|1,0,0]=3 8966 B18R2.3984 Cc1ccncc1OCSCc2ccccc2 34a_100011997053_200011217039 [0,1,0,0,0,1|1,1,0]=4 8967 B18R2.3984 Cc1ccncc1SCCCc2ccccc2 62a_100000211621_100000761580 [0,1,0,0,0,1|2,0,0]=4 8968 B18R2.3984 Cc1ccncc1SCCCc2ccccc2 62a_100000761580_100000211621 [0,1,0,0,0,1|2,0,0]=4 8969 B18R2.3984 Cc1ccncc1SCOCc2ccccc2 62a_100000761580_100000763385 [0,1,0,0,0,1|1,0,0]=3 8970 B18R2.3984 Cc1ccncc1SCOCc2ccccc2 62a_100000763385_100000761580 [0,1,0,0,0,1|1,0,0]=3 8971 B18R2.3984 Cc1ccncc1SCSCc2ccccc2 62a_100000761580_200011217039 [0,1,0,0,0,1|1,1,0]=4 8972 B18R2.3984 Cc1ccncc1SCSCc2ccccc2 62a_200011217039_100000761580 [0,1,0,0,0,1|1,1,0]=4 8973 B18R2.3984 Cc1ccnnc1SCOCc2ccccc2 62a_100000763385_100000089043 [0,1,0,0,0,1|2,0,0]=4 8974 B18R2.3984 Cc1cnccc1CNCCc2ccccc2 2230a_100000106460_100020672808 [0,1,0,0,0,1|2,0,0]=4 8975 B18R2.3984 Cc1cnccc1CNCCc2ccccc2 34a_100000106460_100020672809 [0,1,0,0,0,1|2,0,0]=4 8976 B18R2.3984 Cc1cnccc1COCCc2ccccc2 34a_100000210268_100020672809 [0,1,0,0,0,1|1,0,0]=3 8977 B18R2.3984 Cc1cnccc1COCCc2ccccc2 34a_100011997032_100000765856 [0,1,0,0,0,1|1,0,0]=3 8978 B18R2.3984 Cc1cnccc1COCCc2ccccc2 7a_100000210268_100020672808 [0,1,0,0,0,1|1,0,0]=3 8979 B18R2.3984 Cc1cnccc1COCCc2ccccn2 34a_100000210271_100020672809 [0,1,0,0,0,1|2,0,0]=4 8980 B18R2.3984 Cc1cnccc1COCCc2cccnc2 34a_100011217484_100020672809 [0,1,0,0,0,1|2,0,0]=4 8981 B18R2.3984 Cc1cnccc1COCCc2ccncc2 34a_100011216225_100020672809 [0,1,0,0,0,1|2,0,0]=4 8982 B18R2.3984 Cc1cnccc1CSCCc2ccccc2 62a_100000765856_100020672808 [0,1,0,0,0,1|1,1,0]=4 8983 B18R2.3984 Cc1cnccc1CSCCc2ccccc2 62a_100020672808_100011218657 [0,1,0,0,0,1|1,1,0]=4 8984 B18R2.3984 Cc1cnccc1CSCSc2ccccc2 62a_100011218342_100020672808 [0,1,0,0,0,1|1,1,0]=4 8985 B18R2.3984 Cc1cnccc1CSCSc2ccccc2 62a_100020672808_100011218342 [0,1,0,0,0,1|1,1,0]=4 8986 B18R2.3984 Cc1cnccc1NCCCc2ccccc2 27a_100000211184_100000765111 [0,1,0,0,0,1|2,0,0]=4 8987 B18R2.3984 Cc1cnccc1OCCCc2ccccc2 34a_100000694293_100000211621 [0,1,0,0,0,1|2,0,0]=4 8988 B18R2.3984 Cc1cnccc1OCOCc2ccccc2 34a_100000694293_100000763385 [0,1,0,0,0,1|1,0,0]=3 8989 B18R2.3984 Cc1cnccc1OCSCc2ccccc2 34a_100000694293_200011217039 [0,1,0,0,0,1|1,1,0]=4 8990 B18R2.3984 Cc1cnccc1SCCCc2ccccc2 62a_100000211621_100000765111 [0,1,0,0,0,1|2,0,0]=4 8991 B18R2.3984 Cc1cnccc1SCCCc2ccccc2 62a_100000765111_100000211621 [0,1,0,0,0,1|2,0,0]=4 8992 B18R2.3984 Cc1cnccc1SCOCc2ccccc2 62a_100000763385_100000765111 [0,1,0,0,0,1|1,0,0]=3 8993 B18R2.3984 Cc1cnccc1SCOCc2ccccc2 62a_100000765111_100000763385 [0,1,0,0,0,1|1,0,0]=3 8994 B18R2.3984 Cc1cnccc1SCSCc2ccccc2 62a_100000765111_200011217039 [0,1,0,0,0,1|1,1,0]=4 8995 B18R2.3984 Cc1cnccc1SCSCc2ccccc2 62a_200011217039_100000765111 [0,1,0,0,0,1|1,1,0]=4 8996 B18R2.3984 Cc1cncnc1SCOCc2ccccc2 62a_100000763385_100011998708 [0,1,0,0,0,1|2,0,0]=4 8997 B18R2.3984 Cc1cncnc1SCOCc2ccccc2 62a_100011998708_100000763385 [0,1,0,0,0,1|2,0,0]=4 8998 B18R2.3984 Cc1ncccc1CNCCc2ccccc2 207a_100000106460_100000751968 [0,1,0,0,0,1|2,0,0]=4 8999 B18R2.3984 Cc1ncccc1CNCCc2ccccc2 2230a_100000106460_100000732876 [0,1,0,0,0,1|2,0,0]=4 9000 B18R2.3984 Cc1ncccc1CNCCc2ccccc2 270004a_100000106460_100000751968 [0,1,0,0,0,1|2,0,0]=4 9001 B18R2.3984 Cc1ncccc1CNCCc2ccccc2 34a_100000106460_100000732876 [0,1,0,0,0,1|2,0,0]=4 9002 B18R2.3984 Cc1ncccc1COCCc2ccccc2 34a_100000210268_100000732876 [0,1,0,0,0,1|1,0,0]=3 9003 B18R2.3984 Cc1ncccc1COCCc2ccccc2 34a_100000729262_100000765856 [0,1,0,0,0,1|1,0,0]=3 9004 B18R2.3984 Cc1ncccc1COCCc2ccccc2 7a_100000210268_100000732876 [0,1,0,0,0,1|1,0,0]=3 9005 B18R2.3984 Cc1ncccc1COCCc2ccccc2 7a_100000729262_100000765856 [0,1,0,0,0,1|1,0,0]=3 9006 B18R2.3984 Cc1ncccc1COCCc2ccccn2 34a_100000210271_100000732876 [0,1,0,0,0,1|2,0,0]=4 9007 B18R2.3984 Cc1ncccc1COCCc2ccccn2 7a_100000729262_100015183660 [0,1,0,0,0,1|2,0,0]=4 9008 B18R2.3984 Cc1ncccc1COCCc2cccnc2 34a_100011217484_100000732876 [0,1,0,0,0,1|2,0,0]=4 9009 B18R2.3984 Cc1ncccc1COCCc2cccnc2 7a_100000729262_200011713674 [0,1,0,0,0,1|2,0,0]=4 9010 B18R2.3984 Cc1ncccc1COCCc2ccncc2 34a_100011216225_100000732876 [0,1,0,0,0,1|2,0,0]=4 9011 B18R2.3984 Cc1ncccc1COCCc2ccncc2 7a_100000729262_100000723409 [0,1,0,0,0,1|2,0,0]=4 9012 B18R2.3984 Cc1ncccc1CSCCc2ccccc2 62a_100000732876_100011218657 [0,1,0,0,0,1|1,1,0]=4 9013 B18R2.3984 Cc1ncccc1CSCCc2ccccc2 62a_100000765856_100000732876 [0,1,0,0,0,1|1,1,0]=4 9014 B18R2.3984 Cc1ncccc1CSCSc2ccccc2 62a_100000732876_100011218342 [0,1,0,0,0,1|1,1,0]=4 9015 B18R2.3984 Cc1ncccc1CSCSc2ccccc2 62a_100011218342_100000732876 [0,1,0,0,0,1|1,1,0]=4 9016 B18R2.3984 Cc1ncccc1OCCCc2ccccc2 34a_100000745507_100000211621 [0,1,0,0,0,1|2,0,0]=4 9017 B18R2.3984 Cc1ncccc1OCCCc2ccccc2 7a_100000745507_100000211621 [0,1,0,0,0,1|2,0,0]=4 9018 B18R2.3984 Cc1ncccc1OCOCc2ccccc2 34a_100000745507_100000763385 [0,1,0,0,0,1|1,0,0]=3 9019 B18R2.3984 Cc1ncccc1OCSCc2ccccc2 34a_100000745507_200011217039 [0,1,0,0,0,1|1,1,0]=4 9020 B18R2.3984 Cc1ncccc1SCCCc2ccccc2 62a_100000211621_100000751574 [0,1,0,0,0,1|2,0,0]=4 9021 B18R2.3984 Cc1ncccc1SCCCc2ccccc2 62a_100000751574_100000211621 [0,1,0,0,0,1|2,0,0]=4 9022 B18R2.3984 Cc1ncccc1SCOCc2ccccc2 62a_100000751574_100000763385 [0,1,0,0,0,1|1,0,0]=3 9023 B18R2.3984 Cc1ncccc1SCOCc2ccccc2 62a_100000763385_100000751574 [0,1,0,0,0,1|1,0,0]=3 9024 B18R2.3984 Cc1ncccc1SCSCc2ccccc2 62a_100000751574_200011217039 [0,1,0,0,0,1|1,1,0]=4 9025 B18R2.3984 Cc1ncccc1SCSCc2ccccc2 62a_200011217039_100000751574 [0,1,0,0,0,1|1,1,0]=4 9026 B18R2.3984 Cc1nccnc1OCOCc2ccccc2 34a_100000766352_100000763385 [0,1,0,0,0,1|2,0,0]=4 9027 B18R2.3984 Cc1nccnc1SCOCc2ccccc2 62a_100000763385_100011999405 [0,1,0,0,0,1|2,0,0]=4 9028 B18R2.3984 Cc1nccnc1SCOCc2ccccc2 62a_100011999405_100000763385 [0,1,0,0,0,1|2,0,0]=4 9029 B18R2.3984 Cc1ncncc1SCOCc2ccccc2 62a_100000763385_100009819671 [0,1,0,0,0,1|2,0,0]=4 9030 B18R2.3984 Cc1ncncc1SCOCc2ccccc2 62a_100009819671_100000763385 [0,1,0,0,0,1|2,0,0]=4 9031 B18R2.3984 Clc1ccccc1C=NNCc2ccccc2 4a_100000007032_100000210073 [0,1,0,0,0,1|1,0,1]=4 9032 B18R2.3984 Clc1ccccc1CC=NNc2ccccc2 4a_100015195140_200011713468 [0,1,0,0,0,1|2,0,0]=4 9033 B18R2.3984 Clc1ccccc1CCNCc2ccccc2 207a_100011207228_100015611070 [0,1,0,0,0,1|1,0,0]=3 9034 B18R2.3984 Clc1ccccc1CCNCc2ccccc2 2230a_100011207228_100015291786 [0,1,0,0,0,1|1,0,0]=3 9035 B18R2.3984 Clc1ccccc1CCNCc2ccccc2 2230a_100015324214_100011713703 [0,1,0,0,0,1|1,0,0]=3 9036 B18R2.3984 Clc1ccccc1CCNCc2ccccc2 270004a_100011207228_100015611070 [0,1,0,0,0,1|1,0,0]=3 9037 B18R2.3984 Clc1ccccc1CCNCc2ccccc2 270004a_100015324214_200011713468 [0,1,0,0,0,1|1,0,0]=3 9038 B18R2.3984 Clc1ccccc1CCNCc2ccccc2 34a_100011207228_100015291786 [0,1,0,0,0,1|1,0,0]=3 9039 B18R2.3984 Clc1ccccc1CCNCc2ccccc2 34a_100015324214_100011713703 [0,1,0,0,0,1|1,0,0]=3 9040 B18R2.3984 Clc1ccccc1CCNCc2ccccn2 207a_100011207228_100000209966 [0,1,0,0,0,1|2,0,0]=4 9041 B18R2.3984 Clc1ccccc1CCNCc2ccccn2 2230a_100011207228_100000721315 [0,1,0,0,0,1|2,0,0]=4 9042 B18R2.3984 Clc1ccccc1CCNCc2ccccn2 270004a_100000210449_200011713468 [0,1,0,0,0,1|2,0,0]=4 9043 B18R2.3984 Clc1ccccc1CCNCc2ccccn2 270004a_100011207228_100000209966 [0,1,0,0,0,1|2,0,0]=4 9044 B18R2.3984 Clc1ccccc1CCNCc2ccccn2 34a_100011207228_100000721315 [0,1,0,0,0,1|2,0,0]=4 9045 B18R2.3984 Clc1ccccc1CCNCc2cccnc2 207a_100011207228_100000209961 [0,1,0,0,0,1|2,0,0]=4 9046 B18R2.3984 Clc1ccccc1CCNCc2cccnc2 2230a_100011207228_100000741622 [0,1,0,0,0,1|2,0,0]=4 9047 B18R2.3984 Clc1ccccc1CCNCc2cccnc2 270004a_100000210453_200011713468 [0,1,0,0,0,1|2,0,0]=4 9048 B18R2.3984 Clc1ccccc1CCNCc2cccnc2 270004a_100011207228_100000209961 [0,1,0,0,0,1|2,0,0]=4 9049 B18R2.3984 Clc1ccccc1CCNCc2cccnc2 34a_100011207228_100000733263 [0,1,0,0,0,1|2,0,0]=4 9050 B18R2.3984 Clc1ccccc1CCNCc2ccncc2 207a_100011207228_100000186114 [0,1,0,0,0,1|2,0,0]=4 9051 B18R2.3984 Clc1ccccc1CCNCc2ccncc2 2230a_100011207228_100015193705 [0,1,0,0,0,1|2,0,0]=4 9052 B18R2.3984 Clc1ccccc1CCOCc2ccccc2 34a_100000210790_100011713703 [0,1,0,0,0,1|0,0,0]=2 9053 B18R2.3984 Clc1ccccc1CCOCc2ccccc2 34a_100011215284_100015291786 [0,1,0,0,0,1|0,0,0]=2 9054 B18R2.3984 Clc1ccccc1CCOCc2ccccc2 7a_100000210790_100011713703 [0,1,0,0,0,1|0,0,0]=2 9055 B18R2.3984 Clc1ccccc1CCOCc2ccccc2 7a_100011215284_100000211182 [0,1,0,0,0,1|0,0,0]=2 9056 B18R2.3984 Clc1ccccc1CCOCc2ccccn2 34a_100011215284_100000721315 [0,1,0,0,0,1|1,0,0]=3 9057 B18R2.3984 Clc1ccccc1CCOCc2ccccn2 7a_100011215284_100000721315 [0,1,0,0,0,1|1,0,0]=3 9058 B18R2.3984 Clc1ccccc1CCOCc2cccnc2 34a_100011215284_100000733263 [0,1,0,0,0,1|1,0,0]=3 9059 B18R2.3984 Clc1ccccc1CCOCc2cccnc2 7a_100011215284_100000741622 [0,1,0,0,0,1|1,0,0]=3 9060 B18R2.3984 Clc1ccccc1CCOCc2cccnn2 34a_100011215284_100016990269 [0,1,0,0,0,1|2,0,0]=4 9061 B18R2.3984 Clc1ccccc1CCOCc2cccnn2 7a_100011215284_100016990269 [0,1,0,0,0,1|2,0,0]=4 9062 B18R2.3984 Clc1ccccc1CCOCc2ccncc2 7a_100011215284_100015193705 [0,1,0,0,0,1|1,0,0]=3 9063 B18R2.3984 Clc1ccccc1CCOCc2cnccn2 34a_100011215284_100016995436 [0,1,0,0,0,1|2,0,0]=4 9064 B18R2.3984 Clc1ccccc1CCOCc2cnccn2 7a_100011215284_100016995436 [0,1,0,0,0,1|2,0,0]=4 9065 B18R2.3984 Clc1ccccc1CCOCc2cncnc2 34a_100011215284_100015196519 [0,1,0,0,0,1|2,0,0]=4 9066 B18R2.3984 Clc1ccccc1CCOCc2cncnc2 7a_100011215284_100015196519 [0,1,0,0,0,1|2,0,0]=4 9067 B18R2.3984 Clc1ccccc1CCOCc2ncccn2 34a_100011215284_100000703007 [0,1,0,0,0,1|2,0,0]=4 9068 B18R2.3984 Clc1ccccc1CCOCc2ncccn2 7a_100011215284_100000703007 [0,1,0,0,0,1|2,0,0]=4 9069 B18R2.3984 Clc1ccccc1CCSCc2ccccc2 62a_100000211182_100011713703 [0,1,0,0,0,1|0,1,0]=3 9070 B18R2.3984 Clc1ccccc1CCSCc2ccccc2 62a_100011713703_100015291786 [0,1,0,0,0,1|0,1,0]=3 9071 B18R2.3984 Clc1ccccc1CCSCc2ccccn2 62a_100000721315_100011713703 [0,1,0,0,0,1|1,1,0]=4 9072 B18R2.3984 Clc1ccccc1CCSCc2ccccn2 62a_100011713703_100000721315 [0,1,0,0,0,1|1,1,0]=4 9073 B18R2.3984 Clc1ccccc1CCSCc2cccnc2 62a_100000741622_100011713703 [0,1,0,0,0,1|1,1,0]=4 9074 B18R2.3984 Clc1ccccc1CCSCc2cccnc2 62a_100011713703_100000741622 [0,1,0,0,0,1|1,1,0]=4 9075 B18R2.3984 Clc1ccccc1CCSCc2ccncc2 62a_100011713703_100015193705 [0,1,0,0,0,1|1,1,0]=4 9076 B18R2.3984 Clc1ccccc1CCSCc2ccncc2 62a_100015193705_100011713703 [0,1,0,0,0,1|1,1,0]=4 9077 B18R2.3984 Clc1ccccc1CNCCc2ccccc2 207a_100000106460_100000210073 [0,1,0,0,0,1|1,0,0]=3 9078 B18R2.3984 Clc1ccccc1CNCCc2ccccc2 2230a_100000106460_100000187162 [0,1,0,0,0,1|1,0,0]=3 9079 B18R2.3984 Clc1ccccc1CNCCc2ccccc2 2230a_100000174879_100000765856 [0,1,0,0,0,1|1,0,0]=3 9080 B18R2.3984 Clc1ccccc1CNCCc2ccccc2 270004a_100000106460_100000210073 [0,1,0,0,0,1|1,0,0]=3 9081 B18R2.3984 Clc1ccccc1CNCCc2ccccc2 34a_100000106460_100000187162 [0,1,0,0,0,1|1,0,0]=3 9082 B18R2.3984 Clc1ccccc1CNCCc2ccccc2 34a_100000174879_100000765856 [0,1,0,0,0,1|1,0,0]=3 9083 B18R2.3984 Clc1ccccc1CNCCc2ccccn2 207a_100000211156_100000210073 [0,1,0,0,0,1|2,0,0]=4 9084 B18R2.3984 Clc1ccccc1CNCCc2ccccn2 2230a_100000174879_100015183660 [0,1,0,0,0,1|2,0,0]=4 9085 B18R2.3984 Clc1ccccc1CNCCc2ccccn2 270004a_100000211156_100000210073 [0,1,0,0,0,1|2,0,0]=4 9086 B18R2.3984 Clc1ccccc1CNCCc2cccnc2 207a_100000736294_100000210073 [0,1,0,0,0,1|2,0,0]=4 9087 B18R2.3984 Clc1ccccc1CNCCc2cccnc2 2230a_100000174879_200011713674 [0,1,0,0,0,1|2,0,0]=4 9088 B18R2.3984 Clc1ccccc1CNCCc2cccnc2 2230a_100000736294_100000187162 [0,1,0,0,0,1|2,0,0]=4 9089 B18R2.3984 Clc1ccccc1CNCCc2cccnc2 270004a_100000736294_100000210073 [0,1,0,0,0,1|2,0,0]=4 9090 B18R2.3984 Clc1ccccc1CNCCc2ccncc2 207a_100000742849_100000210073 [0,1,0,0,0,1|2,0,0]=4 9091 B18R2.3984 Clc1ccccc1CNCCc2ccncc2 2230a_100000174879_100000723409 [0,1,0,0,0,1|2,0,0]=4 9092 B18R2.3984 Clc1ccccc1CNCCc2ccncc2 270004a_100000742849_100000210073 [0,1,0,0,0,1|2,0,0]=4 9093 B18R2.3984 Clc1ccccc1CNCSc2ccccc2 2230a_100000174879_100011218342 [0,1,0,0,0,1|1,0,0]=3 9094 B18R2.3984 Clc1ccccc1CNN=Cc2ccccc2 4a_100015187261_100015611070 [0,1,0,0,0,1|1,0,1]=4 9095 B18R2.3984 Clc1ccccc1COCCc2ccccc2 34a_100000210268_100000187162 [0,1,0,0,0,1|0,0,0]=2 9096 B18R2.3984 Clc1ccccc1COCCc2ccccc2 34a_100000210847_100000765856 [0,1,0,0,0,1|0,0,0]=2 9097 B18R2.3984 Clc1ccccc1COCCc2ccccc2 7a_100000210268_100000187162 [0,1,0,0,0,1|0,0,0]=2 9098 B18R2.3984 Clc1ccccc1COCCc2ccccc2 7a_100000210847_100000765856 [0,1,0,0,0,1|0,0,0]=2 9099 B18R2.3984 Clc1ccccc1COCCc2ccccn2 34a_100000210271_100000187162 [0,1,0,0,0,1|1,0,0]=3 9100 B18R2.3984 Clc1ccccc1COCCc2ccccn2 7a_100000210847_100015183660 [0,1,0,0,0,1|1,0,0]=3 9101 B18R2.3984 Clc1ccccc1COCCc2cccnc2 34a_100011217484_100000187162 [0,1,0,0,0,1|1,0,0]=3 9102 B18R2.3984 Clc1ccccc1COCCc2cccnc2 7a_100000210847_200011713674 [0,1,0,0,0,1|1,0,0]=3 9103 B18R2.3984 Clc1ccccc1COCCc2ccncc2 34a_100011216225_100000187162 [0,1,0,0,0,1|1,0,0]=3 9104 B18R2.3984 Clc1ccccc1COCCc2ccncc2 7a_100000210847_100000723409 [0,1,0,0,0,1|1,0,0]=3 9105 B18R2.3984 Clc1ccccc1COCCc2cnccn2 34a_100011349526_100000187162 [0,1,0,0,0,1|2,0,0]=4 9106 B18R2.3984 Clc1ccccc1COCCc2cncnc2 34a_100011709255_100000187162 [0,1,0,0,0,1|2,0,0]=4 9107 B18R2.3984 Clc1ccccc1CSCCc2ccccc2 62a_100000187162_100011218657 [0,1,0,0,0,1|0,1,0]=3 9108 B18R2.3984 Clc1ccccc1CSCCc2ccccc2 62a_100000765856_100000187162 [0,1,0,0,0,1|0,1,0]=3 9109 B18R2.3984 Clc1ccccc1CSCCc2ccccn2 62a_100000187162_100015183660 [0,1,0,0,0,1|1,1,0]=4 9110 B18R2.3984 Clc1ccccc1CSCCc2ccccn2 62a_100015183660_100000187162 [0,1,0,0,0,1|1,1,0]=4 9111 B18R2.3984 Clc1ccccc1CSCCc2cccnc2 62a_100000187162_200011713674 [0,1,0,0,0,1|1,1,0]=4 9112 B18R2.3984 Clc1ccccc1CSCCc2cccnc2 62a_200011713674_100000187162 [0,1,0,0,0,1|1,1,0]=4 9113 B18R2.3984 Clc1ccccc1CSCCc2ccncc2 62a_100000187162_100000723409 [0,1,0,0,0,1|1,1,0]=4 9114 B18R2.3984 Clc1ccccc1CSCCc2ccncc2 62a_100000723409_100000187162 [0,1,0,0,0,1|1,1,0]=4 9115 B18R2.3984 Clc1ccccc1CSCSc2ccccc2 62a_100000187162_100011218342 [0,1,0,0,0,1|0,1,0]=3 9116 B18R2.3984 Clc1ccccc1CSCSc2ccccc2 62a_100011218342_100000187162 [0,1,0,0,0,1|0,1,0]=3 9117 B18R2.3984 Clc1ccccc1NC/C=C/c2ccccc2 34a_100000185783_100016265936 [0,1,0,0,0,1|1,0,1]=4 9118 B18R2.3984 Clc1ccccc1NCC#Cc2ccccc2 34a_100000185783_100011352542 [0,1,0,0,0,1|1,0,1]=4 9119 B18R2.3984 Clc1ccccc1NCCCc2ccccc2 34a_100000185783_100000211621 [0,1,0,0,0,1|1,0,0]=3 9120 B18R2.3984 Clc1ccccc1NCCOc2ccccc2 34a_100000185783_100000184471 [0,1,0,0,0,1|2,0,0]=4 9121 B18R2.3984 Clc1ccccc1NCCSc2ccccc2 34a_100000185783_100000246102 [0,1,0,0,0,1|2,0,0]=4 9122 B18R2.3984 Clc1ccccc1NCOCc2ccccc2 34a_100000185783_100000763385 [0,1,0,0,0,1|0,0,0]=2 9123 B18R2.3984 Clc1ccccc1NCSCc2ccccc2 34a_100000185783_200011217039 [0,1,0,0,0,1|0,1,0]=3 9124 B18R2.3984 Clc1ccccc1NN=CCc2ccccc2 4a_100000683529_100000209964 [0,1,0,0,0,1|2,0,0]=4 9125 B18R2.3984 Clc1ccccc1OC/C=C/c2ccccc2 34a_100000210172_100016265936 [0,1,0,0,0,1|1,0,1]=4 9126 B18R2.3984 Clc1ccccc1OC/C=C/c2ccccc2 7a_100000210172_100016265936 [0,1,0,0,0,1|1,0,1]=4 9127 B18R2.3984 Clc1ccccc1OCC#Cc2ccccc2 34a_100000210172_100011352542 [0,1,0,0,0,1|1,0,1]=4 9128 B18R2.3984 Clc1ccccc1OCC#Cc2ccccc2 7a_100000210172_100011352542 [0,1,0,0,0,1|1,0,1]=4 9129 B18R2.3984 Clc1ccccc1OCCCc2ccccc2 34a_100000210172_100000211621 [0,1,0,0,0,1|1,0,0]=3 9130 B18R2.3984 Clc1ccccc1OCCCc2ccccc2 7a_100000210172_100000211621 [0,1,0,0,0,1|1,0,0]=3 9131 B18R2.3984 Clc1ccccc1OCCOc2ccccc2 34a_100000210172_100000184471 [0,1,0,0,0,1|2,0,0]=4 9132 B18R2.3984 Clc1ccccc1OCCOc2ccccc2 7a_100000210172_100000184471 [0,1,0,0,0,1|2,0,0]=4 9133 B18R2.3984 Clc1ccccc1OCCSc2ccccc2 34a_100000210172_100000246102 [0,1,0,0,0,1|2,0,0]=4 9134 B18R2.3984 Clc1ccccc1OCCSc2ccccc2 7a_100000210172_100000246102 [0,1,0,0,0,1|2,0,0]=4 9135 B18R2.3984 Clc1ccccc1OCOCc2ccccc2 34a_100000210172_100000763385 [0,1,0,0,0,1|0,0,0]=2 9136 B18R2.3984 Clc1ccccc1OCSCc2ccccc2 34a_100000210172_200011217039 [0,1,0,0,0,1|0,1,0]=3 9137 B18R2.3984 Clc1ccccc1SC/C=C/c2ccccc2 62a_100000764095_100016265936 [0,1,0,0,0,1|1,0,1]=4 9138 B18R2.3984 Clc1ccccc1SC/C=C/c2ccccc2 62a_100016265936_100000764095 [0,1,0,0,0,1|1,0,1]=4 9139 B18R2.3984 Clc1ccccc1SCC#Cc2ccccc2 62a_100000764095_100011352542 [0,1,0,0,0,1|1,0,1]=4 9140 B18R2.3984 Clc1ccccc1SCCCc2ccccc2 62a_100000211621_100000764095 [0,1,0,0,0,1|1,0,0]=3 9141 B18R2.3984 Clc1ccccc1SCCCc2ccccc2 62a_100000764095_100000211621 [0,1,0,0,0,1|1,0,0]=3 9142 B18R2.3984 Clc1ccccc1SCCOc2ccccc2 62a_100000184471_100000764095 [0,1,0,0,0,1|2,0,0]=4 9143 B18R2.3984 Clc1ccccc1SCCOc2ccccc2 62a_100000764095_100000184471 [0,1,0,0,0,1|2,0,0]=4 9144 B18R2.3984 Clc1ccccc1SCCSc2ccccc2 62a_100000246102_100000764095 [0,1,0,0,0,1|2,0,0]=4 9145 B18R2.3984 Clc1ccccc1SCCSc2ccccc2 62a_100000764095_100000246102 [0,1,0,0,0,1|2,0,0]=4 9146 B18R2.3984 Clc1ccccc1SCOCc2ccccc2 62a_100000763385_100000764095 [0,1,0,0,0,1|0,0,0]=2 9147 B18R2.3984 Clc1ccccc1SCOCc2ccccc2 62a_100000764095_100000763385 [0,1,0,0,0,1|0,0,0]=2 9148 B18R2.3984 Clc1ccccc1SCSCc2ccccc2 62a_100000764095_200011217039 [0,1,0,0,0,1|0,1,0]=3 9149 B18R2.3984 Clc1ccccc1SCSCc2ccccc2 62a_200011217039_100000764095 [0,1,0,0,0,1|0,1,0]=3 9150 B18R2.3984 Clc1cccnc1CNCCc2ccccc2 207a_100000106460_100012001307 [0,1,0,0,0,1|2,0,0]=4 9151 B18R2.3984 Clc1cccnc1CNCCc2ccccc2 2230a_100000106460_100000099807 [0,1,0,0,0,1|2,0,0]=4 9152 B18R2.3984 Clc1cccnc1CNCCc2ccccc2 2230a_100015189233_100000765856 [0,1,0,0,0,1|2,0,0]=4 9153 B18R2.3984 Clc1cccnc1CNCCc2ccccc2 270004a_100000106460_100012001307 [0,1,0,0,0,1|2,0,0]=4 9154 B18R2.3984 Clc1cccnc1CNCSc2ccccc2 2230a_100015189233_100011218342 [0,1,0,0,0,1|2,0,0]=4 9155 B18R2.3984 Clc1cccnc1COCCc2ccccc2 34a_100012002383_100000765856 [0,1,0,0,0,1|1,0,0]=3 9156 B18R2.3984 Clc1cccnc1COCCc2ccccc2 7a_100000210268_100000099807 [0,1,0,0,0,1|1,0,0]=3 9157 B18R2.3984 Clc1cccnc1CSCCc2ccccc2 62a_100000099807_100011218657 [0,1,0,0,0,1|1,1,0]=4 9158 B18R2.3984 Clc1cccnc1CSCCc2ccccc2 62a_100000765856_100000099807 [0,1,0,0,0,1|1,1,0]=4 9159 B18R2.3984 Clc1cccnc1CSCSc2ccccc2 62a_100000099807_100011218342 [0,1,0,0,0,1|1,1,0]=4 9160 B18R2.3984 Clc1cccnc1CSCSc2ccccc2 62a_100011218342_100000099807 [0,1,0,0,0,1|1,1,0]=4 9161 B18R2.3984 Clc1cccnc1OCCCc2ccccc2 34a_100011290957_100000211621 [0,1,0,0,0,1|2,0,0]=4 9162 B18R2.3984 Clc1cccnc1OCOCc2ccccc2 34a_100011290957_100000763385 [0,1,0,0,0,1|1,0,0]=3 9163 B18R2.3984 Clc1cccnc1OCSCc2ccccc2 34a_100011290957_200011217039 [0,1,0,0,0,1|1,1,0]=4 9164 B18R2.3984 Clc1cccnc1SCCCc2ccccc2 62a_100000211621_100011356963 [0,1,0,0,0,1|2,0,0]=4 9165 B18R2.3984 Clc1cccnc1SCCCc2ccccc2 62a_100011356963_100000211621 [0,1,0,0,0,1|2,0,0]=4 9166 B18R2.3984 Clc1cccnc1SCOCc2ccccc2 62a_100000763385_100011356963 [0,1,0,0,0,1|1,0,0]=3 9167 B18R2.3984 Clc1cccnc1SCOCc2ccccc2 62a_100011356963_100000763385 [0,1,0,0,0,1|1,0,0]=3 9168 B18R2.3984 Clc1cccnc1SCSCc2ccccc2 62a_100011356963_200011217039 [0,1,0,0,0,1|1,1,0]=4 9169 B18R2.3984 Clc1cccnc1SCSCc2ccccc2 62a_200011217039_100011356963 [0,1,0,0,0,1|1,1,0]=4 9170 B18R2.3984 Clc1ccncc1CNCCc2ccccc2 270004a_100000106460_100000050567 [0,1,0,0,0,1|2,0,0]=4 9171 B18R2.3984 Clc1ccncc1COCCc2ccccc2 34a_100000117392_100000765856 [0,1,0,0,0,1|1,0,0]=3 9172 B18R2.3984 Clc1ccncc1OCCCc2ccccc2 34a_100011996695_100000211621 [0,1,0,0,0,1|2,0,0]=4 9173 B18R2.3984 Clc1ccncc1OCOCc2ccccc2 34a_100011996695_100000763385 [0,1,0,0,0,1|1,0,0]=3 9174 B18R2.3984 Clc1ccncc1OCSCc2ccccc2 34a_100011996695_200011217039 [0,1,0,0,0,1|1,1,0]=4 9175 B18R2.3984 Clc1ccncc1SCCCc2ccccc2 62a_100000211621_100009995489 [0,1,0,0,0,1|2,0,0]=4 9176 B18R2.3984 Clc1ccncc1SCCCc2ccccc2 62a_100009995489_100000211621 [0,1,0,0,0,1|2,0,0]=4 9177 B18R2.3984 Clc1ccncc1SCOCc2ccccc2 62a_100000763385_100009995489 [0,1,0,0,0,1|1,0,0]=3 9178 B18R2.3984 Clc1ccncc1SCOCc2ccccc2 62a_100009995489_100000763385 [0,1,0,0,0,1|1,0,0]=3 9179 B18R2.3984 Clc1ccncc1SCSCc2ccccc2 62a_100009995489_200011217039 [0,1,0,0,0,1|1,1,0]=4 9180 B18R2.3984 Clc1ccncc1SCSCc2ccccc2 62a_200011217039_100009995489 [0,1,0,0,0,1|1,1,0]=4 9181 B18R2.3984 Clc1cnccc1CNCCc2ccccc2 207a_100000106460_100011934409 [0,1,0,0,0,1|2,0,0]=4 9182 B18R2.3984 Clc1cnccc1CNCCc2ccccc2 2230a_100000106460_100000763264 [0,1,0,0,0,1|2,0,0]=4 9183 B18R2.3984 Clc1cnccc1CNCCc2ccccc2 270004a_100000106460_100011934409 [0,1,0,0,0,1|2,0,0]=4 9184 B18R2.3984 Clc1cnccc1COCCc2ccccc2 7a_100000210268_100000763264 [0,1,0,0,0,1|1,0,0]=3 9185 B18R2.3984 Clc1cnccc1CSCCc2ccccc2 62a_100000763264_100011218657 [0,1,0,0,0,1|1,1,0]=4 9186 B18R2.3984 Clc1cnccc1CSCCc2ccccc2 62a_100000765856_100000763264 [0,1,0,0,0,1|1,1,0]=4 9187 B18R2.3984 Clc1cnccc1CSCSc2ccccc2 62a_100000763264_100011218342 [0,1,0,0,0,1|1,1,0]=4 9188 B18R2.3984 Clc1cnccc1CSCSc2ccccc2 62a_100011218342_100000763264 [0,1,0,0,0,1|1,1,0]=4 9189 B18R2.3984 Clc1cnccc1OCCCc2ccccc2 34a_100011997054_100000211621 [0,1,0,0,0,1|2,0,0]=4 9190 B18R2.3984 Clc1cnccc1OCOCc2ccccc2 34a_100011997054_100000763385 [0,1,0,0,0,1|1,0,0]=3 9191 B18R2.3984 Clc1cnccc1OCSCc2ccccc2 34a_100011997054_200011217039 [0,1,0,0,0,1|1,1,0]=4 9192 B18R2.3984 Clc1cnccc1SCCCc2ccccc2 62a_100000211621_100000708259 [0,1,0,0,0,1|2,0,0]=4 9193 B18R2.3984 Clc1cnccc1SCCCc2ccccc2 62a_100000708259_100000211621 [0,1,0,0,0,1|2,0,0]=4 9194 B18R2.3984 Clc1cnccc1SCOCc2ccccc2 62a_100000708259_100000763385 [0,1,0,0,0,1|1,0,0]=3 9195 B18R2.3984 Clc1cnccc1SCOCc2ccccc2 62a_100000763385_100000708259 [0,1,0,0,0,1|1,0,0]=3 9196 B18R2.3984 Clc1cnccc1SCSCc2ccccc2 62a_100000708259_200011217039 [0,1,0,0,0,1|1,1,0]=4 9197 B18R2.3984 Clc1cnccc1SCSCc2ccccc2 62a_200011217039_100000708259 [0,1,0,0,0,1|1,1,0]=4 9198 B18R2.3984 Clc1ncccc1CNCCc2ccccc2 2230a_100000106460_100000045678 [0,1,0,0,0,1|2,0,0]=4 9199 B18R2.3984 Clc1ncccc1CNCCc2ccccc2 2230a_100015189234_100000765856 [0,1,0,0,0,1|2,0,0]=4 9200 B18R2.3984 Clc1ncccc1CNCCc2ccccc2 34a_100000106460_100000045678 [0,1,0,0,0,1|2,0,0]=4 9201 B18R2.3984 Clc1ncccc1CNCCc2ccccc2 34a_100015189234_100000765856 [0,1,0,0,0,1|2,0,0]=4 9202 B18R2.3984 Clc1ncccc1CNCSc2ccccc2 2230a_100015189234_100011218342 [0,1,0,0,0,1|2,0,0]=4 9203 B18R2.3984 Clc1ncccc1COCCc2ccccc2 34a_100000210268_100000045678 [0,1,0,0,0,1|1,0,0]=3 9204 B18R2.3984 Clc1ncccc1COCCc2ccccc2 34a_100000748726_100000765856 [0,1,0,0,0,1|1,0,0]=3 9205 B18R2.3984 Clc1ncccc1COCCc2ccccc2 7a_100000210268_100000045678 [0,1,0,0,0,1|1,0,0]=3 9206 B18R2.3984 Clc1ncccc1COCCc2ccccc2 7a_100000748726_100000765856 [0,1,0,0,0,1|1,0,0]=3 9207 B18R2.3984 Clc1ncccc1COCCc2ccccn2 34a_100000210271_100000045678 [0,1,0,0,0,1|2,0,0]=4 9208 B18R2.3984 Clc1ncccc1COCCc2ccccn2 7a_100000748726_100015183660 [0,1,0,0,0,1|2,0,0]=4 9209 B18R2.3984 Clc1ncccc1COCCc2cccnc2 34a_100011217484_100000045678 [0,1,0,0,0,1|2,0,0]=4 9210 B18R2.3984 Clc1ncccc1COCCc2cccnc2 7a_100000748726_200011713674 [0,1,0,0,0,1|2,0,0]=4 9211 B18R2.3984 Clc1ncccc1COCCc2ccncc2 34a_100011216225_100000045678 [0,1,0,0,0,1|2,0,0]=4 9212 B18R2.3984 Clc1ncccc1COCCc2ccncc2 7a_100000748726_100000723409 [0,1,0,0,0,1|2,0,0]=4 9213 B18R2.3984 Clc1ncccc1CSCCc2ccccc2 62a_100000045678_100011218657 [0,1,0,0,0,1|1,1,0]=4 9214 B18R2.3984 Clc1ncccc1CSCCc2ccccc2 62a_100000765856_100000045678 [0,1,0,0,0,1|1,1,0]=4 9215 B18R2.3984 Clc1ncccc1CSCSc2ccccc2 62a_100000045678_100011218342 [0,1,0,0,0,1|1,1,0]=4 9216 B18R2.3984 Clc1ncccc1CSCSc2ccccc2 62a_100011218342_100000045678 [0,1,0,0,0,1|1,1,0]=4 9217 B18R2.3984 Clc1ncccc1OCCCc2ccccc2 34a_100000757616_100000211621 [0,1,0,0,0,1|2,0,0]=4 9218 B18R2.3984 Clc1ncccc1OCCCc2ccccc2 7a_100000757616_100000211621 [0,1,0,0,0,1|2,0,0]=4 9219 B18R2.3984 Clc1ncccc1OCOCc2ccccc2 34a_100000757616_100000763385 [0,1,0,0,0,1|1,0,0]=3 9220 B18R2.3984 Clc1ncccc1OCSCc2ccccc2 34a_100000757616_200011217039 [0,1,0,0,0,1|1,1,0]=4 9221 B18R2.3984 Clc1ncccc1SCCCc2ccccc2 62a_100000036424_100000211621 [0,1,0,0,0,1|2,0,0]=4 9222 B18R2.3984 Clc1ncccc1SCCCc2ccccc2 62a_100000211621_100000036424 [0,1,0,0,0,1|2,0,0]=4 9223 B18R2.3984 Clc1ncccc1SCOCc2ccccc2 62a_100000036424_100000763385 [0,1,0,0,0,1|1,0,0]=3 9224 B18R2.3984 Clc1ncccc1SCOCc2ccccc2 62a_100000763385_100000036424 [0,1,0,0,0,1|1,0,0]=3 9225 B18R2.3984 Clc1ncccc1SCSCc2ccccc2 62a_100000036424_200011217039 [0,1,0,0,0,1|1,1,0]=4 9226 B18R2.3984 Clc1ncccc1SCSCc2ccccc2 62a_200011217039_100000036424 [0,1,0,0,0,1|1,1,0]=4 9227 B18R2.3984 Clc1nccnc1COCCc2ccccc2 34a_100000057004_100000765856 [0,1,0,0,0,1|2,0,0]=4 9228 B18R2.3984 Clc1nccnc1SCOCc2ccccc2 62a_100000763385_100010886584 [0,1,0,0,0,1|2,0,0]=4 9229 B18R2.3984 Clc1nccnc1SCOCc2ccccc2 62a_100010886584_100000763385 [0,1,0,0,0,1|2,0,0]=4 9230 B18R2.3984 Clc1ncncc1SCOCc2ccccc2 62a_100000758962_100000763385 [0,1,0,0,0,1|2,0,0]=4 9231 B18R2.3984 Clc1ncncc1SCOCc2ccccc2 62a_100000763385_100000758962 [0,1,0,0,0,1|2,0,0]=4 9232 B18R2.3984 Fc1ccccc1C#CCNc2ccccc2 34a_100000106764_100010404167 [0,1,0,0,0,1|1,0,1]=4 9233 B18R2.3984 Fc1ccccc1C#CCOc2ccccc2 34a_100000210340_100010404167 [0,1,0,0,0,1|1,0,1]=4 9234 B18R2.3984 Fc1ccccc1C#CCOc2ccccc2 7a_100000210340_100010404167 [0,1,0,0,0,1|1,0,1]=4 9235 B18R2.3984 Fc1ccccc1C#CCSc2ccccc2 62a_100000719477_100010404167 [0,1,0,0,0,1|1,0,1]=4 9236 B18R2.3984 Fc1ccccc1C#CCSc2ccccc2 62a_100010404167_100000041952 [0,1,0,0,0,1|1,0,1]=4 9237 B18R2.3984 Fc1ccccc1C=NNCc2ccccc2 4a_100000007032_100000210811 [0,1,0,0,0,1|1,0,1]=4 9238 B18R2.3984 Fc1ccccc1CC=NNc2ccccc2 4a_100015195140_200000687578 [0,1,0,0,0,1|2,0,0]=4 9239 B18R2.3984 Fc1ccccc1CCNCc2ccccc2 207a_100000185272_100015611070 [0,1,0,0,0,1|1,0,0]=3 9240 B18R2.3984 Fc1ccccc1CCNCc2ccccc2 2230a_100000185272_100015291786 [0,1,0,0,0,1|1,0,0]=3 9241 B18R2.3984 Fc1ccccc1CCNCc2ccccc2 2230a_100015324214_100011713696 [0,1,0,0,0,1|1,0,0]=3 9242 B18R2.3984 Fc1ccccc1CCNCc2ccccc2 270004a_100000185272_100015611070 [0,1,0,0,0,1|1,0,0]=3 9243 B18R2.3984 Fc1ccccc1CCNCc2ccccc2 34a_100000185272_100015291786 [0,1,0,0,0,1|1,0,0]=3 9244 B18R2.3984 Fc1ccccc1CCNCc2ccccc2 34a_100015324214_100000720011 [0,1,0,0,0,1|1,0,0]=3 9245 B18R2.3984 Fc1ccccc1CCNCc2ccccn2 207a_100000185272_100000209966 [0,1,0,0,0,1|2,0,0]=4 9246 B18R2.3984 Fc1ccccc1CCNCc2ccccn2 2230a_100000185272_100000721315 [0,1,0,0,0,1|2,0,0]=4 9247 B18R2.3984 Fc1ccccc1CCNCc2ccccn2 270004a_100000185272_100000209966 [0,1,0,0,0,1|2,0,0]=4 9248 B18R2.3984 Fc1ccccc1CCNCc2ccccn2 34a_100000185272_100000721315 [0,1,0,0,0,1|2,0,0]=4 9249 B18R2.3984 Fc1ccccc1CCNCc2cccnc2 207a_100000185272_100000209961 [0,1,0,0,0,1|2,0,0]=4 9250 B18R2.3984 Fc1ccccc1CCNCc2cccnc2 2230a_100000185272_100000741622 [0,1,0,0,0,1|2,0,0]=4 9251 B18R2.3984 Fc1ccccc1CCNCc2cccnc2 270004a_100000185272_100000209961 [0,1,0,0,0,1|2,0,0]=4 9252 B18R2.3984 Fc1ccccc1CCNCc2cccnc2 34a_100000185272_100000733263 [0,1,0,0,0,1|2,0,0]=4 9253 B18R2.3984 Fc1ccccc1CCNCc2ccncc2 207a_100000185272_100000186114 [0,1,0,0,0,1|2,0,0]=4 9254 B18R2.3984 Fc1ccccc1CCNCc2ccncc2 2230a_100000185272_100015193705 [0,1,0,0,0,1|2,0,0]=4 9255 B18R2.3984 Fc1ccccc1CCOCc2ccccc2 34a_100000210790_100000720011 [0,1,0,0,0,1|0,0,0]=2 9256 B18R2.3984 Fc1ccccc1CCOCc2ccccc2 34a_100000753711_100015291786 [0,1,0,0,0,1|0,0,0]=2 9257 B18R2.3984 Fc1ccccc1CCOCc2ccccc2 7a_100000210790_100000720011 [0,1,0,0,0,1|0,0,0]=2 9258 B18R2.3984 Fc1ccccc1CCOCc2ccccc2 7a_100000753711_100000211182 [0,1,0,0,0,1|0,0,0]=2 9259 B18R2.3984 Fc1ccccc1CCOCc2ccccn2 34a_100000753711_100000721315 [0,1,0,0,0,1|1,0,0]=3 9260 B18R2.3984 Fc1ccccc1CCOCc2ccccn2 7a_100000753711_100000721315 [0,1,0,0,0,1|1,0,0]=3 9261 B18R2.3984 Fc1ccccc1CCOCc2cccnc2 34a_100000753711_100000733263 [0,1,0,0,0,1|1,0,0]=3 9262 B18R2.3984 Fc1ccccc1CCOCc2cccnc2 7a_100000753711_100000741622 [0,1,0,0,0,1|1,0,0]=3 9263 B18R2.3984 Fc1ccccc1CCOCc2cccnn2 34a_100000753711_100016990269 [0,1,0,0,0,1|2,0,0]=4 9264 B18R2.3984 Fc1ccccc1CCOCc2cccnn2 7a_100000753711_100016990269 [0,1,0,0,0,1|2,0,0]=4 9265 B18R2.3984 Fc1ccccc1CCOCc2ccncc2 7a_100000753711_100015193705 [0,1,0,0,0,1|1,0,0]=3 9266 B18R2.3984 Fc1ccccc1CCOCc2cnccn2 34a_100000753711_100016995436 [0,1,0,0,0,1|2,0,0]=4 9267 B18R2.3984 Fc1ccccc1CCOCc2cnccn2 7a_100000753711_100016995436 [0,1,0,0,0,1|2,0,0]=4 9268 B18R2.3984 Fc1ccccc1CCOCc2cncnc2 34a_100000753711_100015196519 [0,1,0,0,0,1|2,0,0]=4 9269 B18R2.3984 Fc1ccccc1CCOCc2cncnc2 7a_100000753711_100015196519 [0,1,0,0,0,1|2,0,0]=4 9270 B18R2.3984 Fc1ccccc1CCOCc2ncccn2 34a_100000753711_100000703007 [0,1,0,0,0,1|2,0,0]=4 9271 B18R2.3984 Fc1ccccc1CCOCc2ncccn2 7a_100000753711_100000703007 [0,1,0,0,0,1|2,0,0]=4 9272 B18R2.3984 Fc1ccccc1CCSCc2ccccc2 62a_100000211182_100011713696 [0,1,0,0,0,1|0,1,0]=3 9273 B18R2.3984 Fc1ccccc1CCSCc2ccccc2 62a_100011713696_100015291786 [0,1,0,0,0,1|0,1,0]=3 9274 B18R2.3984 Fc1ccccc1CCSCc2ccccn2 62a_100000721315_100011713696 [0,1,0,0,0,1|1,1,0]=4 9275 B18R2.3984 Fc1ccccc1CCSCc2ccccn2 62a_100011713696_100000721315 [0,1,0,0,0,1|1,1,0]=4 9276 B18R2.3984 Fc1ccccc1CCSCc2cccnc2 62a_100000741622_100011713696 [0,1,0,0,0,1|1,1,0]=4 9277 B18R2.3984 Fc1ccccc1CCSCc2cccnc2 62a_100011713696_100000741622 [0,1,0,0,0,1|1,1,0]=4 9278 B18R2.3984 Fc1ccccc1CCSCc2ccncc2 62a_100011713696_100015193705 [0,1,0,0,0,1|1,1,0]=4 9279 B18R2.3984 Fc1ccccc1CCSCc2ccncc2 62a_100015193705_100011713696 [0,1,0,0,0,1|1,1,0]=4 9280 B18R2.3984 Fc1ccccc1CNCCc2ccccc2 207a_100000106460_100000210811 [0,1,0,0,0,1|1,0,0]=3 9281 B18R2.3984 Fc1ccccc1CNCCc2ccccc2 2230a_100000106460_100000211605 [0,1,0,0,0,1|1,0,0]=3 9282 B18R2.3984 Fc1ccccc1CNCCc2ccccc2 270004a_100000106460_100000210811 [0,1,0,0,0,1|1,0,0]=3 9283 B18R2.3984 Fc1ccccc1CNCCc2ccccc2 34a_100000106460_100000211605 [0,1,0,0,0,1|1,0,0]=3 9284 B18R2.3984 Fc1ccccc1CNCCc2ccccc2 34a_100000174869_100000765856 [0,1,0,0,0,1|1,0,0]=3 9285 B18R2.3984 Fc1ccccc1CNCCc2ccccn2 207a_100000211156_100000210811 [0,1,0,0,0,1|2,0,0]=4 9286 B18R2.3984 Fc1ccccc1CNCCc2ccccn2 270004a_100000211156_100000210811 [0,1,0,0,0,1|2,0,0]=4 9287 B18R2.3984 Fc1ccccc1CNCCc2cccnc2 207a_100000736294_100000210811 [0,1,0,0,0,1|2,0,0]=4 9288 B18R2.3984 Fc1ccccc1CNCCc2cccnc2 2230a_100000736294_100000211605 [0,1,0,0,0,1|2,0,0]=4 9289 B18R2.3984 Fc1ccccc1CNCCc2cccnc2 270004a_100000736294_100000210811 [0,1,0,0,0,1|2,0,0]=4 9290 B18R2.3984 Fc1ccccc1CNCCc2ccncc2 207a_100000742849_100000210811 [0,1,0,0,0,1|2,0,0]=4 9291 B18R2.3984 Fc1ccccc1CNCCc2ccncc2 270004a_100000742849_100000210811 [0,1,0,0,0,1|2,0,0]=4 9292 B18R2.3984 Fc1ccccc1CNN=Cc2ccccc2 4a_100015200773_100015611070 [0,1,0,0,0,1|1,0,1]=4 9293 B18R2.3984 Fc1ccccc1COCCc2ccccc2 34a_100000210268_100000211605 [0,1,0,0,0,1|0,0,0]=2 9294 B18R2.3984 Fc1ccccc1COCCc2ccccc2 34a_100000211962_100000765856 [0,1,0,0,0,1|0,0,0]=2 9295 B18R2.3984 Fc1ccccc1COCCc2ccccc2 7a_100000210268_100000211605 [0,1,0,0,0,1|0,0,0]=2 9296 B18R2.3984 Fc1ccccc1COCCc2ccccc2 7a_100000211962_100000765856 [0,1,0,0,0,1|0,0,0]=2 9297 B18R2.3984 Fc1ccccc1COCCc2ccccn2 34a_100000210271_100000211605 [0,1,0,0,0,1|1,0,0]=3 9298 B18R2.3984 Fc1ccccc1COCCc2ccccn2 7a_100000211962_100015183660 [0,1,0,0,0,1|1,0,0]=3 9299 B18R2.3984 Fc1ccccc1COCCc2cccnc2 34a_100011217484_100000211605 [0,1,0,0,0,1|1,0,0]=3 9300 B18R2.3984 Fc1ccccc1COCCc2cccnc2 7a_100000211962_200011713674 [0,1,0,0,0,1|1,0,0]=3 9301 B18R2.3984 Fc1ccccc1COCCc2ccncc2 34a_100011216225_100000211605 [0,1,0,0,0,1|1,0,0]=3 9302 B18R2.3984 Fc1ccccc1COCCc2ccncc2 7a_100000211962_100000723409 [0,1,0,0,0,1|1,0,0]=3 9303 B18R2.3984 Fc1ccccc1COCCc2cnccn2 34a_100011349526_100000211605 [0,1,0,0,0,1|2,0,0]=4 9304 B18R2.3984 Fc1ccccc1COCCc2cncnc2 34a_100011709255_100000211605 [0,1,0,0,0,1|2,0,0]=4 9305 B18R2.3984 Fc1ccccc1CSCCc2ccccc2 62a_100000211605_100011218657 [0,1,0,0,0,1|0,1,0]=3 9306 B18R2.3984 Fc1ccccc1CSCCc2ccccc2 62a_100000765856_100000211605 [0,1,0,0,0,1|0,1,0]=3 9307 B18R2.3984 Fc1ccccc1CSCCc2ccccn2 62a_100000211605_100015183660 [0,1,0,0,0,1|1,1,0]=4 9308 B18R2.3984 Fc1ccccc1CSCCc2ccccn2 62a_100015183660_100000211605 [0,1,0,0,0,1|1,1,0]=4 9309 B18R2.3984 Fc1ccccc1CSCCc2cccnc2 62a_100000211605_200011713674 [0,1,0,0,0,1|1,1,0]=4 9310 B18R2.3984 Fc1ccccc1CSCCc2cccnc2 62a_200011713674_100000211605 [0,1,0,0,0,1|1,1,0]=4 9311 B18R2.3984 Fc1ccccc1CSCCc2ccncc2 62a_100000211605_100000723409 [0,1,0,0,0,1|1,1,0]=4 9312 B18R2.3984 Fc1ccccc1CSCCc2ccncc2 62a_100000723409_100000211605 [0,1,0,0,0,1|1,1,0]=4 9313 B18R2.3984 Fc1ccccc1CSCSc2ccccc2 62a_100000211605_100011218342 [0,1,0,0,0,1|0,1,0]=3 9314 B18R2.3984 Fc1ccccc1CSCSc2ccccc2 62a_100011218342_100000211605 [0,1,0,0,0,1|0,1,0]=3 9315 B18R2.3984 Fc1ccccc1NC/C=C/c2ccccc2 34a_100000210422_100016265936 [0,1,0,0,0,1|1,0,1]=4 9316 B18R2.3984 Fc1ccccc1NCC#Cc2ccccc2 34a_100000210422_100011352542 [0,1,0,0,0,1|1,0,1]=4 9317 B18R2.3984 Fc1ccccc1NCCCc2ccccc2 34a_100000210422_100000211621 [0,1,0,0,0,1|1,0,0]=3 9318 B18R2.3984 Fc1ccccc1NCCOc2ccccc2 34a_100000210422_100000184471 [0,1,0,0,0,1|2,0,0]=4 9319 B18R2.3984 Fc1ccccc1NCCSc2ccccc2 34a_100000210422_100000246102 [0,1,0,0,0,1|2,0,0]=4 9320 B18R2.3984 Fc1ccccc1NCOCc2ccccc2 34a_100000210422_100000763385 [0,1,0,0,0,1|0,0,0]=2 9321 B18R2.3984 Fc1ccccc1NCSCc2ccccc2 34a_100000210422_200011217039 [0,1,0,0,0,1|0,1,0]=3 9322 B18R2.3984 Fc1ccccc1NN=CCc2ccccc2 4a_100000239246_100000209964 [0,1,0,0,0,1|2,0,0]=4 9323 B18R2.3984 Fc1ccccc1OC/C=C/c2ccccc2 34a_100000210171_100016265936 [0,1,0,0,0,1|1,0,1]=4 9324 B18R2.3984 Fc1ccccc1OC/C=C/c2ccccc2 7a_100000210171_100016265936 [0,1,0,0,0,1|1,0,1]=4 9325 B18R2.3984 Fc1ccccc1OCC#Cc2ccccc2 34a_100000210171_100011352542 [0,1,0,0,0,1|1,0,1]=4 9326 B18R2.3984 Fc1ccccc1OCC#Cc2ccccc2 7a_100000210171_100011352542 [0,1,0,0,0,1|1,0,1]=4 9327 B18R2.3984 Fc1ccccc1OCCCc2ccccc2 34a_100000210171_100000211621 [0,1,0,0,0,1|1,0,0]=3 9328 B18R2.3984 Fc1ccccc1OCCCc2ccccc2 7a_100000210171_100000211621 [0,1,0,0,0,1|1,0,0]=3 9329 B18R2.3984 Fc1ccccc1OCCNc2ccccc2 34a_100000106764_100000183290 [0,1,0,0,0,1|2,0,0]=4 9330 B18R2.3984 Fc1ccccc1OCCOc2ccccc2 34a_100000210171_100000184471 [0,1,0,0,0,1|2,0,0]=4 9331 B18R2.3984 Fc1ccccc1OCCOc2ccccc2 34a_100000210340_100000183290 [0,1,0,0,0,1|2,0,0]=4 9332 B18R2.3984 Fc1ccccc1OCCOc2ccccc2 7a_100000210171_100000184471 [0,1,0,0,0,1|2,0,0]=4 9333 B18R2.3984 Fc1ccccc1OCCOc2ccccc2 7a_100000210340_100000183290 [0,1,0,0,0,1|2,0,0]=4 9334 B18R2.3984 Fc1ccccc1OCCSc2ccccc2 34a_100000210171_100000246102 [0,1,0,0,0,1|2,0,0]=4 9335 B18R2.3984 Fc1ccccc1OCCSc2ccccc2 62a_100000183290_100000041952 [0,1,0,0,0,1|2,0,0]=4 9336 B18R2.3984 Fc1ccccc1OCCSc2ccccc2 62a_100000719477_100000183290 [0,1,0,0,0,1|2,0,0]=4 9337 B18R2.3984 Fc1ccccc1OCCSc2ccccc2 7a_100000210171_100000246102 [0,1,0,0,0,1|2,0,0]=4 9338 B18R2.3984 Fc1ccccc1OCOCc2ccccc2 34a_100000210171_100000763385 [0,1,0,0,0,1|0,0,0]=2 9339 B18R2.3984 Fc1ccccc1OCSCc2ccccc2 34a_100000210171_200011217039 [0,1,0,0,0,1|0,1,0]=3 9340 B18R2.3984 Fc1ccccc1SC/C=C/c2ccccc2 62a_100011215700_100016265936 [0,1,0,0,0,1|1,0,1]=4 9341 B18R2.3984 Fc1ccccc1SC/C=C/c2ccccc2 62a_100016265936_100011215700 [0,1,0,0,0,1|1,0,1]=4 9342 B18R2.3984 Fc1ccccc1SCC#Cc2ccccc2 62a_100011215700_100011352542 [0,1,0,0,0,1|1,0,1]=4 9343 B18R2.3984 Fc1ccccc1SCCCc2ccccc2 62a_100000211621_100011215700 [0,1,0,0,0,1|1,0,0]=3 9344 B18R2.3984 Fc1ccccc1SCCCc2ccccc2 62a_100011215700_100000211621 [0,1,0,0,0,1|1,0,0]=3 9345 B18R2.3984 Fc1ccccc1SCCOc2ccccc2 62a_100000184471_100011215700 [0,1,0,0,0,1|2,0,0]=4 9346 B18R2.3984 Fc1ccccc1SCCOc2ccccc2 62a_100011215700_100000184471 [0,1,0,0,0,1|2,0,0]=4 9347 B18R2.3984 Fc1ccccc1SCCSc2ccccc2 62a_100000246102_100011215700 [0,1,0,0,0,1|2,0,0]=4 9348 B18R2.3984 Fc1ccccc1SCCSc2ccccc2 62a_100011215700_100000246102 [0,1,0,0,0,1|2,0,0]=4 9349 B18R2.3984 Fc1ccccc1SCOCc2ccccc2 62a_100000763385_100011215700 [0,1,0,0,0,1|0,0,0]=2 9350 B18R2.3984 Fc1ccccc1SCOCc2ccccc2 62a_100011215700_100000763385 [0,1,0,0,0,1|0,0,0]=2 9351 B18R2.3984 Fc1ccccc1SCSCc2ccccc2 62a_100011215700_200011217039 [0,1,0,0,0,1|0,1,0]=3 9352 B18R2.3984 Fc1ccccc1SCSCc2ccccc2 62a_200011217039_100011215700 [0,1,0,0,0,1|0,1,0]=3 9353 B18R2.3984 Fc1cccnc1CNCCc2ccccc2 207a_100000106460_100011934734 [0,1,0,0,0,1|2,0,0]=4 9354 B18R2.3984 Fc1cccnc1CNCCc2ccccc2 2230a_100000106460_100000104219 [0,1,0,0,0,1|2,0,0]=4 9355 B18R2.3984 Fc1cccnc1CNCCc2ccccc2 270004a_100000106460_100011934734 [0,1,0,0,0,1|2,0,0]=4 9356 B18R2.3984 Fc1cccnc1CNCCc2ccccc2 34a_100000106460_100000104219 [0,1,0,0,0,1|2,0,0]=4 9357 B18R2.3984 Fc1cccnc1CNCCc2ccccc2 34a_100000690088_100000765856 [0,1,0,0,0,1|2,0,0]=4 9358 B18R2.3984 Fc1cccnc1COCCc2ccccc2 34a_100000210268_100000104219 [0,1,0,0,0,1|1,0,0]=3 9359 B18R2.3984 Fc1cccnc1COCCc2ccccc2 34a_100011934865_100000765856 [0,1,0,0,0,1|1,0,0]=3 9360 B18R2.3984 Fc1cccnc1COCCc2ccccc2 7a_100000210268_100000104219 [0,1,0,0,0,1|1,0,0]=3 9361 B18R2.3984 Fc1cccnc1COCCc2ccccn2 34a_100000210271_100000104219 [0,1,0,0,0,1|2,0,0]=4 9362 B18R2.3984 Fc1cccnc1COCCc2cccnc2 34a_100011217484_100000104219 [0,1,0,0,0,1|2,0,0]=4 9363 B18R2.3984 Fc1cccnc1COCCc2ccncc2 34a_100011216225_100000104219 [0,1,0,0,0,1|2,0,0]=4 9364 B18R2.3984 Fc1cccnc1CSCCc2ccccc2 62a_100000104219_100011218657 [0,1,0,0,0,1|1,1,0]=4 9365 B18R2.3984 Fc1cccnc1CSCCc2ccccc2 62a_100000765856_100000104219 [0,1,0,0,0,1|1,1,0]=4 9366 B18R2.3984 Fc1cccnc1CSCSc2ccccc2 62a_100000104219_100011218342 [0,1,0,0,0,1|1,1,0]=4 9367 B18R2.3984 Fc1cccnc1CSCSc2ccccc2 62a_100011218342_100000104219 [0,1,0,0,0,1|1,1,0]=4 9368 B18R2.3984 Fc1cccnc1OCCCc2ccccc2 34a_100011219419_100000211621 [0,1,0,0,0,1|2,0,0]=4 9369 B18R2.3984 Fc1cccnc1OCOCc2ccccc2 34a_100011219419_100000763385 [0,1,0,0,0,1|1,0,0]=3 9370 B18R2.3984 Fc1cccnc1OCSCc2ccccc2 34a_100011219419_200011217039 [0,1,0,0,0,1|1,1,0]=4 9371 B18R2.3984 Fc1cccnc1SCCCc2ccccc2 62a_100000211621_100000685392 [0,1,0,0,0,1|2,0,0]=4 9372 B18R2.3984 Fc1cccnc1SCCCc2ccccc2 62a_100000685392_100000211621 [0,1,0,0,0,1|2,0,0]=4 9373 B18R2.3984 Fc1cccnc1SCOCc2ccccc2 62a_100000685392_100000763385 [0,1,0,0,0,1|1,0,0]=3 9374 B18R2.3984 Fc1cccnc1SCOCc2ccccc2 62a_100000763385_100000685392 [0,1,0,0,0,1|1,0,0]=3 9375 B18R2.3984 Fc1cccnc1SCSCc2ccccc2 62a_100000685392_200011217039 [0,1,0,0,0,1|1,1,0]=4 9376 B18R2.3984 Fc1cccnc1SCSCc2ccccc2 62a_200011217039_100000685392 [0,1,0,0,0,1|1,1,0]=4 9377 B18R2.3984 Fc1ccncc1SCCCc2ccccc2 62a_100000211621_100009820683 [0,1,0,0,0,1|2,0,0]=4 9378 B18R2.3984 Fc1ccncc1SCCCc2ccccc2 62a_100009820683_100000211621 [0,1,0,0,0,1|2,0,0]=4 9379 B18R2.3984 Fc1ccncc1SCOCc2ccccc2 62a_100000763385_100009820683 [0,1,0,0,0,1|1,0,0]=3 9380 B18R2.3984 Fc1ccncc1SCOCc2ccccc2 62a_100009820683_100000763385 [0,1,0,0,0,1|1,0,0]=3 9381 B18R2.3984 Fc1ccncc1SCSCc2ccccc2 62a_100009820683_200011217039 [0,1,0,0,0,1|1,1,0]=4 9382 B18R2.3984 Fc1ccncc1SCSCc2ccccc2 62a_200011217039_100009820683 [0,1,0,0,0,1|1,1,0]=4 9383 B18R2.3984 Fc1cnccc1CNCCc2ccccc2 34a_100011935246_100000765856 [0,1,0,0,0,1|2,0,0]=4 9384 B18R2.3984 Fc1cnccc1COCCc2ccccc2 34a_100012172863_100000765856 [0,1,0,0,0,1|1,0,0]=3 9385 B18R2.3984 Fc1cnccc1NCCCc2ccccc2 27a_100000211184_100000035921 [0,1,0,0,0,1|2,0,0]=4 9386 B18R2.3984 Fc1cnccc1OCCCc2ccccc2 34a_200000081243_100000211621 [0,1,0,0,0,1|2,0,0]=4 9387 B18R2.3984 Fc1cnccc1OCOCc2ccccc2 34a_200000081243_100000763385 [0,1,0,0,0,1|1,0,0]=3 9388 B18R2.3984 Fc1cnccc1OCSCc2ccccc2 34a_200000081243_200011217039 [0,1,0,0,0,1|1,1,0]=4 9389 B18R2.3984 Fc1cnccc1SCCCc2ccccc2 62a_100000047030_100000211621 [0,1,0,0,0,1|2,0,0]=4 9390 B18R2.3984 Fc1cnccc1SCCCc2ccccc2 62a_100000211621_100000047030 [0,1,0,0,0,1|2,0,0]=4 9391 B18R2.3984 Fc1cnccc1SCOCc2ccccc2 62a_100000047030_100000763385 [0,1,0,0,0,1|1,0,0]=3 9392 B18R2.3984 Fc1cnccc1SCOCc2ccccc2 62a_100000763385_100000047030 [0,1,0,0,0,1|1,0,0]=3 9393 B18R2.3984 Fc1cnccc1SCSCc2ccccc2 62a_100000047030_200011217039 [0,1,0,0,0,1|1,1,0]=4 9394 B18R2.3984 Fc1cnccc1SCSCc2ccccc2 62a_200011217039_100000047030 [0,1,0,0,0,1|1,1,0]=4 9395 B18R2.3984 Fc1cncnc1SCOCc2ccccc2 62a_100000069762_100000763385 [0,1,0,0,0,1|2,0,0]=4 9396 B18R2.3984 Fc1cncnc1SCOCc2ccccc2 62a_100000763385_100000069762 [0,1,0,0,0,1|2,0,0]=4 9397 B18R2.3984 Fc1ncccc1CNCCc2ccccc2 2230a_100000106460_100000099810 [0,1,0,0,0,1|2,0,0]=4 9398 B18R2.3984 Fc1ncccc1CNCCc2ccccc2 34a_100000106460_100000099810 [0,1,0,0,0,1|2,0,0]=4 9399 B18R2.3984 Fc1ncccc1CNCCc2ccccc2 34a_100000724633_100000765856 [0,1,0,0,0,1|2,0,0]=4 9400 B18R2.3984 Fc1ncccc1COCCc2ccccc2 34a_100000079888_100000765856 [0,1,0,0,0,1|1,0,0]=3 9401 B18R2.3984 Fc1ncccc1COCCc2ccccc2 34a_100000210268_100000099810 [0,1,0,0,0,1|1,0,0]=3 9402 B18R2.3984 Fc1ncccc1COCCc2ccccc2 7a_100000079888_100000765856 [0,1,0,0,0,1|1,0,0]=3 9403 B18R2.3984 Fc1ncccc1COCCc2ccccc2 7a_100000210268_100000099810 [0,1,0,0,0,1|1,0,0]=3 9404 B18R2.3984 Fc1ncccc1COCCc2ccccn2 34a_100000210271_100000099810 [0,1,0,0,0,1|2,0,0]=4 9405 B18R2.3984 Fc1ncccc1COCCc2ccccn2 7a_100000079888_100015183660 [0,1,0,0,0,1|2,0,0]=4 9406 B18R2.3984 Fc1ncccc1COCCc2cccnc2 34a_100011217484_100000099810 [0,1,0,0,0,1|2,0,0]=4 9407 B18R2.3984 Fc1ncccc1COCCc2cccnc2 7a_100000079888_200011713674 [0,1,0,0,0,1|2,0,0]=4 9408 B18R2.3984 Fc1ncccc1COCCc2ccncc2 34a_100011216225_100000099810 [0,1,0,0,0,1|2,0,0]=4 9409 B18R2.3984 Fc1ncccc1COCCc2ccncc2 7a_100000079888_100000723409 [0,1,0,0,0,1|2,0,0]=4 9410 B18R2.3984 Fc1ncccc1CSCCc2ccccc2 62a_100000099810_100011218657 [0,1,0,0,0,1|1,1,0]=4 9411 B18R2.3984 Fc1ncccc1CSCCc2ccccc2 62a_100000765856_100000099810 [0,1,0,0,0,1|1,1,0]=4 9412 B18R2.3984 Fc1ncccc1CSCSc2ccccc2 62a_100000099810_100011218342 [0,1,0,0,0,1|1,1,0]=4 9413 B18R2.3984 Fc1ncccc1CSCSc2ccccc2 62a_100011218342_100000099810 [0,1,0,0,0,1|1,1,0]=4 9414 B18R2.3984 Fc1ncccc1OCCCc2ccccc2 34a_100000061740_100000211621 [0,1,0,0,0,1|2,0,0]=4 9415 B18R2.3984 Fc1ncccc1OCCCc2ccccc2 7a_100000061740_100000211621 [0,1,0,0,0,1|2,0,0]=4 9416 B18R2.3984 Fc1ncccc1OCOCc2ccccc2 34a_100000061740_100000763385 [0,1,0,0,0,1|1,0,0]=3 9417 B18R2.3984 Fc1ncccc1OCSCc2ccccc2 34a_100000061740_200011217039 [0,1,0,0,0,1|1,1,0]=4 9418 B18R2.3984 Fc1ncccc1SCCCc2ccccc2 62a_100000211621_100009816115 [0,1,0,0,0,1|2,0,0]=4 9419 B18R2.3984 Fc1ncccc1SCCCc2ccccc2 62a_100009816115_100000211621 [0,1,0,0,0,1|2,0,0]=4 9420 B18R2.3984 Fc1ncccc1SCOCc2ccccc2 62a_100000763385_100009816115 [0,1,0,0,0,1|1,0,0]=3 9421 B18R2.3984 Fc1ncccc1SCOCc2ccccc2 62a_100009816115_100000763385 [0,1,0,0,0,1|1,0,0]=3 9422 B18R2.3984 Fc1ncccc1SCSCc2ccccc2 62a_100009816115_200011217039 [0,1,0,0,0,1|1,1,0]=4 9423 B18R2.3984 Fc1ncccc1SCSCc2ccccc2 62a_200011217039_100009816115 [0,1,0,0,0,1|1,1,0]=4 9424 B18R2.3984 Fc1nccnc1SCOCc2ccccc2 62a_100000763385_200010125657 [0,1,0,0,0,1|2,0,0]=4 9425 B18R2.3984 Fc1nccnc1SCOCc2ccccc2 62a_200010125657_100000763385 [0,1,0,0,0,1|2,0,0]=4 9426 B18R2.3984 Ic1ccccc1C=NNCc2ccccc2 4a_100000007032_100000010305 [0,1,0,0,0,1|1,0,1]=4 9427 B18R2.3984 Ic1ccccc1CCOCc2ccccc2 34a_100010255290_100015291786 [0,1,0,0,0,1|0,0,0]=2 9428 B18R2.3984 Ic1ccccc1CCOCc2ccccc2 7a_100010255290_100000211182 [0,1,0,0,0,1|0,0,0]=2 9429 B18R2.3984 Ic1ccccc1CCOCc2ccccn2 34a_100010255290_100000721315 [0,1,0,0,0,1|1,0,0]=3 9430 B18R2.3984 Ic1ccccc1CCOCc2ccccn2 7a_100010255290_100000721315 [0,1,0,0,0,1|1,0,0]=3 9431 B18R2.3984 Ic1ccccc1CCOCc2cccnc2 34a_100010255290_100000733263 [0,1,0,0,0,1|1,0,0]=3 9432 B18R2.3984 Ic1ccccc1CCOCc2cccnc2 7a_100010255290_100000741622 [0,1,0,0,0,1|1,0,0]=3 9433 B18R2.3984 Ic1ccccc1CCOCc2cccnn2 34a_100010255290_100016990269 [0,1,0,0,0,1|2,0,0]=4 9434 B18R2.3984 Ic1ccccc1CCOCc2cccnn2 7a_100010255290_100016990269 [0,1,0,0,0,1|2,0,0]=4 9435 B18R2.3984 Ic1ccccc1CCOCc2ccncc2 7a_100010255290_100015193705 [0,1,0,0,0,1|1,0,0]=3 9436 B18R2.3984 Ic1ccccc1CCOCc2cnccn2 34a_100010255290_100016995436 [0,1,0,0,0,1|2,0,0]=4 9437 B18R2.3984 Ic1ccccc1CCOCc2cnccn2 7a_100010255290_100016995436 [0,1,0,0,0,1|2,0,0]=4 9438 B18R2.3984 Ic1ccccc1CCOCc2cncnc2 34a_100010255290_100015196519 [0,1,0,0,0,1|2,0,0]=4 9439 B18R2.3984 Ic1ccccc1CCOCc2cncnc2 7a_100010255290_100015196519 [0,1,0,0,0,1|2,0,0]=4 9440 B18R2.3984 Ic1ccccc1CCOCc2ncccn2 34a_100010255290_100000703007 [0,1,0,0,0,1|2,0,0]=4 9441 B18R2.3984 Ic1ccccc1CCOCc2ncccn2 7a_100010255290_100000703007 [0,1,0,0,0,1|2,0,0]=4 9442 B18R2.3984 Ic1ccccc1CNCCc2ccccc2 207a_100000106460_100000010305 [0,1,0,0,0,1|1,0,0]=3 9443 B18R2.3984 Ic1ccccc1CNCCc2ccccc2 2230a_100000106460_100011215278 [0,1,0,0,0,1|1,0,0]=3 9444 B18R2.3984 Ic1ccccc1CNCCc2ccccc2 270004a_100000106460_100000010305 [0,1,0,0,0,1|1,0,0]=3 9445 B18R2.3984 Ic1ccccc1CNCCc2ccccc2 34a_100000106460_100011215278 [0,1,0,0,0,1|1,0,0]=3 9446 B18R2.3984 Ic1ccccc1CNCCc2ccccn2 207a_100000211156_100000010305 [0,1,0,0,0,1|2,0,0]=4 9447 B18R2.3984 Ic1ccccc1CNCCc2ccccn2 270004a_100000211156_100000010305 [0,1,0,0,0,1|2,0,0]=4 9448 B18R2.3984 Ic1ccccc1CNCCc2cccnc2 207a_100000736294_100000010305 [0,1,0,0,0,1|2,0,0]=4 9449 B18R2.3984 Ic1ccccc1CNCCc2cccnc2 2230a_100000736294_100011215278 [0,1,0,0,0,1|2,0,0]=4 9450 B18R2.3984 Ic1ccccc1CNCCc2cccnc2 270004a_100000736294_100000010305 [0,1,0,0,0,1|2,0,0]=4 9451 B18R2.3984 Ic1ccccc1CNCCc2ccncc2 207a_100000742849_100000010305 [0,1,0,0,0,1|2,0,0]=4 9452 B18R2.3984 Ic1ccccc1CNCCc2ccncc2 270004a_100000742849_100000010305 [0,1,0,0,0,1|2,0,0]=4 9453 B18R2.3984 Ic1ccccc1COCCc2ccccc2 34a_100000187465_100000765856 [0,1,0,0,0,1|0,0,0]=2 9454 B18R2.3984 Ic1ccccc1COCCc2ccccc2 34a_100000210268_100011215278 [0,1,0,0,0,1|0,0,0]=2 9455 B18R2.3984 Ic1ccccc1COCCc2ccccc2 7a_100000187465_100000765856 [0,1,0,0,0,1|0,0,0]=2 9456 B18R2.3984 Ic1ccccc1COCCc2ccccc2 7a_100000210268_100011215278 [0,1,0,0,0,1|0,0,0]=2 9457 B18R2.3984 Ic1ccccc1COCCc2ccccn2 34a_100000210271_100011215278 [0,1,0,0,0,1|1,0,0]=3 9458 B18R2.3984 Ic1ccccc1COCCc2ccccn2 7a_100000187465_100015183660 [0,1,0,0,0,1|1,0,0]=3 9459 B18R2.3984 Ic1ccccc1COCCc2cccnc2 34a_100011217484_100011215278 [0,1,0,0,0,1|1,0,0]=3 9460 B18R2.3984 Ic1ccccc1COCCc2cccnc2 7a_100000187465_200011713674 [0,1,0,0,0,1|1,0,0]=3 9461 B18R2.3984 Ic1ccccc1COCCc2ccncc2 34a_100011216225_100011215278 [0,1,0,0,0,1|1,0,0]=3 9462 B18R2.3984 Ic1ccccc1COCCc2ccncc2 7a_100000187465_100000723409 [0,1,0,0,0,1|1,0,0]=3 9463 B18R2.3984 Ic1ccccc1COCCc2cnccn2 34a_100011349526_100011215278 [0,1,0,0,0,1|2,0,0]=4 9464 B18R2.3984 Ic1ccccc1COCCc2cncnc2 34a_100011709255_100011215278 [0,1,0,0,0,1|2,0,0]=4 9465 B18R2.3984 Ic1ccccc1CSCCc2ccccc2 62a_100000765856_100011216222 [0,1,0,0,0,1|0,1,0]=3 9466 B18R2.3984 Ic1ccccc1CSCCc2ccccc2 62a_100011216222_100011218657 [0,1,0,0,0,1|0,1,0]=3 9467 B18R2.3984 Ic1ccccc1CSCCc2ccccn2 62a_100011216222_100015183660 [0,1,0,0,0,1|1,1,0]=4 9468 B18R2.3984 Ic1ccccc1CSCCc2ccccn2 62a_100015183660_100011216222 [0,1,0,0,0,1|1,1,0]=4 9469 B18R2.3984 Ic1ccccc1CSCCc2cccnc2 62a_100011216222_200011713674 [0,1,0,0,0,1|1,1,0]=4 9470 B18R2.3984 Ic1ccccc1CSCCc2cccnc2 62a_200011713674_100011216222 [0,1,0,0,0,1|1,1,0]=4 9471 B18R2.3984 Ic1ccccc1CSCCc2ccncc2 62a_100000723409_100011216222 [0,1,0,0,0,1|1,1,0]=4 9472 B18R2.3984 Ic1ccccc1CSCCc2ccncc2 62a_100011216222_100000723409 [0,1,0,0,0,1|1,1,0]=4 9473 B18R2.3984 Ic1ccccc1CSCSc2ccccc2 62a_100011216222_100011218342 [0,1,0,0,0,1|0,1,0]=3 9474 B18R2.3984 Ic1ccccc1CSCSc2ccccc2 62a_100011218342_100011216222 [0,1,0,0,0,1|0,1,0]=3 9475 B18R2.3984 Ic1ccccc1NC/C=C/c2ccccc2 34a_100000210053_100016265936 [0,1,0,0,0,1|1,0,1]=4 9476 B18R2.3984 Ic1ccccc1NCC#Cc2ccccc2 34a_100000210053_100011352542 [0,1,0,0,0,1|1,0,1]=4 9477 B18R2.3984 Ic1ccccc1NCCCc2ccccc2 34a_100000210053_100000211621 [0,1,0,0,0,1|1,0,0]=3 9478 B18R2.3984 Ic1ccccc1NCCOc2ccccc2 34a_100000210053_100000184471 [0,1,0,0,0,1|2,0,0]=4 9479 B18R2.3984 Ic1ccccc1NCCSc2ccccc2 34a_100000210053_100000246102 [0,1,0,0,0,1|2,0,0]=4 9480 B18R2.3984 Ic1ccccc1NCOCc2ccccc2 34a_100000210053_100000763385 [0,1,0,0,0,1|0,0,0]=2 9481 B18R2.3984 Ic1ccccc1NCSCc2ccccc2 34a_100000210053_200011217039 [0,1,0,0,0,1|0,1,0]=3 9482 B18R2.3984 Ic1ccccc1NN=CCc2ccccc2 4a_100011218156_100000209964 [0,1,0,0,0,1|2,0,0]=4 9483 B18R2.3984 Ic1ccccc1OC/C=C/c2ccccc2 34a_100000739446_100016265936 [0,1,0,0,0,1|1,0,1]=4 9484 B18R2.3984 Ic1ccccc1OC/C=C/c2ccccc2 7a_100000739446_100016265936 [0,1,0,0,0,1|1,0,1]=4 9485 B18R2.3984 Ic1ccccc1OCC#Cc2ccccc2 34a_100000739446_100011352542 [0,1,0,0,0,1|1,0,1]=4 9486 B18R2.3984 Ic1ccccc1OCC#Cc2ccccc2 7a_100000739446_100011352542 [0,1,0,0,0,1|1,0,1]=4 9487 B18R2.3984 Ic1ccccc1OCCCc2ccccc2 34a_100000739446_100000211621 [0,1,0,0,0,1|1,0,0]=3 9488 B18R2.3984 Ic1ccccc1OCCCc2ccccc2 7a_100000739446_100000211621 [0,1,0,0,0,1|1,0,0]=3 9489 B18R2.3984 Ic1ccccc1OCCOc2ccccc2 34a_100000739446_100000184471 [0,1,0,0,0,1|2,0,0]=4 9490 B18R2.3984 Ic1ccccc1OCCOc2ccccc2 7a_100000739446_100000184471 [0,1,0,0,0,1|2,0,0]=4 9491 B18R2.3984 Ic1ccccc1OCCSc2ccccc2 34a_100000739446_100000246102 [0,1,0,0,0,1|2,0,0]=4 9492 B18R2.3984 Ic1ccccc1OCCSc2ccccc2 7a_100000739446_100000246102 [0,1,0,0,0,1|2,0,0]=4 9493 B18R2.3984 Ic1ccccc1OCOCc2ccccc2 34a_100000739446_100000763385 [0,1,0,0,0,1|0,0,0]=2 9494 B18R2.3984 Ic1ccccc1OCSCc2ccccc2 34a_100000739446_200011217039 [0,1,0,0,0,1|0,1,0]=3 9495 B18R2.3984 Ic1ccncc1OCCCc2ccccc2 34a_100000050107_100000211621 [0,1,0,0,0,1|2,0,0]=4 9496 B18R2.3984 Ic1ccncc1OCOCc2ccccc2 34a_100000050107_100000763385 [0,1,0,0,0,1|1,0,0]=3 9497 B18R2.3984 Ic1ccncc1OCSCc2ccccc2 34a_100000050107_200011217039 [0,1,0,0,0,1|1,1,0]=4 9498 B18R2.3984 Ic1ncccc1OCCCc2ccccc2 34a_100000034122_100000211621 [0,1,0,0,0,1|2,0,0]=4 9499 B18R2.3984 Ic1ncccc1OCCCc2ccccc2 7a_100000034122_100000211621 [0,1,0,0,0,1|2,0,0]=4 9500 B18R2.3984 Ic1ncccc1OCOCc2ccccc2 34a_100000034122_100000763385 [0,1,0,0,0,1|1,0,0]=3 9501 B18R2.3984 Ic1ncccc1OCSCc2ccccc2 34a_100000034122_200011217039 [0,1,0,0,0,1|1,1,0]=4 9502 B18R2.3984 Nc1ccccc1CCOCc2ccccc2 34a_100011215289_100015291786 [0,1,0,0,0,1|0,0,0]=2 9503 B18R2.3984 Nc1ccccc1CCOCc2ccccn2 34a_100011215289_100000721315 [0,1,0,0,0,1|1,0,0]=3 9504 B18R2.3984 Nc1ccccc1CCOCc2cccnc2 34a_100011215289_100000733263 [0,1,0,0,0,1|1,0,0]=3 9505 B18R2.3984 Nc1ccccc1CCOCc2cccnn2 34a_100011215289_100016990269 [0,1,0,0,0,1|2,0,0]=4 9506 B18R2.3984 Nc1ccccc1CCOCc2cnccn2 34a_100011215289_100016995436 [0,1,0,0,0,1|2,0,0]=4 9507 B18R2.3984 Nc1ccccc1CCOCc2cncnc2 34a_100011215289_100015196519 [0,1,0,0,0,1|2,0,0]=4 9508 B18R2.3984 Nc1ccccc1CCOCc2ncccn2 34a_100011215289_100000703007 [0,1,0,0,0,1|2,0,0]=4 9509 B18R2.3984 Nc1ccccc1COCCc2ccccc2 34a_100000212039_100000765856 [0,1,0,0,0,1|0,0,0]=2 9510 B18R2.3984 Nc1ccccc1OC/C=C/c2ccccc2 34a_100000185747_100016265936 [0,1,0,0,0,1|1,0,1]=4 9511 B18R2.3984 Nc1ccccc1OC/C=C/c2ccccc2 7a_100000185747_100016265936 [0,1,0,0,0,1|1,0,1]=4 9512 B18R2.3984 Nc1ccccc1OCC#Cc2ccccc2 34a_100000185747_100011352542 [0,1,0,0,0,1|1,0,1]=4 9513 B18R2.3984 Nc1ccccc1OCC#Cc2ccccc2 7a_100000185747_100011352542 [0,1,0,0,0,1|1,0,1]=4 9514 B18R2.3984 Nc1ccccc1OCCCc2ccccc2 34a_100000185747_100000211621 [0,1,0,0,0,1|1,0,0]=3 9515 B18R2.3984 Nc1ccccc1OCCCc2ccccc2 7a_100000185747_100000211621 [0,1,0,0,0,1|1,0,0]=3 9516 B18R2.3984 Nc1ccccc1OCCOc2ccccc2 34a_100000185747_100000184471 [0,1,0,0,0,1|2,0,0]=4 9517 B18R2.3984 Nc1ccccc1OCCOc2ccccc2 7a_100000185747_100000184471 [0,1,0,0,0,1|2,0,0]=4 9518 B18R2.3984 Nc1ccccc1OCCSc2ccccc2 34a_100000185747_100000246102 [0,1,0,0,0,1|2,0,0]=4 9519 B18R2.3984 Nc1ccccc1OCCSc2ccccc2 7a_100000185747_100000246102 [0,1,0,0,0,1|2,0,0]=4 9520 B18R2.3984 Nc1ccccc1OCOCc2ccccc2 34a_100000185747_100000763385 [0,1,0,0,0,1|0,0,0]=2 9521 B18R2.3984 Nc1ccccc1OCSCc2ccccc2 34a_100000185747_200011217039 [0,1,0,0,0,1|0,1,0]=3 9522 B18R2.3984 Nc1ccccc1SC/C=C/c2ccccc2 62a_100000210017_100016265936 [0,1,0,0,0,1|1,0,1]=4 9523 B18R2.3984 Nc1ccccc1SC/C=C/c2ccccc2 62a_100016265936_100000210017 [0,1,0,0,0,1|1,0,1]=4 9524 B18R2.3984 Nc1ccccc1SCC#Cc2ccccc2 62a_100000210017_100011352542 [0,1,0,0,0,1|1,0,1]=4 9525 B18R2.3984 Nc1ccccc1SCCCc2ccccc2 62a_100000210017_100000211621 [0,1,0,0,0,1|1,0,0]=3 9526 B18R2.3984 Nc1ccccc1SCCCc2ccccc2 62a_100000211621_100000210017 [0,1,0,0,0,1|1,0,0]=3 9527 B18R2.3984 Nc1ccccc1SCCOc2ccccc2 62a_100000184471_100000210017 [0,1,0,0,0,1|2,0,0]=4 9528 B18R2.3984 Nc1ccccc1SCCOc2ccccc2 62a_100000210017_100000184471 [0,1,0,0,0,1|2,0,0]=4 9529 B18R2.3984 Nc1ccccc1SCCSc2ccccc2 62a_100000210017_100000246102 [0,1,0,0,0,1|2,0,0]=4 9530 B18R2.3984 Nc1ccccc1SCCSc2ccccc2 62a_100000246102_100000210017 [0,1,0,0,0,1|2,0,0]=4 9531 B18R2.3984 Nc1ccccc1SCOCc2ccccc2 62a_100000210017_100000763385 [0,1,0,0,0,1|0,0,0]=2 9532 B18R2.3984 Nc1ccccc1SCOCc2ccccc2 62a_100000763385_100000210017 [0,1,0,0,0,1|0,0,0]=2 9533 B18R2.3984 Nc1ccccc1SCSCc2ccccc2 62a_100000210017_200011217039 [0,1,0,0,0,1|0,1,0]=3 9534 B18R2.3984 Nc1ccccc1SCSCc2ccccc2 62a_200011217039_100000210017 [0,1,0,0,0,1|0,1,0]=3 9535 B18R2.3984 Nc1cccnc1COCCc2ccccc2 34a_114873767017_100000765856 [0,1,0,0,0,1|1,0,0]=3 9536 B18R2.3984 Nc1cccnc1OCCCc2ccccc2 34a_100000746358_100000211621 [0,1,0,0,0,1|2,0,0]=4 9537 B18R2.3984 Nc1cccnc1OCOCc2ccccc2 34a_100000746358_100000763385 [0,1,0,0,0,1|1,0,0]=3 9538 B18R2.3984 Nc1cccnc1OCSCc2ccccc2 34a_100000746358_200011217039 [0,1,0,0,0,1|1,1,0]=4 9539 B18R2.3984 Nc1cccnc1SCCCc2ccccc2 62a_100000211621_100000688686 [0,1,0,0,0,1|2,0,0]=4 9540 B18R2.3984 Nc1cccnc1SCCCc2ccccc2 62a_100000688686_100000211621 [0,1,0,0,0,1|2,0,0]=4 9541 B18R2.3984 Nc1cccnc1SCOCc2ccccc2 62a_100000688686_100000763385 [0,1,0,0,0,1|1,0,0]=3 9542 B18R2.3984 Nc1cccnc1SCOCc2ccccc2 62a_100000763385_100000688686 [0,1,0,0,0,1|1,0,0]=3 9543 B18R2.3984 Nc1cccnc1SCSCc2ccccc2 62a_100000688686_200011217039 [0,1,0,0,0,1|1,1,0]=4 9544 B18R2.3984 Nc1cccnc1SCSCc2ccccc2 62a_200011217039_100000688686 [0,1,0,0,0,1|1,1,0]=4 9545 B18R2.3984 Nc1ccncc1OCCCc2ccccc2 34a_100000753702_100000211621 [0,1,0,0,0,1|2,0,0]=4 9546 B18R2.3984 Nc1ccncc1OCOCc2ccccc2 34a_100000753702_100000763385 [0,1,0,0,0,1|1,0,0]=3 9547 B18R2.3984 Nc1ccncc1OCSCc2ccccc2 34a_100000753702_200011217039 [0,1,0,0,0,1|1,1,0]=4 9548 B18R2.3984 Nc1ccncc1SCCCc2ccccc2 62a_100000047001_100000211621 [0,1,0,0,0,1|2,0,0]=4 9549 B18R2.3984 Nc1ccncc1SCCCc2ccccc2 62a_100000211621_100000047001 [0,1,0,0,0,1|2,0,0]=4 9550 B18R2.3984 Nc1ccncc1SCOCc2ccccc2 62a_100000047001_100000763385 [0,1,0,0,0,1|1,0,0]=3 9551 B18R2.3984 Nc1ccncc1SCOCc2ccccc2 62a_100000763385_100000047001 [0,1,0,0,0,1|1,0,0]=3 9552 B18R2.3984 Nc1ccncc1SCSCc2ccccc2 62a_100000047001_200011217039 [0,1,0,0,0,1|1,1,0]=4 9553 B18R2.3984 Nc1ccncc1SCSCc2ccccc2 62a_200011217039_100000047001 [0,1,0,0,0,1|1,1,0]=4 9554 B18R2.3984 Nc1cnccc1SCCCc2ccccc2 62a_100000211621_100000756074 [0,1,0,0,0,1|2,0,0]=4 9555 B18R2.3984 Nc1cnccc1SCCCc2ccccc2 62a_100000756074_100000211621 [0,1,0,0,0,1|2,0,0]=4 9556 B18R2.3984 Nc1cnccc1SCOCc2ccccc2 62a_100000756074_100000763385 [0,1,0,0,0,1|1,0,0]=3 9557 B18R2.3984 Nc1cnccc1SCOCc2ccccc2 62a_100000763385_100000756074 [0,1,0,0,0,1|1,0,0]=3 9558 B18R2.3984 Nc1cnccc1SCSCc2ccccc2 62a_100000756074_200011217039 [0,1,0,0,0,1|1,1,0]=4 9559 B18R2.3984 Nc1cnccc1SCSCc2ccccc2 62a_200011217039_100000756074 [0,1,0,0,0,1|1,1,0]=4 9560 B18R2.3984 Nc1cncnc1SCOCc2ccccc2 62a_100000709731_100000763385 [0,1,0,0,0,1|2,0,0]=4 9561 B18R2.3984 Nc1cncnc1SCOCc2ccccc2 62a_100000763385_100000709731 [0,1,0,0,0,1|2,0,0]=4 9562 B18R2.3984 Nc1cnncc1SCOCc2ccccc2 62a_100000763385_100009829405 [0,1,0,0,0,1|2,0,0]=4 9563 B18R2.3984 Nc1cnncc1SCOCc2ccccc2 62a_100009829405_100000763385 [0,1,0,0,0,1|2,0,0]=4 9564 B18R2.3984 Nc1ncccc1OCCCc2ccccc2 34a_100000211975_100000211621 [0,1,0,0,0,1|2,0,0]=4 9565 B18R2.3984 Nc1ncccc1OCCCc2ccccc2 7a_100000211975_100000211621 [0,1,0,0,0,1|2,0,0]=4 9566 B18R2.3984 Nc1ncccc1OCOCc2ccccc2 34a_100000211975_100000763385 [0,1,0,0,0,1|1,0,0]=3 9567 B18R2.3984 Nc1ncccc1OCSCc2ccccc2 34a_100000211975_200011217039 [0,1,0,0,0,1|1,1,0]=4 9568 B18R2.3984 Nc1ncccc1SCCCc2ccccc2 62a_100000045569_100000211621 [0,1,0,0,0,1|2,0,0]=4 9569 B18R2.3984 Nc1ncccc1SCCCc2ccccc2 62a_100000211621_100000045569 [0,1,0,0,0,1|2,0,0]=4 9570 B18R2.3984 Nc1ncccc1SCOCc2ccccc2 62a_100000045569_100000763385 [0,1,0,0,0,1|1,0,0]=3 9571 B18R2.3984 Nc1ncccc1SCOCc2ccccc2 62a_100000763385_100000045569 [0,1,0,0,0,1|1,0,0]=3 9572 B18R2.3984 Nc1ncccc1SCSCc2ccccc2 62a_100000045569_200011217039 [0,1,0,0,0,1|1,1,0]=4 9573 B18R2.3984 Nc1ncccc1SCSCc2ccccc2 62a_200011217039_100000045569 [0,1,0,0,0,1|1,1,0]=4 9574 B18R2.3984 Nc1nccnc1SCOCc2ccccc2 62a_100000747729_100000763385 [0,1,0,0,0,1|2,0,0]=4 9575 B18R2.3984 Nc1nccnc1SCOCc2ccccc2 62a_100000763385_100000747729 [0,1,0,0,0,1|2,0,0]=4 9576 B18R2.3984 Nc1ncncc1SCOCc2ccccc2 62a_100000763385_100011996079 [0,1,0,0,0,1|2,0,0]=4 9577 B18R2.3984 Nc1ncncc1SCOCc2ccccc2 62a_100011996079_100000763385 [0,1,0,0,0,1|2,0,0]=4 9578 B18R2.3984 O=c1[nH]ccnc1SCOCc2ccccc2 62a_100000763385_100000763361 [0,1,0,0,0,1|2,0,0]=4 9579 B18R2.3984 O=c1[nH]nccc1SCOCc2ccccc2 62a_100000763385_100000087129 [0,1,0,0,0,1|2,0,0]=4 9580 B18R2.3984 O=c1cc[nH]cc1SCCCc2ccccc2 62a_100000211621_100009998708 [0,1,0,0,0,1|2,0,0]=4 9581 B18R2.3984 O=c1cc[nH]cc1SCCCc2ccccc2 62a_100009998708_100000211621 [0,1,0,0,0,1|2,0,0]=4 9582 B18R2.3984 O=c1cc[nH]cc1SCOCc2ccccc2 62a_100000763385_100009998708 [0,1,0,0,0,1|1,0,0]=3 9583 B18R2.3984 O=c1cc[nH]cc1SCOCc2ccccc2 62a_100009998708_100000763385 [0,1,0,0,0,1|1,0,0]=3 9584 B18R2.3984 O=c1cc[nH]cc1SCSCc2ccccc2 62a_100009998708_200011217039 [0,1,0,0,0,1|1,1,0]=4 9585 B18R2.3984 O=c1cc[nH]cc1SCSCc2ccccc2 62a_200011217039_100009998708 [0,1,0,0,0,1|1,1,0]=4 9586 B18R2.3984 O=c1ccccn1CCNCc2ccccc2 207a_100000687133_100015611070 [0,1,0,0,0,1|2,0,0]=4 9587 B18R2.3984 O=c1ccccn1CCNCc2ccccc2 2230a_100000687133_100015291786 [0,1,0,0,0,1|2,0,0]=4 9588 B18R2.3984 O=c1ccocc1OCCCc2ccccc2 34a_100000060831_100000211621 [0,1,0,0,0,1|2,0,0]=4 9589 B18R2.3984 O=c1ccocc1OCOCc2ccccc2 34a_100000060831_100000763385 [0,1,0,0,0,1|1,0,0]=3 9590 B18R2.3984 O=c1ccocc1OCSCc2ccccc2 34a_100000060831_200011217039 [0,1,0,0,0,1|1,1,0]=4 9591 B18R2.3984 O=c1occcc1OCCCc2ccccc2 34a_100000077404_100000211621 [0,1,0,0,0,1|2,0,0]=4 9592 B18R2.3984 O=c1occcc1OCCCc2ccccc2 7a_100000077404_100000211621 [0,1,0,0,0,1|2,0,0]=4 9593 B18R2.3984 O=c1occcc1OCOCc2ccccc2 34a_100000077404_100000763385 [0,1,0,0,0,1|1,0,0]=3 9594 B18R2.3984 O=c1occcc1OCSCc2ccccc2 34a_100000077404_200011217039 [0,1,0,0,0,1|1,1,0]=4 9595 B18R2.3984 Oc1ccccc1C=NNCc2ccccc2 4a_100000007032_100000185834 [0,1,0,0,0,1|1,0,1]=4 9596 B18R2.3984 Oc1ccccc1CCNCc2ccccc2 207a_100011207237_100015611070 [0,1,0,0,0,1|1,0,0]=3 9597 B18R2.3984 Oc1ccccc1CCNCc2ccccc2 270004a_100011207237_100015611070 [0,1,0,0,0,1|1,0,0]=3 9598 B18R2.3984 Oc1ccccc1CCNCc2ccccc2 34a_100011207237_100015291786 [0,1,0,0,0,1|1,0,0]=3 9599 B18R2.3984 Oc1ccccc1CCNCc2ccccc2 34a_100015324214_100000722297 [0,1,0,0,0,1|1,0,0]=3 9600 B18R2.3984 Oc1ccccc1CCNCc2ccccn2 207a_100011207237_100000209966 [0,1,0,0,0,1|2,0,0]=4 9601 B18R2.3984 Oc1ccccc1CCNCc2ccccn2 270004a_100011207237_100000209966 [0,1,0,0,0,1|2,0,0]=4 9602 B18R2.3984 Oc1ccccc1CCNCc2ccccn2 34a_100011207237_100000721315 [0,1,0,0,0,1|2,0,0]=4 9603 B18R2.3984 Oc1ccccc1CCNCc2cccnc2 207a_100011207237_100000209961 [0,1,0,0,0,1|2,0,0]=4 9604 B18R2.3984 Oc1ccccc1CCNCc2cccnc2 270004a_100011207237_100000209961 [0,1,0,0,0,1|2,0,0]=4 9605 B18R2.3984 Oc1ccccc1CCNCc2cccnc2 34a_100011207237_100000733263 [0,1,0,0,0,1|2,0,0]=4 9606 B18R2.3984 Oc1ccccc1CCNCc2ccncc2 207a_100011207237_100000186114 [0,1,0,0,0,1|2,0,0]=4 9607 B18R2.3984 Oc1ccccc1CCOCc2ccccc2 34a_100000210790_100000722297 [0,1,0,0,0,1|0,0,0]=2 9608 B18R2.3984 Oc1ccccc1CCOCc2ccccc2 7a_100000210790_100000722297 [0,1,0,0,0,1|0,0,0]=2 9609 B18R2.3984 Oc1ccccc1CCSCc2ccccc2 62a_100000211182_100000722297 [0,1,0,0,0,1|0,1,0]=3 9610 B18R2.3984 Oc1ccccc1CCSCc2ccccc2 62a_100000722297_100015291786 [0,1,0,0,0,1|0,1,0]=3 9611 B18R2.3984 Oc1ccccc1CCSCc2ccccn2 62a_100000721315_100000722297 [0,1,0,0,0,1|1,1,0]=4 9612 B18R2.3984 Oc1ccccc1CCSCc2ccccn2 62a_100000722297_100000721315 [0,1,0,0,0,1|1,1,0]=4 9613 B18R2.3984 Oc1ccccc1CCSCc2cccnc2 62a_100000722297_100000741622 [0,1,0,0,0,1|1,1,0]=4 9614 B18R2.3984 Oc1ccccc1CCSCc2cccnc2 62a_100000741622_100000722297 [0,1,0,0,0,1|1,1,0]=4 9615 B18R2.3984 Oc1ccccc1CCSCc2ccncc2 62a_100000722297_100015193705 [0,1,0,0,0,1|1,1,0]=4 9616 B18R2.3984 Oc1ccccc1CCSCc2ccncc2 62a_100015193705_100000722297 [0,1,0,0,0,1|1,1,0]=4 9617 B18R2.3984 Oc1ccccc1CNCCc2ccccc2 34a_100000185550_100000765856 [0,1,0,0,0,1|1,0,0]=3 9618 B18R2.3984 Oc1ccccc1NC/C=C/c2ccccc2 34a_100000185747_100016265936 [0,1,0,0,0,1|1,0,1]=4 9619 B18R2.3984 Oc1ccccc1NCC#Cc2ccccc2 34a_100000185747_100011352542 [0,1,0,0,0,1|1,0,1]=4 9620 B18R2.3984 Oc1ccccc1NCCCc2ccccc2 34a_100000185747_100000211621 [0,1,0,0,0,1|1,0,0]=3 9621 B18R2.3984 Oc1ccccc1NCCOc2ccccc2 34a_100000185747_100000184471 [0,1,0,0,0,1|2,0,0]=4 9622 B18R2.3984 Oc1ccccc1NCCSc2ccccc2 34a_100000185747_100000246102 [0,1,0,0,0,1|2,0,0]=4 9623 B18R2.3984 Oc1ccccc1NCOCc2ccccc2 34a_100000185747_100000763385 [0,1,0,0,0,1|0,0,0]=2 9624 B18R2.3984 Oc1ccccc1NCSCc2ccccc2 34a_100000185747_200011217039 [0,1,0,0,0,1|0,1,0]=3 9625 B18R2.3984 Oc1ccccc1SC/C=C/c2ccccc2 62a_100000739446_100016265936 [0,1,0,0,0,1|1,0,1]=4 9626 B18R2.3984 Oc1ccccc1SC/C=C/c2ccccc2 62a_100016265936_100000739446 [0,1,0,0,0,1|1,0,1]=4 9627 B18R2.3984 Oc1ccccc1SCC#Cc2ccccc2 62a_100000739446_100011352542 [0,1,0,0,0,1|1,0,1]=4 9628 B18R2.3984 Oc1ccccc1SCCCc2ccccc2 62a_100000211621_100000739446 [0,1,0,0,0,1|1,0,0]=3 9629 B18R2.3984 Oc1ccccc1SCCCc2ccccc2 62a_100000739446_100000211621 [0,1,0,0,0,1|1,0,0]=3 9630 B18R2.3984 Oc1ccccc1SCCOc2ccccc2 62a_100000184471_100000739446 [0,1,0,0,0,1|2,0,0]=4 9631 B18R2.3984 Oc1ccccc1SCCOc2ccccc2 62a_100000739446_100000184471 [0,1,0,0,0,1|2,0,0]=4 9632 B18R2.3984 Oc1ccccc1SCCSc2ccccc2 62a_100000246102_100000739446 [0,1,0,0,0,1|2,0,0]=4 9633 B18R2.3984 Oc1ccccc1SCCSc2ccccc2 62a_100000739446_100000246102 [0,1,0,0,0,1|2,0,0]=4 9634 B18R2.3984 Oc1ccccc1SCOCc2ccccc2 62a_100000739446_100000763385 [0,1,0,0,0,1|0,0,0]=2 9635 B18R2.3984 Oc1ccccc1SCOCc2ccccc2 62a_100000763385_100000739446 [0,1,0,0,0,1|0,0,0]=2 9636 B18R2.3984 Oc1ccccc1SCSCc2ccccc2 62a_100000739446_200011217039 [0,1,0,0,0,1|0,1,0]=3 9637 B18R2.3984 Oc1ccccc1SCSCc2ccccc2 62a_200011217039_100000739446 [0,1,0,0,0,1|0,1,0]=3 9638 B18R2.3984 Oc1cccnc1CNCCc2ccccc2 34a_100000106460_200020655725 [0,1,0,0,0,1|2,0,0]=4 9639 B18R2.3984 Oc1cccnc1COCCc2ccccc2 34a_100000210268_200020655725 [0,1,0,0,0,1|1,0,0]=3 9640 B18R2.3984 Oc1cccnc1COCCc2ccccc2 7a_100000210268_200020655725 [0,1,0,0,0,1|1,0,0]=3 9641 B18R2.3984 Oc1cccnc1COCCc2ccccn2 34a_100000210271_200020655725 [0,1,0,0,0,1|2,0,0]=4 9642 B18R2.3984 Oc1cccnc1COCCc2cccnc2 34a_100011217484_200020655725 [0,1,0,0,0,1|2,0,0]=4 9643 B18R2.3984 Oc1cccnc1COCCc2ccncc2 34a_100011216225_200020655725 [0,1,0,0,0,1|2,0,0]=4 9644 B18R2.3984 Oc1cccnc1CSCCc2ccccc2 62a_100000765856_200020655725 [0,1,0,0,0,1|1,1,0]=4 9645 B18R2.3984 Oc1cccnc1CSCCc2ccccc2 62a_200020655725_100011218657 [0,1,0,0,0,1|1,1,0]=4 9646 B18R2.3984 Oc1cccnc1CSCSc2ccccc2 62a_100011218342_200020655725 [0,1,0,0,0,1|1,1,0]=4 9647 B18R2.3984 Oc1cccnc1CSCSc2ccccc2 62a_200020655725_100011218342 [0,1,0,0,0,1|1,1,0]=4 9648 B18R2.3984 Oc1cccnc1SCCCc2ccccc2 62a_100000034122_100000211621 [0,1,0,0,0,1|2,0,0]=4 9649 B18R2.3984 Oc1cccnc1SCCCc2ccccc2 62a_100000211621_100000034122 [0,1,0,0,0,1|2,0,0]=4 9650 B18R2.3984 Oc1cccnc1SCOCc2ccccc2 62a_100000034122_100000763385 [0,1,0,0,0,1|1,0,0]=3 9651 B18R2.3984 Oc1cccnc1SCOCc2ccccc2 62a_100000763385_100000034122 [0,1,0,0,0,1|1,0,0]=3 9652 B18R2.3984 Oc1cccnc1SCSCc2ccccc2 62a_100000034122_200011217039 [0,1,0,0,0,1|1,1,0]=4 9653 B18R2.3984 Oc1cccnc1SCSCc2ccccc2 62a_200011217039_100000034122 [0,1,0,0,0,1|1,1,0]=4 9654 B18R2.3984 Oc1cnccc1SCCCc2ccccc2 62a_100000211621_100009817591 [0,1,0,0,0,1|2,0,0]=4 9655 B18R2.3984 Oc1cnccc1SCCCc2ccccc2 62a_100009817591_100000211621 [0,1,0,0,0,1|2,0,0]=4 9656 B18R2.3984 Oc1cnccc1SCOCc2ccccc2 62a_100000763385_100009817591 [0,1,0,0,0,1|1,0,0]=3 9657 B18R2.3984 Oc1cnccc1SCOCc2ccccc2 62a_100009817591_100000763385 [0,1,0,0,0,1|1,0,0]=3 9658 B18R2.3984 Oc1cnccc1SCSCc2ccccc2 62a_100009817591_200011217039 [0,1,0,0,0,1|1,1,0]=4 9659 B18R2.3984 Oc1cnccc1SCSCc2ccccc2 62a_200011217039_100009817591 [0,1,0,0,0,1|1,1,0]=4 9660 B18R2.3984 Oc1ncccc1CNCCc2ccccc2 207a_100000106460_100011998315 [0,1,0,0,0,1|2,0,0]=4 9661 B18R2.3984 Oc1ncccc1CNCCc2ccccc2 270004a_100000106460_100011998315 [0,1,0,0,0,1|2,0,0]=4 9662 B18R2.3984 Oc1ncccc1SCCCc2ccccc2 62a_100000211621_100000760158 [0,1,0,0,0,1|2,0,0]=4 9663 B18R2.3984 Oc1ncccc1SCCCc2ccccc2 62a_100000760158_100000211621 [0,1,0,0,0,1|2,0,0]=4 9664 B18R2.3984 Oc1ncccc1SCOCc2ccccc2 62a_100000760158_100000763385 [0,1,0,0,0,1|1,0,0]=3 9665 B18R2.3984 Oc1ncccc1SCOCc2ccccc2 62a_100000763385_100000760158 [0,1,0,0,0,1|1,0,0]=3 9666 B18R2.3984 Oc1ncccc1SCSCc2ccccc2 62a_100000760158_200011217039 [0,1,0,0,0,1|1,1,0]=4 9667 B18R2.3984 Oc1ncccc1SCSCc2ccccc2 62a_200011217039_100000760158 [0,1,0,0,0,1|1,1,0]=4 9668 B18R2.3984 Oc1ncncc1SCOCc2ccccc2 62a_100000751107_100000763385 [0,1,0,0,0,1|2,0,0]=4 9669 B18R2.3984 Oc1ncncc1SCOCc2ccccc2 62a_100000763385_100000751107 [0,1,0,0,0,1|2,0,0]=4 9670 B18R2.3984 S=c1cc[nH]cc1SCCCc2ccccc2 62a_100000211621_200012280681 [0,1,0,0,0,1|2,0,0]=4 9671 B18R2.3984 S=c1cc[nH]cc1SCCCc2ccccc2 62a_200012280681_100000211621 [0,1,0,0,0,1|2,0,0]=4 9672 B18R2.3984 S=c1cc[nH]cc1SCOCc2ccccc2 62a_100000763385_200012280681 [0,1,0,0,0,1|1,0,0]=3 9673 B18R2.3984 S=c1cc[nH]cc1SCOCc2ccccc2 62a_200012280681_100000763385 [0,1,0,0,0,1|1,0,0]=3 9674 B18R2.3984 S=c1cc[nH]cc1SCSCc2ccccc2 62a_200011217039_200012280681 [0,1,0,0,0,1|1,1,0]=4 9675 B18R2.3984 S=c1cc[nH]cc1SCSCc2ccccc2 62a_200012280681_200011217039 [0,1,0,0,0,1|1,1,0]=4 9676 B18R2.3984 [O-][n+]1ccccc1OCCCc2ccccc2 7a_100000211761_100000211621 [0,1,0,0,0,1|2,0,0]=4 9677 B18R2.3984 [O-][n+]1ccccc1SCCCc2ccccc2 62a_100000211621_200000042595 [0,1,0,0,0,1|2,0,0]=4 9678 B18R2.3984 [O-][n+]1ccccc1SCOCc2ccccc2 62a_100000763385_200000042595 [0,1,0,0,0,1|1,0,0]=3 9679 B18R2.3984 [O-][n+]1ccccc1SCSCc2ccccc2 62a_200011217039_200000042595 [0,1,0,0,0,1|1,1,0]=4 9680 B18R2.6483 Brc1cc(ccn1)CNCCc2ccccc2 2230a_100000106460_100010243470 [0,1,0,0,0,1|2,0,0]=4 9681 B18R2.6483 Brc1cc(ccn1)CNCCc2ccccc2 2230a_100025757509_100000765856 [0,1,0,0,0,1|2,0,0]=4 9682 B18R2.6483 Brc1cc(ccn1)CNCCc2ccccc2 270004a_100000106460_100009814634 [0,1,0,0,0,1|2,0,0]=4 9683 B18R2.6483 Brc1cc(ccn1)CNCCc2ccccc2 34a_100000106460_100010243470 [0,1,0,0,0,1|2,0,0]=4 9684 B18R2.6483 Brc1cc(ccn1)CNCCc2ccccc2 34a_100025757509_100000765856 [0,1,0,0,0,1|2,0,0]=4 9685 B18R2.6483 Brc1cc(ccn1)CNCSc2ccccc2 2230a_100025757509_100011218342 [0,1,0,0,0,1|2,0,0]=4 9686 B18R2.6483 Brc1cc(ccn1)COCCc2ccccc2 34a_100000210268_100010243470 [0,1,0,0,0,1|1,0,0]=3 9687 B18R2.6483 Brc1cc(ccn1)COCCc2ccccc2 34a_100009814636_100000765856 [0,1,0,0,0,1|1,0,0]=3 9688 B18R2.6483 Brc1cc(ccn1)COCCc2ccccc2 7a_100000210268_100010254460 [0,1,0,0,0,1|1,0,0]=3 9689 B18R2.6483 Brc1cc(ccn1)COCCc2ccccc2 7a_100009814636_100000765856 [0,1,0,0,0,1|1,0,0]=3 9690 B18R2.6483 Brc1cc(ccn1)COCCc2ccccn2 34a_100000210271_100010243470 [0,1,0,0,0,1|2,0,0]=4 9691 B18R2.6483 Brc1cc(ccn1)COCCc2ccccn2 7a_100009814636_100015183660 [0,1,0,0,0,1|2,0,0]=4 9692 B18R2.6483 Brc1cc(ccn1)COCCc2cccnc2 34a_100011217484_100010243470 [0,1,0,0,0,1|2,0,0]=4 9693 B18R2.6483 Brc1cc(ccn1)COCCc2cccnc2 7a_100009814636_200011713674 [0,1,0,0,0,1|2,0,0]=4 9694 B18R2.6483 Brc1cc(ccn1)COCCc2ccncc2 34a_100011216225_100010243470 [0,1,0,0,0,1|2,0,0]=4 9695 B18R2.6483 Brc1cc(ccn1)COCCc2ccncc2 7a_100009814636_100000723409 [0,1,0,0,0,1|2,0,0]=4 9696 B18R2.6483 Brc1cc(ccn1)CSCCc2ccccc2 62a_100000765856_100010243470 [0,1,0,0,0,1|1,1,0]=4 9697 B18R2.6483 Brc1cc(ccn1)CSCCc2ccccc2 62a_100010254460_100011218657 [0,1,0,0,0,1|1,1,0]=4 9698 B18R2.6483 Brc1cc(ccn1)CSCSc2ccccc2 62a_100010254460_100011218342 [0,1,0,0,0,1|1,1,0]=4 9699 B18R2.6483 Brc1cc(ccn1)CSCSc2ccccc2 62a_100011218342_100010243470 [0,1,0,0,0,1|1,1,0]=4 9700 B18R2.6483 Brc1cc(ccn1)SCCCc2ccccc2 62a_100000211621_100009814637 [0,1,0,0,0,1|2,0,0]=4 9701 B18R2.6483 Brc1cc(ccn1)SCCCc2ccccc2 62a_100009814637_100000211621 [0,1,0,0,0,1|2,0,0]=4 9702 B18R2.6483 Brc1cc(ccn1)SCOCc2ccccc2 62a_100000763385_100009814637 [0,1,0,0,0,1|1,0,0]=3 9703 B18R2.6483 Brc1cc(ccn1)SCOCc2ccccc2 62a_100009814637_100000763385 [0,1,0,0,0,1|1,0,0]=3 9704 B18R2.6483 Brc1cc(ccn1)SCSCc2ccccc2 62a_100009814637_200011217039 [0,1,0,0,0,1|1,1,0]=4 9705 B18R2.6483 Brc1cc(ccn1)SCSCc2ccccc2 62a_200011217039_100009814637 [0,1,0,0,0,1|1,1,0]=4 9706 B18R2.6483 Brc1cccc(c1)C#CCNc2ccccc2 34a_100000106764_100010706776 [0,1,0,0,0,1|1,0,1]=4 9707 B18R2.6483 Brc1cccc(c1)C#CCOc2ccccc2 34a_100000210340_100010706776 [0,1,0,0,0,1|1,0,1]=4 9708 B18R2.6483 Brc1cccc(c1)C#CCOc2ccccc2 7a_100000210340_100010706776 [0,1,0,0,0,1|1,0,1]=4 9709 B18R2.6483 Brc1cccc(c1)C#CCSc2ccccc2 62a_100000719477_100010706776 [0,1,0,0,0,1|1,0,1]=4 9710 B18R2.6483 Brc1cccc(c1)C#CCSc2ccccc2 62a_100010706776_100000041952 [0,1,0,0,0,1|1,0,1]=4 9711 B18R2.6483 Brc1cccc(c1)C=NNCc2ccccc2 4a_100000007032_100000210085 [0,1,0,0,0,1|1,0,1]=4 9712 B18R2.6483 Brc1cccc(c1)CC=NNc2ccccc2 4a_100015195140_200000698211 [0,1,0,0,0,1|2,0,0]=4 9713 B18R2.6483 Brc1cccc(c1)CCCNc2ccccc2 34a_100000106764_100011713683 [0,1,0,0,0,1|1,0,0]=3 9714 B18R2.6483 Brc1cccc(c1)CCCOc2ccccc2 34a_100000210340_100011713683 [0,1,0,0,0,1|1,0,0]=3 9715 B18R2.6483 Brc1cccc(c1)CCCOc2ccccc2 7a_100000210340_100011713683 [0,1,0,0,0,1|1,0,0]=3 9716 B18R2.6483 Brc1cccc(c1)CCCOc2cccnc2 34a_100000210849_100011713683 [0,1,0,0,0,1|2,0,0]=4 9717 B18R2.6483 Brc1cccc(c1)CCCOc2cccnc2 7a_100000210849_100011713683 [0,1,0,0,0,1|2,0,0]=4 9718 B18R2.6483 Brc1cccc(c1)CCCOc2ccncc2 34a_100000212176_100011713683 [0,1,0,0,0,1|2,0,0]=4 9719 B18R2.6483 Brc1cccc(c1)CCCSc2ccccc2 62a_100000719477_100011713683 [0,1,0,0,0,1|1,0,0]=3 9720 B18R2.6483 Brc1cccc(c1)CCCSc2ccccc2 62a_100011713683_100000041952 [0,1,0,0,0,1|1,0,0]=3 9721 B18R2.6483 Brc1cccc(c1)CCCSc2ccccn2 62a_100011216584_100011713683 [0,1,0,0,0,1|2,0,0]=4 9722 B18R2.6483 Brc1cccc(c1)CCCSc2ccccn2 62a_100011713683_100011216584 [0,1,0,0,0,1|2,0,0]=4 9723 B18R2.6483 Brc1cccc(c1)CCCSc2cccnc2 62a_100000210063_100011713683 [0,1,0,0,0,1|2,0,0]=4 9724 B18R2.6483 Brc1cccc(c1)CCCSc2cccnc2 62a_100011713683_100000210063 [0,1,0,0,0,1|2,0,0]=4 9725 B18R2.6483 Brc1cccc(c1)CCCSc2ccncc2 62a_100000728582_100011713683 [0,1,0,0,0,1|2,0,0]=4 9726 B18R2.6483 Brc1cccc(c1)CCCSc2ccncc2 62a_100011713683_100000728582 [0,1,0,0,0,1|2,0,0]=4 9727 B18R2.6483 Brc1cccc(c1)CCNCc2ccccc2 207a_100011207229_100015611070 [0,1,0,0,0,1|1,0,0]=3 9728 B18R2.6483 Brc1cccc(c1)CCNCc2ccccc2 2230a_100011207229_100015291786 [0,1,0,0,0,1|1,0,0]=3 9729 B18R2.6483 Brc1cccc(c1)CCNCc2ccccc2 2230a_100015324214_100011740638 [0,1,0,0,0,1|1,0,0]=3 9730 B18R2.6483 Brc1cccc(c1)CCNCc2ccccc2 270004a_100011207229_100015611070 [0,1,0,0,0,1|1,0,0]=3 9731 B18R2.6483 Brc1cccc(c1)CCNCc2ccccc2 34a_100011207229_100015291786 [0,1,0,0,0,1|1,0,0]=3 9732 B18R2.6483 Brc1cccc(c1)CCNCc2ccccc2 34a_100015324214_100011740638 [0,1,0,0,0,1|1,0,0]=3 9733 B18R2.6483 Brc1cccc(c1)CCNCc2ccccn2 207a_100011207229_100000209966 [0,1,0,0,0,1|2,0,0]=4 9734 B18R2.6483 Brc1cccc(c1)CCNCc2ccccn2 2230a_100011207229_100000721315 [0,1,0,0,0,1|2,0,0]=4 9735 B18R2.6483 Brc1cccc(c1)CCNCc2ccccn2 270004a_100011207229_100000209966 [0,1,0,0,0,1|2,0,0]=4 9736 B18R2.6483 Brc1cccc(c1)CCNCc2ccccn2 34a_100011207229_100000721315 [0,1,0,0,0,1|2,0,0]=4 9737 B18R2.6483 Brc1cccc(c1)CCNCc2cccnc2 207a_100011207229_100000209961 [0,1,0,0,0,1|2,0,0]=4 9738 B18R2.6483 Brc1cccc(c1)CCNCc2cccnc2 2230a_100011207229_100000741622 [0,1,0,0,0,1|2,0,0]=4 9739 B18R2.6483 Brc1cccc(c1)CCNCc2cccnc2 270004a_100011207229_100000209961 [0,1,0,0,0,1|2,0,0]=4 9740 B18R2.6483 Brc1cccc(c1)CCNCc2cccnc2 34a_100011207229_100000733263 [0,1,0,0,0,1|2,0,0]=4 9741 B18R2.6483 Brc1cccc(c1)CCNCc2ccncc2 207a_100011207229_100000186114 [0,1,0,0,0,1|2,0,0]=4 9742 B18R2.6483 Brc1cccc(c1)CCNCc2ccncc2 2230a_100011207229_100015193705 [0,1,0,0,0,1|2,0,0]=4 9743 B18R2.6483 Brc1cccc(c1)CCOCc2ccccc2 34a_100000210790_100011740638 [0,1,0,0,0,1|0,0,0]=2 9744 B18R2.6483 Brc1cccc(c1)CCOCc2ccccc2 34a_100011217444_100015291786 [0,1,0,0,0,1|0,0,0]=2 9745 B18R2.6483 Brc1cccc(c1)CCOCc2ccccc2 7a_100000210790_100011740638 [0,1,0,0,0,1|0,0,0]=2 9746 B18R2.6483 Brc1cccc(c1)CCOCc2ccccc2 7a_100011217444_100000211182 [0,1,0,0,0,1|0,0,0]=2 9747 B18R2.6483 Brc1cccc(c1)CCOCc2ccccn2 34a_100011217444_100000721315 [0,1,0,0,0,1|1,0,0]=3 9748 B18R2.6483 Brc1cccc(c1)CCOCc2ccccn2 7a_100011217444_100000721315 [0,1,0,0,0,1|1,0,0]=3 9749 B18R2.6483 Brc1cccc(c1)CCOCc2cccnc2 34a_100011217444_100000733263 [0,1,0,0,0,1|1,0,0]=3 9750 B18R2.6483 Brc1cccc(c1)CCOCc2cccnc2 7a_100011217444_100000741622 [0,1,0,0,0,1|1,0,0]=3 9751 B18R2.6483 Brc1cccc(c1)CCOCc2cccnn2 34a_100011217444_100016990269 [0,1,0,0,0,1|2,0,0]=4 9752 B18R2.6483 Brc1cccc(c1)CCOCc2cccnn2 7a_100011217444_100016990269 [0,1,0,0,0,1|2,0,0]=4 9753 B18R2.6483 Brc1cccc(c1)CCOCc2ccncc2 7a_100011217444_100015193705 [0,1,0,0,0,1|1,0,0]=3 9754 B18R2.6483 Brc1cccc(c1)CCOCc2cnccn2 34a_100011217444_100016995436 [0,1,0,0,0,1|2,0,0]=4 9755 B18R2.6483 Brc1cccc(c1)CCOCc2cnccn2 7a_100011217444_100016995436 [0,1,0,0,0,1|2,0,0]=4 9756 B18R2.6483 Brc1cccc(c1)CCOCc2cncnc2 34a_100011217444_100015196519 [0,1,0,0,0,1|2,0,0]=4 9757 B18R2.6483 Brc1cccc(c1)CCOCc2cncnc2 7a_100011217444_100015196519 [0,1,0,0,0,1|2,0,0]=4 9758 B18R2.6483 Brc1cccc(c1)CCOCc2ncccn2 34a_100011217444_100000703007 [0,1,0,0,0,1|2,0,0]=4 9759 B18R2.6483 Brc1cccc(c1)CCOCc2ncccn2 7a_100011217444_100000703007 [0,1,0,0,0,1|2,0,0]=4 9760 B18R2.6483 Brc1cccc(c1)CCSCc2ccccc2 62a_100000211182_100011740638 [0,1,0,0,0,1|0,1,0]=3 9761 B18R2.6483 Brc1cccc(c1)CCSCc2ccccc2 62a_100011740638_100015291786 [0,1,0,0,0,1|0,1,0]=3 9762 B18R2.6483 Brc1cccc(c1)CCSCc2ccccn2 62a_100000721315_100011740638 [0,1,0,0,0,1|1,1,0]=4 9763 B18R2.6483 Brc1cccc(c1)CCSCc2ccccn2 62a_100011740638_100000721315 [0,1,0,0,0,1|1,1,0]=4 9764 B18R2.6483 Brc1cccc(c1)CCSCc2cccnc2 62a_100000741622_100011740638 [0,1,0,0,0,1|1,1,0]=4 9765 B18R2.6483 Brc1cccc(c1)CCSCc2cccnc2 62a_100011740638_100000741622 [0,1,0,0,0,1|1,1,0]=4 9766 B18R2.6483 Brc1cccc(c1)CCSCc2ccncc2 62a_100011740638_100015193705 [0,1,0,0,0,1|1,1,0]=4 9767 B18R2.6483 Brc1cccc(c1)CCSCc2ccncc2 62a_100015193705_100011740638 [0,1,0,0,0,1|1,1,0]=4 9768 B18R2.6483 Brc1cccc(c1)CNCCc2ccccc2 207a_100000106460_100000210085 [0,1,0,0,0,1|1,0,0]=3 9769 B18R2.6483 Brc1cccc(c1)CNCCc2ccccc2 2230a_100000106460_100000698116 [0,1,0,0,0,1|1,0,0]=3 9770 B18R2.6483 Brc1cccc(c1)CNCCc2ccccc2 2230a_100000174977_100000765856 [0,1,0,0,0,1|1,0,0]=3 9771 B18R2.6483 Brc1cccc(c1)CNCCc2ccccc2 270004a_100000106460_100000210085 [0,1,0,0,0,1|1,0,0]=3 9772 B18R2.6483 Brc1cccc(c1)CNCCc2ccccc2 34a_100000106460_100000698116 [0,1,0,0,0,1|1,0,0]=3 9773 B18R2.6483 Brc1cccc(c1)CNCCc2ccccc2 34a_100000174977_100000765856 [0,1,0,0,0,1|1,0,0]=3 9774 B18R2.6483 Brc1cccc(c1)CNCCc2ccccn2 207a_100000211156_100000210085 [0,1,0,0,0,1|2,0,0]=4 9775 B18R2.6483 Brc1cccc(c1)CNCCc2ccccn2 2230a_100000174977_100015183660 [0,1,0,0,0,1|2,0,0]=4 9776 B18R2.6483 Brc1cccc(c1)CNCCc2ccccn2 270004a_100000211156_100000210085 [0,1,0,0,0,1|2,0,0]=4 9777 B18R2.6483 Brc1cccc(c1)CNCCc2cccnc2 207a_100000736294_100000210085 [0,1,0,0,0,1|2,0,0]=4 9778 B18R2.6483 Brc1cccc(c1)CNCCc2cccnc2 2230a_100000174977_200011713674 [0,1,0,0,0,1|2,0,0]=4 9779 B18R2.6483 Brc1cccc(c1)CNCCc2cccnc2 2230a_100000736294_100000698116 [0,1,0,0,0,1|2,0,0]=4 9780 B18R2.6483 Brc1cccc(c1)CNCCc2cccnc2 270004a_100000736294_100000210085 [0,1,0,0,0,1|2,0,0]=4 9781 B18R2.6483 Brc1cccc(c1)CNCCc2ccncc2 207a_100000742849_100000210085 [0,1,0,0,0,1|2,0,0]=4 9782 B18R2.6483 Brc1cccc(c1)CNCCc2ccncc2 2230a_100000174977_100000723409 [0,1,0,0,0,1|2,0,0]=4 9783 B18R2.6483 Brc1cccc(c1)CNCCc2ccncc2 270004a_100000742849_100000210085 [0,1,0,0,0,1|2,0,0]=4 9784 B18R2.6483 Brc1cccc(c1)CNCSc2ccccc2 2230a_100000174977_100011218342 [0,1,0,0,0,1|1,0,0]=3 9785 B18R2.6483 Brc1cccc(c1)CNN=Cc2ccccc2 4a_100000686200_100015611070 [0,1,0,0,0,1|1,0,1]=4 9786 B18R2.6483 Brc1cccc(c1)COCCc2ccccc2 34a_100000210268_100000698116 [0,1,0,0,0,1|0,0,0]=2 9787 B18R2.6483 Brc1cccc(c1)COCCc2ccccc2 34a_100000687537_100000765856 [0,1,0,0,0,1|0,0,0]=2 9788 B18R2.6483 Brc1cccc(c1)COCCc2ccccc2 7a_100000210268_100000211773 [0,1,0,0,0,1|0,0,0]=2 9789 B18R2.6483 Brc1cccc(c1)COCCc2ccccc2 7a_100000687537_100000765856 [0,1,0,0,0,1|0,0,0]=2 9790 B18R2.6483 Brc1cccc(c1)COCCc2ccccn2 34a_100000210271_100000698116 [0,1,0,0,0,1|1,0,0]=3 9791 B18R2.6483 Brc1cccc(c1)COCCc2ccccn2 7a_100000687537_100015183660 [0,1,0,0,0,1|1,0,0]=3 9792 B18R2.6483 Brc1cccc(c1)COCCc2cccnc2 34a_100011217484_100000698116 [0,1,0,0,0,1|1,0,0]=3 9793 B18R2.6483 Brc1cccc(c1)COCCc2cccnc2 7a_100000687537_200011713674 [0,1,0,0,0,1|1,0,0]=3 9794 B18R2.6483 Brc1cccc(c1)COCCc2ccncc2 34a_100011216225_100000698116 [0,1,0,0,0,1|1,0,0]=3 9795 B18R2.6483 Brc1cccc(c1)COCCc2ccncc2 7a_100000687537_100000723409 [0,1,0,0,0,1|1,0,0]=3 9796 B18R2.6483 Brc1cccc(c1)COCCc2cnccn2 34a_100011349526_100000698116 [0,1,0,0,0,1|2,0,0]=4 9797 B18R2.6483 Brc1cccc(c1)COCCc2cncnc2 34a_100011709255_100000698116 [0,1,0,0,0,1|2,0,0]=4 9798 B18R2.6483 Brc1cccc(c1)CSCCc2ccccc2 62a_100000211773_100011218657 [0,1,0,0,0,1|0,1,0]=3 9799 B18R2.6483 Brc1cccc(c1)CSCCc2ccccc2 62a_100000765856_100000211773 [0,1,0,0,0,1|0,1,0]=3 9800 B18R2.6483 Brc1cccc(c1)CSCCc2ccccn2 62a_100000211773_100015183660 [0,1,0,0,0,1|1,1,0]=4 9801 B18R2.6483 Brc1cccc(c1)CSCCc2ccccn2 62a_100015183660_100000211773 [0,1,0,0,0,1|1,1,0]=4 9802 B18R2.6483 Brc1cccc(c1)CSCCc2cccnc2 62a_100000211773_200011713674 [0,1,0,0,0,1|1,1,0]=4 9803 B18R2.6483 Brc1cccc(c1)CSCCc2cccnc2 62a_200011713674_100000211773 [0,1,0,0,0,1|1,1,0]=4 9804 B18R2.6483 Brc1cccc(c1)CSCCc2ccncc2 62a_100000211773_100000723409 [0,1,0,0,0,1|1,1,0]=4 9805 B18R2.6483 Brc1cccc(c1)CSCCc2ccncc2 62a_100000723409_100000211773 [0,1,0,0,0,1|1,1,0]=4 9806 B18R2.6483 Brc1cccc(c1)CSCSc2ccccc2 62a_100000211773_100011218342 [0,1,0,0,0,1|0,1,0]=3 9807 B18R2.6483 Brc1cccc(c1)CSCSc2ccccc2 62a_100011218342_100000211773 [0,1,0,0,0,1|0,1,0]=3 9808 B18R2.6483 Brc1cccc(c1)NC/C=C/c2ccccc2 34a_100000210019_100016265936 [0,1,0,0,0,1|1,0,1]=4 9809 B18R2.6483 Brc1cccc(c1)NCC#Cc2ccccc2 34a_100000210019_100011352542 [0,1,0,0,0,1|1,0,1]=4 9810 B18R2.6483 Brc1cccc(c1)NCCCc2ccccc2 34a_100000210019_100000211621 [0,1,0,0,0,1|1,0,0]=3 9811 B18R2.6483 Brc1cccc(c1)NCCOc2ccccc2 34a_100000210019_100000184471 [0,1,0,0,0,1|2,0,0]=4 9812 B18R2.6483 Brc1cccc(c1)NCCSc2ccccc2 34a_100000210019_100000246102 [0,1,0,0,0,1|2,0,0]=4 9813 B18R2.6483 Brc1cccc(c1)NCOCc2ccccc2 34a_100000210019_100000763385 [0,1,0,0,0,1|0,0,0]=2 9814 B18R2.6483 Brc1cccc(c1)NCSCc2ccccc2 34a_100000210019_200011217039 [0,1,0,0,0,1|0,1,0]=3 9815 B18R2.6483 Brc1cccc(c1)NN=CCc2ccccc2 4a_100000217339_100000209964 [0,1,0,0,0,1|2,0,0]=4 9816 B18R2.6483 Brc1cccc(c1)OC/C=C/c2ccccc2 34a_100000210342_100016265936 [0,1,0,0,0,1|1,0,1]=4 9817 B18R2.6483 Brc1cccc(c1)OC/C=C/c2ccccc2 7a_100000210342_100016265936 [0,1,0,0,0,1|1,0,1]=4 9818 B18R2.6483 Brc1cccc(c1)OCC#Cc2ccccc2 34a_100000210342_100011352542 [0,1,0,0,0,1|1,0,1]=4 9819 B18R2.6483 Brc1cccc(c1)OCC#Cc2ccccc2 7a_100000210342_100011352542 [0,1,0,0,0,1|1,0,1]=4 9820 B18R2.6483 Brc1cccc(c1)OCCCc2ccccc2 34a_100000210342_100000211621 [0,1,0,0,0,1|1,0,0]=3 9821 B18R2.6483 Brc1cccc(c1)OCCCc2ccccc2 7a_100000210342_100000211621 [0,1,0,0,0,1|1,0,0]=3 9822 B18R2.6483 Brc1cccc(c1)OCCNc2ccccc2 34a_100000106764_100000183150 [0,1,0,0,0,1|2,0,0]=4 9823 B18R2.6483 Brc1cccc(c1)OCCOc2ccccc2 34a_100000210340_100000183150 [0,1,0,0,0,1|2,0,0]=4 9824 B18R2.6483 Brc1cccc(c1)OCCOc2ccccc2 34a_100000210342_100000184471 [0,1,0,0,0,1|2,0,0]=4 9825 B18R2.6483 Brc1cccc(c1)OCCOc2ccccc2 7a_100000210340_100000183150 [0,1,0,0,0,1|2,0,0]=4 9826 B18R2.6483 Brc1cccc(c1)OCCOc2ccccc2 7a_100000210342_100000184471 [0,1,0,0,0,1|2,0,0]=4 9827 B18R2.6483 Brc1cccc(c1)OCCSc2ccccc2 34a_100000210342_100000246102 [0,1,0,0,0,1|2,0,0]=4 9828 B18R2.6483 Brc1cccc(c1)OCCSc2ccccc2 62a_100000183150_100000041952 [0,1,0,0,0,1|2,0,0]=4 9829 B18R2.6483 Brc1cccc(c1)OCCSc2ccccc2 62a_100000719477_100000183150 [0,1,0,0,0,1|2,0,0]=4 9830 B18R2.6483 Brc1cccc(c1)OCCSc2ccccc2 7a_100000210342_100000246102 [0,1,0,0,0,1|2,0,0]=4 9831 B18R2.6483 Brc1cccc(c1)OCOCc2ccccc2 34a_100000210342_100000763385 [0,1,0,0,0,1|0,0,0]=2 9832 B18R2.6483 Brc1cccc(c1)OCSCc2ccccc2 34a_100000210342_200011217039 [0,1,0,0,0,1|0,1,0]=3 9833 B18R2.6483 Brc1cccc(c1)SC/C=C/c2ccccc2 62a_100000691529_100016265936 [0,1,0,0,0,1|1,0,1]=4 9834 B18R2.6483 Brc1cccc(c1)SC/C=C/c2ccccc2 62a_100016265936_100000691529 [0,1,0,0,0,1|1,0,1]=4 9835 B18R2.6483 Brc1cccc(c1)SCC#Cc2ccccc2 62a_100000691529_100011352542 [0,1,0,0,0,1|1,0,1]=4 9836 B18R2.6483 Brc1cccc(c1)SCCCc2ccccc2 62a_100000211621_100000691529 [0,1,0,0,0,1|1,0,0]=3 9837 B18R2.6483 Brc1cccc(c1)SCCCc2ccccc2 62a_100000691529_100000211621 [0,1,0,0,0,1|1,0,0]=3 9838 B18R2.6483 Brc1cccc(c1)SCCOc2ccccc2 62a_100000184471_100000691529 [0,1,0,0,0,1|2,0,0]=4 9839 B18R2.6483 Brc1cccc(c1)SCCOc2ccccc2 62a_100000691529_100000184471 [0,1,0,0,0,1|2,0,0]=4 9840 B18R2.6483 Brc1cccc(c1)SCCSc2ccccc2 62a_100000246102_100000691529 [0,1,0,0,0,1|2,0,0]=4 9841 B18R2.6483 Brc1cccc(c1)SCCSc2ccccc2 62a_100000691529_100000246102 [0,1,0,0,0,1|2,0,0]=4 9842 B18R2.6483 Brc1cccc(c1)SCOCc2ccccc2 62a_100000691529_100000763385 [0,1,0,0,0,1|0,0,0]=2 9843 B18R2.6483 Brc1cccc(c1)SCOCc2ccccc2 62a_100000763385_100000691529 [0,1,0,0,0,1|0,0,0]=2 9844 B18R2.6483 Brc1cccc(c1)SCSCc2ccccc2 62a_100000691529_200011217039 [0,1,0,0,0,1|0,1,0]=3 9845 B18R2.6483 Brc1cccc(c1)SCSCc2ccccc2 62a_200011217039_100000691529 [0,1,0,0,0,1|0,1,0]=3 9846 B18R2.6483 Brc1cccc(n1)CCOCc2ccccc2 34a_100010221043_100015291786 [0,1,0,0,0,1|1,0,0]=3 9847 B18R2.6483 Brc1cccc(n1)CCOCc2ccccc2 7a_100010221043_100000211182 [0,1,0,0,0,1|1,0,0]=3 9848 B18R2.6483 Brc1cccc(n1)CCOCc2ccccn2 34a_100010221043_100000721315 [0,1,0,0,0,1|2,0,0]=4 9849 B18R2.6483 Brc1cccc(n1)CCOCc2ccccn2 7a_100010221043_100000721315 [0,1,0,0,0,1|2,0,0]=4 9850 B18R2.6483 Brc1cccc(n1)CCOCc2cccnc2 34a_100010221043_100000733263 [0,1,0,0,0,1|2,0,0]=4 9851 B18R2.6483 Brc1cccc(n1)CCOCc2cccnc2 7a_100010221043_100000741622 [0,1,0,0,0,1|2,0,0]=4 9852 B18R2.6483 Brc1cccc(n1)CCOCc2ccncc2 7a_100010221043_100015193705 [0,1,0,0,0,1|2,0,0]=4 9853 B18R2.6483 Brc1cccc(n1)CNCCc2ccccc2 2230a_100000106460_100009889011 [0,1,0,0,0,1|2,0,0]=4 9854 B18R2.6483 Brc1cccc(n1)CNCCc2ccccc2 2230a_100016987751_100000765856 [0,1,0,0,0,1|2,0,0]=4 9855 B18R2.6483 Brc1cccc(n1)CNCCc2ccccc2 270004a_100000106460_100000688028 [0,1,0,0,0,1|2,0,0]=4 9856 B18R2.6483 Brc1cccc(n1)CNCCc2ccccc2 34a_100000106460_100009889011 [0,1,0,0,0,1|2,0,0]=4 9857 B18R2.6483 Brc1cccc(n1)CNCSc2ccccc2 2230a_100016987751_100011218342 [0,1,0,0,0,1|2,0,0]=4 9858 B18R2.6483 Brc1cccc(n1)COCCc2ccccc2 34a_100000210268_100009889011 [0,1,0,0,0,1|1,0,0]=3 9859 B18R2.6483 Brc1cccc(n1)COCCc2ccccc2 34a_100000694195_100000765856 [0,1,0,0,0,1|1,0,0]=3 9860 B18R2.6483 Brc1cccc(n1)COCCc2ccccc2 7a_100000210268_100009889011 [0,1,0,0,0,1|1,0,0]=3 9861 B18R2.6483 Brc1cccc(n1)COCCc2ccccn2 34a_100000210271_100009889011 [0,1,0,0,0,1|2,0,0]=4 9862 B18R2.6483 Brc1cccc(n1)COCCc2cccnc2 34a_100011217484_100009889011 [0,1,0,0,0,1|2,0,0]=4 9863 B18R2.6483 Brc1cccc(n1)COCCc2ccncc2 34a_100011216225_100009889011 [0,1,0,0,0,1|2,0,0]=4 9864 B18R2.6483 Brc1cccc(n1)CSCCc2ccccc2 62a_100000765856_100009889011 [0,1,0,0,0,1|1,1,0]=4 9865 B18R2.6483 Brc1cccc(n1)CSCCc2ccccc2 62a_100009889011_100011218657 [0,1,0,0,0,1|1,1,0]=4 9866 B18R2.6483 Brc1cccc(n1)CSCSc2ccccc2 62a_100009889011_100011218342 [0,1,0,0,0,1|1,1,0]=4 9867 B18R2.6483 Brc1cccc(n1)CSCSc2ccccc2 62a_100011218342_100009889011 [0,1,0,0,0,1|1,1,0]=4 9868 B18R2.6483 Brc1cccc(n1)SCCCc2ccccc2 62a_100000211621_100000684672 [0,1,0,0,0,1|2,0,0]=4 9869 B18R2.6483 Brc1cccc(n1)SCCCc2ccccc2 62a_100000684672_100000211621 [0,1,0,0,0,1|2,0,0]=4 9870 B18R2.6483 Brc1cccc(n1)SCOCc2ccccc2 62a_100000684672_100000763385 [0,1,0,0,0,1|1,0,0]=3 9871 B18R2.6483 Brc1cccc(n1)SCOCc2ccccc2 62a_100000763385_100000684672 [0,1,0,0,0,1|1,0,0]=3 9872 B18R2.6483 Brc1cccc(n1)SCSCc2ccccc2 62a_100000684672_200011217039 [0,1,0,0,0,1|1,1,0]=4 9873 B18R2.6483 Brc1cccc(n1)SCSCc2ccccc2 62a_200011217039_100000684672 [0,1,0,0,0,1|1,1,0]=4 9874 B18R2.6483 Brc1ccnc(c1)CNCCc2ccccc2 2230a_100000106460_100010173614 [0,1,0,0,0,1|2,0,0]=4 9875 B18R2.6483 Brc1ccnc(c1)CNCCc2ccccc2 270004a_100000106460_100009818557 [0,1,0,0,0,1|2,0,0]=4 9876 B18R2.6483 Brc1ccnc(c1)CNCCc2ccccc2 34a_100000106460_100010173614 [0,1,0,0,0,1|2,0,0]=4 9877 B18R2.6483 Brc1ccnc(c1)COCCc2ccccc2 34a_100000210268_100010173614 [0,1,0,0,0,1|1,0,0]=3 9878 B18R2.6483 Brc1ccnc(c1)COCCc2ccccc2 7a_100000210268_100010173614 [0,1,0,0,0,1|1,0,0]=3 9879 B18R2.6483 Brc1ccnc(c1)COCCc2ccccn2 34a_100000210271_100010173614 [0,1,0,0,0,1|2,0,0]=4 9880 B18R2.6483 Brc1ccnc(c1)COCCc2cccnc2 34a_100011217484_100010173614 [0,1,0,0,0,1|2,0,0]=4 9881 B18R2.6483 Brc1ccnc(c1)COCCc2ccncc2 34a_100011216225_100010173614 [0,1,0,0,0,1|2,0,0]=4 9882 B18R2.6483 Brc1ccnc(c1)CSCCc2ccccc2 62a_100000765856_100010173614 [0,1,0,0,0,1|1,1,0]=4 9883 B18R2.6483 Brc1ccnc(c1)CSCCc2ccccc2 62a_100010173614_100011218657 [0,1,0,0,0,1|1,1,0]=4 9884 B18R2.6483 Brc1ccnc(c1)CSCSc2ccccc2 62a_100010173614_100011218342 [0,1,0,0,0,1|1,1,0]=4 9885 B18R2.6483 Brc1ccnc(c1)CSCSc2ccccc2 62a_100011218342_100010173614 [0,1,0,0,0,1|1,1,0]=4 9886 B18R2.6483 Brc1cncc(c1)CNCCc2ccccc2 207a_100000106460_100000687066 [0,1,0,0,0,1|2,0,0]=4 9887 B18R2.6483 Brc1cncc(c1)CNCCc2ccccc2 2230a_100000106460_100000738771 [0,1,0,0,0,1|2,0,0]=4 9888 B18R2.6483 Brc1cncc(c1)CNCCc2ccccc2 270004a_100000106460_100000687066 [0,1,0,0,0,1|2,0,0]=4 9889 B18R2.6483 Brc1cncc(c1)CNCCc2ccccc2 34a_100000106460_100000738771 [0,1,0,0,0,1|2,0,0]=4 9890 B18R2.6483 Brc1cncc(c1)COCCc2ccccc2 34a_100000210268_100000738771 [0,1,0,0,0,1|1,0,0]=3 9891 B18R2.6483 Brc1cncc(c1)COCCc2ccccc2 34a_100011259137_100000765856 [0,1,0,0,0,1|1,0,0]=3 9892 B18R2.6483 Brc1cncc(c1)COCCc2ccccc2 7a_100000210268_100000738771 [0,1,0,0,0,1|1,0,0]=3 9893 B18R2.6483 Brc1cncc(c1)COCCc2ccccc2 7a_100011259137_100000765856 [0,1,0,0,0,1|1,0,0]=3 9894 B18R2.6483 Brc1cncc(c1)COCCc2ccccn2 34a_100000210271_100000738771 [0,1,0,0,0,1|2,0,0]=4 9895 B18R2.6483 Brc1cncc(c1)COCCc2ccccn2 7a_100011259137_100015183660 [0,1,0,0,0,1|2,0,0]=4 9896 B18R2.6483 Brc1cncc(c1)COCCc2cccnc2 34a_100011217484_100000738771 [0,1,0,0,0,1|2,0,0]=4 9897 B18R2.6483 Brc1cncc(c1)COCCc2cccnc2 7a_100011259137_200011713674 [0,1,0,0,0,1|2,0,0]=4 9898 B18R2.6483 Brc1cncc(c1)COCCc2ccncc2 34a_100011216225_100000738771 [0,1,0,0,0,1|2,0,0]=4 9899 B18R2.6483 Brc1cncc(c1)COCCc2ccncc2 7a_100011259137_100000723409 [0,1,0,0,0,1|2,0,0]=4 9900 B18R2.6483 Brc1cncc(c1)CSCCc2ccccc2 62a_100000738771_100011218657 [0,1,0,0,0,1|1,1,0]=4 9901 B18R2.6483 Brc1cncc(c1)CSCCc2ccccc2 62a_100000765856_100000738771 [0,1,0,0,0,1|1,1,0]=4 9902 B18R2.6483 Brc1cncc(c1)CSCSc2ccccc2 62a_100000738771_100011218342 [0,1,0,0,0,1|1,1,0]=4 9903 B18R2.6483 Brc1cncc(c1)CSCSc2ccccc2 62a_100011218342_100000738771 [0,1,0,0,0,1|1,1,0]=4 9904 B18R2.6483 Brc1cncc(c1)OCCCc2ccccc2 34a_100000754920_100000211621 [0,1,0,0,0,1|2,0,0]=4 9905 B18R2.6483 Brc1cncc(c1)OCCCc2ccccc2 7a_100000754920_100000211621 [0,1,0,0,0,1|2,0,0]=4 9906 B18R2.6483 Brc1cncc(c1)OCOCc2ccccc2 34a_100000754920_100000763385 [0,1,0,0,0,1|1,0,0]=3 9907 B18R2.6483 Brc1cncc(c1)OCSCc2ccccc2 34a_100000754920_200011217039 [0,1,0,0,0,1|1,1,0]=4 9908 B18R2.6483 Brc1cncc(c1)SCCCc2ccccc2 62a_100000211621_100000728054 [0,1,0,0,0,1|2,0,0]=4 9909 B18R2.6483 Brc1cncc(c1)SCCCc2ccccc2 62a_100000728054_100000211621 [0,1,0,0,0,1|2,0,0]=4 9910 B18R2.6483 Brc1cncc(c1)SCOCc2ccccc2 62a_100000728054_100000763385 [0,1,0,0,0,1|1,0,0]=3 9911 B18R2.6483 Brc1cncc(c1)SCOCc2ccccc2 62a_100000763385_100000728054 [0,1,0,0,0,1|1,0,0]=3 9912 B18R2.6483 Brc1cncc(c1)SCSCc2ccccc2 62a_100000728054_200011217039 [0,1,0,0,0,1|1,1,0]=4 9913 B18R2.6483 Brc1cncc(c1)SCSCc2ccccc2 62a_200011217039_100000728054 [0,1,0,0,0,1|1,1,0]=4 9914 B18R2.6483 C[n+]1cccc(c1)SCCCc2ccccc2 62a_100000211621_100009996589 [0,1,0,0,0,1|2,0,0]=4 9915 B18R2.6483 C[n+]1cccc(c1)SCCCc2ccccc2 62a_100009996589_100000211621 [0,1,0,0,0,1|2,0,0]=4 9916 B18R2.6483 C[n+]1cccc(c1)SCOCc2ccccc2 62a_100000763385_100009996589 [0,1,0,0,0,1|1,0,0]=3 9917 B18R2.6483 C[n+]1cccc(c1)SCOCc2ccccc2 62a_100009996589_100000763385 [0,1,0,0,0,1|1,0,0]=3 9918 B18R2.6483 C[n+]1cccc(c1)SCSCc2ccccc2 62a_100009996589_200011217039 [0,1,0,0,0,1|1,1,0]=4 9919 B18R2.6483 C[n+]1cccc(c1)SCSCc2ccccc2 62a_200011217039_100009996589 [0,1,0,0,0,1|1,1,0]=4 9920 B18R2.6483 Cc1cc(ccn1)CNCCc2ccccc2 207a_100000106460_100011361630 [0,1,0,0,0,1|2,0,0]=4 9921 B18R2.6483 Cc1cc(ccn1)CNCCc2ccccc2 2230a_100000106460_200020672517 [0,1,0,0,0,1|2,0,0]=4 9922 B18R2.6483 Cc1cc(ccn1)CNCCc2ccccc2 270004a_100000106460_100011361630 [0,1,0,0,0,1|2,0,0]=4 9923 B18R2.6483 Cc1cc(ccn1)CNCCc2ccccc2 34a_100000106460_200020672517 [0,1,0,0,0,1|2,0,0]=4 9924 B18R2.6483 Cc1cc(ccn1)CNCCc2ccccc2 34a_100011934566_100000765856 [0,1,0,0,0,1|2,0,0]=4 9925 B18R2.6483 Cc1cc(ccn1)COCCc2ccccc2 34a_100000210268_200020672517 [0,1,0,0,0,1|1,0,0]=3 9926 B18R2.6483 Cc1cc(ccn1)COCCc2ccccc2 34a_100011998630_100000765856 [0,1,0,0,0,1|1,0,0]=3 9927 B18R2.6483 Cc1cc(ccn1)COCCc2ccccc2 7a_100000210268_200020672517 [0,1,0,0,0,1|1,0,0]=3 9928 B18R2.6483 Cc1cc(ccn1)COCCc2ccccn2 34a_100000210271_200020672517 [0,1,0,0,0,1|2,0,0]=4 9929 B18R2.6483 Cc1cc(ccn1)COCCc2cccnc2 34a_100011217484_200020672517 [0,1,0,0,0,1|2,0,0]=4 9930 B18R2.6483 Cc1cc(ccn1)COCCc2ccncc2 34a_100011216225_200020672517 [0,1,0,0,0,1|2,0,0]=4 9931 B18R2.6483 Cc1cc(ccn1)CSCCc2ccccc2 62a_100000765856_200020672517 [0,1,0,0,0,1|1,1,0]=4 9932 B18R2.6483 Cc1cc(ccn1)CSCCc2ccccc2 62a_200020672517_100011218657 [0,1,0,0,0,1|1,1,0]=4 9933 B18R2.6483 Cc1cc(ccn1)CSCSc2ccccc2 62a_100011218342_200020672517 [0,1,0,0,0,1|1,1,0]=4 9934 B18R2.6483 Cc1cc(ccn1)CSCSc2ccccc2 62a_200020672517_100011218342 [0,1,0,0,0,1|1,1,0]=4 9935 B18R2.6483 Cc1cc(ccn1)NCCCc2ccccc2 27a_100000211184_100000758586 [0,1,0,0,0,1|2,0,0]=4 9936 B18R2.6483 Cc1cc(ccn1)OCCCc2ccccc2 34a_100000688365_100000211621 [0,1,0,0,0,1|2,0,0]=4 9937 B18R2.6483 Cc1cc(ccn1)OCOCc2ccccc2 34a_100000688365_100000763385 [0,1,0,0,0,1|1,0,0]=3 9938 B18R2.6483 Cc1cc(ccn1)OCSCc2ccccc2 34a_100000688365_200011217039 [0,1,0,0,0,1|1,1,0]=4 9939 B18R2.6483 Cc1cc(ccn1)SCCCc2ccccc2 62a_100000211621_100000758586 [0,1,0,0,0,1|2,0,0]=4 9940 B18R2.6483 Cc1cc(ccn1)SCCCc2ccccc2 62a_100000758586_100000211621 [0,1,0,0,0,1|2,0,0]=4 9941 B18R2.6483 Cc1cc(ccn1)SCOCc2ccccc2 62a_100000758586_100000763385 [0,1,0,0,0,1|1,0,0]=3 9942 B18R2.6483 Cc1cc(ccn1)SCOCc2ccccc2 62a_100000763385_100000758586 [0,1,0,0,0,1|1,0,0]=3 9943 B18R2.6483 Cc1cc(ccn1)SCSCc2ccccc2 62a_100000758586_200011217039 [0,1,0,0,0,1|1,1,0]=4 9944 B18R2.6483 Cc1cc(ccn1)SCSCc2ccccc2 62a_200011217039_100000758586 [0,1,0,0,0,1|1,1,0]=4 9945 B18R2.6483 Cc1cc(ncn1)SCOCc2ccccc2 62a_100000744208_100000763385 [0,1,0,0,0,1|2,0,0]=4 9946 B18R2.6483 Cc1cc(ncn1)SCOCc2ccccc2 62a_100000763385_100000744208 [0,1,0,0,0,1|2,0,0]=4 9947 B18R2.6483 Cc1cccc(c1)C=NNCc2ccccc2 4a_100000007032_100000211157 [0,1,0,0,0,1|1,0,1]=4 9948 B18R2.6483 Cc1cccc(c1)CCNCc2ccccc2 207a_100000749837_100015611070 [0,1,0,0,0,1|1,0,0]=3 9949 B18R2.6483 Cc1cccc(c1)CCNCc2ccccc2 2230a_100000749837_100015291786 [0,1,0,0,0,1|1,0,0]=3 9950 B18R2.6483 Cc1cccc(c1)CCNCc2ccccc2 2230a_100015324214_100011713685 [0,1,0,0,0,1|1,0,0]=3 9951 B18R2.6483 Cc1cccc(c1)CCNCc2ccccc2 270004a_100000749837_100015611070 [0,1,0,0,0,1|1,0,0]=3 9952 B18R2.6483 Cc1cccc(c1)CCNCc2ccccc2 34a_100000749837_100015291786 [0,1,0,0,0,1|1,0,0]=3 9953 B18R2.6483 Cc1cccc(c1)CCNCc2ccccc2 34a_100015324214_100011713685 [0,1,0,0,0,1|1,0,0]=3 9954 B18R2.6483 Cc1cccc(c1)CCNCc2ccccn2 207a_100000749837_100000209966 [0,1,0,0,0,1|2,0,0]=4 9955 B18R2.6483 Cc1cccc(c1)CCNCc2ccccn2 2230a_100000749837_100000721315 [0,1,0,0,0,1|2,0,0]=4 9956 B18R2.6483 Cc1cccc(c1)CCNCc2ccccn2 270004a_100000749837_100000209966 [0,1,0,0,0,1|2,0,0]=4 9957 B18R2.6483 Cc1cccc(c1)CCNCc2ccccn2 34a_100000749837_100000721315 [0,1,0,0,0,1|2,0,0]=4 9958 B18R2.6483 Cc1cccc(c1)CCNCc2cccnc2 207a_100000749837_100000209961 [0,1,0,0,0,1|2,0,0]=4 9959 B18R2.6483 Cc1cccc(c1)CCNCc2cccnc2 2230a_100000749837_100000741622 [0,1,0,0,0,1|2,0,0]=4 9960 B18R2.6483 Cc1cccc(c1)CCNCc2cccnc2 270004a_100000749837_100000209961 [0,1,0,0,0,1|2,0,0]=4 9961 B18R2.6483 Cc1cccc(c1)CCNCc2cccnc2 34a_100000749837_100000733263 [0,1,0,0,0,1|2,0,0]=4 9962 B18R2.6483 Cc1cccc(c1)CCNCc2ccncc2 207a_100000749837_100000186114 [0,1,0,0,0,1|2,0,0]=4 9963 B18R2.6483 Cc1cccc(c1)CCNCc2ccncc2 2230a_100000749837_100015193705 [0,1,0,0,0,1|2,0,0]=4 9964 B18R2.6483 Cc1cccc(c1)CCOCc2ccccc2 34a_100000210790_100011713685 [0,1,0,0,0,1|0,0,0]=2 9965 B18R2.6483 Cc1cccc(c1)CCOCc2ccccc2 34a_100011217157_100015291786 [0,1,0,0,0,1|0,0,0]=2 9966 B18R2.6483 Cc1cccc(c1)CCOCc2ccccc2 7a_100000210790_100011713685 [0,1,0,0,0,1|0,0,0]=2 9967 B18R2.6483 Cc1cccc(c1)CCOCc2ccccc2 7a_100011217157_100000211182 [0,1,0,0,0,1|0,0,0]=2 9968 B18R2.6483 Cc1cccc(c1)CCOCc2ccccn2 34a_100011217157_100000721315 [0,1,0,0,0,1|1,0,0]=3 9969 B18R2.6483 Cc1cccc(c1)CCOCc2ccccn2 7a_100011217157_100000721315 [0,1,0,0,0,1|1,0,0]=3 9970 B18R2.6483 Cc1cccc(c1)CCOCc2cccnc2 34a_100011217157_100000733263 [0,1,0,0,0,1|1,0,0]=3 9971 B18R2.6483 Cc1cccc(c1)CCOCc2cccnc2 7a_100011217157_100000741622 [0,1,0,0,0,1|1,0,0]=3 9972 B18R2.6483 Cc1cccc(c1)CCOCc2cccnn2 34a_100011217157_100016990269 [0,1,0,0,0,1|2,0,0]=4 9973 B18R2.6483 Cc1cccc(c1)CCOCc2cccnn2 7a_100011217157_100016990269 [0,1,0,0,0,1|2,0,0]=4 9974 B18R2.6483 Cc1cccc(c1)CCOCc2ccncc2 7a_100011217157_100015193705 [0,1,0,0,0,1|1,0,0]=3 9975 B18R2.6483 Cc1cccc(c1)CCOCc2cnccn2 34a_100011217157_100016995436 [0,1,0,0,0,1|2,0,0]=4 9976 B18R2.6483 Cc1cccc(c1)CCOCc2cnccn2 7a_100011217157_100016995436 [0,1,0,0,0,1|2,0,0]=4 9977 B18R2.6483 Cc1cccc(c1)CCOCc2cncnc2 34a_100011217157_100015196519 [0,1,0,0,0,1|2,0,0]=4 9978 B18R2.6483 Cc1cccc(c1)CCOCc2cncnc2 7a_100011217157_100015196519 [0,1,0,0,0,1|2,0,0]=4 9979 B18R2.6483 Cc1cccc(c1)CCOCc2ncccn2 34a_100011217157_100000703007 [0,1,0,0,0,1|2,0,0]=4 9980 B18R2.6483 Cc1cccc(c1)CCOCc2ncccn2 7a_100011217157_100000703007 [0,1,0,0,0,1|2,0,0]=4 9981 B18R2.6483 Cc1cccc(c1)CCSCc2ccccc2 62a_100000211182_100011713685 [0,1,0,0,0,1|0,1,0]=3 9982 B18R2.6483 Cc1cccc(c1)CCSCc2ccccc2 62a_100011713685_100015291786 [0,1,0,0,0,1|0,1,0]=3 9983 B18R2.6483 Cc1cccc(c1)CCSCc2ccccn2 62a_100000721315_100011713685 [0,1,0,0,0,1|1,1,0]=4 9984 B18R2.6483 Cc1cccc(c1)CCSCc2ccccn2 62a_100011713685_100000721315 [0,1,0,0,0,1|1,1,0]=4 9985 B18R2.6483 Cc1cccc(c1)CCSCc2cccnc2 62a_100000741622_100011713685 [0,1,0,0,0,1|1,1,0]=4 9986 B18R2.6483 Cc1cccc(c1)CCSCc2cccnc2 62a_100011713685_100000741622 [0,1,0,0,0,1|1,1,0]=4 9987 B18R2.6483 Cc1cccc(c1)CCSCc2ccncc2 62a_100011713685_100015193705 [0,1,0,0,0,1|1,1,0]=4 9988 B18R2.6483 Cc1cccc(c1)CCSCc2ccncc2 62a_100015193705_100011713685 [0,1,0,0,0,1|1,1,0]=4 9989 B18R2.6483 Cc1cccc(c1)CNCCc2ccccc2 207a_100000106460_100000211157 [0,1,0,0,0,1|1,0,0]=3 9990 B18R2.6483 Cc1cccc(c1)CNCCc2ccccc2 2230a_100000106460_100000211840 [0,1,0,0,0,1|1,0,0]=3 9991 B18R2.6483 Cc1cccc(c1)CNCCc2ccccc2 2230a_100000185548_100000765856 [0,1,0,0,0,1|1,0,0]=3 9992 B18R2.6483 Cc1cccc(c1)CNCCc2ccccc2 270004a_100000106460_100000211157 [0,1,0,0,0,1|1,0,0]=3 9993 B18R2.6483 Cc1cccc(c1)CNCCc2ccccc2 34a_100000106460_100000211840 [0,1,0,0,0,1|1,0,0]=3 9994 B18R2.6483 Cc1cccc(c1)CNCCc2ccccc2 34a_100000185548_100000765856 [0,1,0,0,0,1|1,0,0]=3 9995 B18R2.6483 Cc1cccc(c1)CNCCc2ccccn2 207a_100000211156_100000211157 [0,1,0,0,0,1|2,0,0]=4 9996 B18R2.6483 Cc1cccc(c1)CNCCc2ccccn2 2230a_100000185548_100015183660 [0,1,0,0,0,1|2,0,0]=4 9997 B18R2.6483 Cc1cccc(c1)CNCCc2ccccn2 270004a_100000211156_100000211157 [0,1,0,0,0,1|2,0,0]=4 9998 B18R2.6483 Cc1cccc(c1)CNCCc2cccnc2 207a_100000736294_100000211157 [0,1,0,0,0,1|2,0,0]=4 9999 B18R2.6483 Cc1cccc(c1)CNCCc2cccnc2 2230a_100000185548_200011713674 [0,1,0,0,0,1|2,0,0]=4 10000 B18R2.6483 Cc1cccc(c1)CNCCc2cccnc2 2230a_100000736294_100000211840 [0,1,0,0,0,1|2,0,0]=4 10001 B18R2.6483 Cc1cccc(c1)CNCCc2cccnc2 270004a_100000736294_100000211157 [0,1,0,0,0,1|2,0,0]=4 10002 B18R2.6483 Cc1cccc(c1)CNCCc2ccncc2 207a_100000742849_100000211157 [0,1,0,0,0,1|2,0,0]=4 10003 B18R2.6483 Cc1cccc(c1)CNCCc2ccncc2 2230a_100000185548_100000723409 [0,1,0,0,0,1|2,0,0]=4 10004 B18R2.6483 Cc1cccc(c1)CNCCc2ccncc2 270004a_100000742849_100000211157 [0,1,0,0,0,1|2,0,0]=4 10005 B18R2.6483 Cc1cccc(c1)CNCSc2ccccc2 2230a_100000185548_100011218342 [0,1,0,0,0,1|1,0,0]=3 10006 B18R2.6483 Cc1cccc(c1)COCCc2ccccc2 34a_100000210268_100000211840 [0,1,0,0,0,1|0,0,0]=2 10007 B18R2.6483 Cc1cccc(c1)COCCc2ccccc2 34a_100011217746_100000765856 [0,1,0,0,0,1|0,0,0]=2 10008 B18R2.6483 Cc1cccc(c1)COCCc2ccccc2 7a_100000210268_100000211840 [0,1,0,0,0,1|0,0,0]=2 10009 B18R2.6483 Cc1cccc(c1)COCCc2ccccc2 7a_100011217746_100000765856 [0,1,0,0,0,1|0,0,0]=2 10010 B18R2.6483 Cc1cccc(c1)COCCc2ccccn2 34a_100000210271_100000211840 [0,1,0,0,0,1|1,0,0]=3 10011 B18R2.6483 Cc1cccc(c1)COCCc2ccccn2 7a_100011217746_100015183660 [0,1,0,0,0,1|1,0,0]=3 10012 B18R2.6483 Cc1cccc(c1)COCCc2cccnc2 34a_100011217484_100000211840 [0,1,0,0,0,1|1,0,0]=3 10013 B18R2.6483 Cc1cccc(c1)COCCc2cccnc2 7a_100011217746_200011713674 [0,1,0,0,0,1|1,0,0]=3 10014 B18R2.6483 Cc1cccc(c1)COCCc2ccncc2 34a_100011216225_100000211840 [0,1,0,0,0,1|1,0,0]=3 10015 B18R2.6483 Cc1cccc(c1)COCCc2ccncc2 7a_100011217746_100000723409 [0,1,0,0,0,1|1,0,0]=3 10016 B18R2.6483 Cc1cccc(c1)COCCc2cnccn2 34a_100011349526_100000211840 [0,1,0,0,0,1|2,0,0]=4 10017 B18R2.6483 Cc1cccc(c1)COCCc2cncnc2 34a_100011709255_100000211840 [0,1,0,0,0,1|2,0,0]=4 10018 B18R2.6483 Cc1cccc(c1)CSCCc2ccccc2 62a_100000211840_100011218657 [0,1,0,0,0,1|0,1,0]=3 10019 B18R2.6483 Cc1cccc(c1)CSCCc2ccccc2 62a_100000765856_100000211840 [0,1,0,0,0,1|0,1,0]=3 10020 B18R2.6483 Cc1cccc(c1)CSCCc2ccccn2 62a_100000211840_100015183660 [0,1,0,0,0,1|1,1,0]=4 10021 B18R2.6483 Cc1cccc(c1)CSCCc2ccccn2 62a_100015183660_100000211840 [0,1,0,0,0,1|1,1,0]=4 10022 B18R2.6483 Cc1cccc(c1)CSCCc2cccnc2 62a_100000211840_200011713674 [0,1,0,0,0,1|1,1,0]=4 10023 B18R2.6483 Cc1cccc(c1)CSCCc2cccnc2 62a_200011713674_100000211840 [0,1,0,0,0,1|1,1,0]=4 10024 B18R2.6483 Cc1cccc(c1)CSCCc2ccncc2 62a_100000211840_100000723409 [0,1,0,0,0,1|1,1,0]=4 10025 B18R2.6483 Cc1cccc(c1)CSCCc2ccncc2 62a_100000723409_100000211840 [0,1,0,0,0,1|1,1,0]=4 10026 B18R2.6483 Cc1cccc(c1)CSCSc2ccccc2 62a_100000211840_100011218342 [0,1,0,0,0,1|0,1,0]=3 10027 B18R2.6483 Cc1cccc(c1)CSCSc2ccccc2 62a_100011218342_100000211840 [0,1,0,0,0,1|0,1,0]=3 10028 B18R2.6483 Cc1cccc(c1)NC/C=C/c2ccccc2 2230a_100000188690_100016265936 [0,1,0,0,0,1|1,0,1]=4 10029 B18R2.6483 Cc1cccc(c1)NC/C=C/c2ccccc2 34a_100000188690_100016265936 [0,1,0,0,0,1|1,0,1]=4 10030 B18R2.6483 Cc1cccc(c1)NCC#Cc2ccccc2 2230a_100000188690_100011352542 [0,1,0,0,0,1|1,0,1]=4 10031 B18R2.6483 Cc1cccc(c1)NCC#Cc2ccccc2 34a_100000188690_100011352542 [0,1,0,0,0,1|1,0,1]=4 10032 B18R2.6483 Cc1cccc(c1)NCCCc2ccccc2 2230a_100000188690_100000211621 [0,1,0,0,0,1|1,0,0]=3 10033 B18R2.6483 Cc1cccc(c1)NCCCc2ccccc2 34a_100000188690_100000211621 [0,1,0,0,0,1|1,0,0]=3 10034 B18R2.6483 Cc1cccc(c1)NCCOc2ccccc2 2230a_100000188690_100000184471 [0,1,0,0,0,1|2,0,0]=4 10035 B18R2.6483 Cc1cccc(c1)NCCOc2ccccc2 34a_100000188690_100000184471 [0,1,0,0,0,1|2,0,0]=4 10036 B18R2.6483 Cc1cccc(c1)NCCSc2ccccc2 2230a_100000188690_100000246102 [0,1,0,0,0,1|2,0,0]=4 10037 B18R2.6483 Cc1cccc(c1)NCCSc2ccccc2 34a_100000188690_100000246102 [0,1,0,0,0,1|2,0,0]=4 10038 B18R2.6483 Cc1cccc(c1)NCOCc2ccccc2 2230a_100000188690_100000763385 [0,1,0,0,0,1|0,0,0]=2 10039 B18R2.6483 Cc1cccc(c1)NCOCc2ccccc2 34a_100000188690_100000763385 [0,1,0,0,0,1|0,0,0]=2 10040 B18R2.6483 Cc1cccc(c1)NCSCc2ccccc2 2230a_100000188690_200011217039 [0,1,0,0,0,1|0,1,0]=3 10041 B18R2.6483 Cc1cccc(c1)NCSCc2ccccc2 34a_100000188690_200011217039 [0,1,0,0,0,1|0,1,0]=3 10042 B18R2.6483 Cc1cccc(c1)NN=CCc2ccccc2 4a_100000681630_100000209964 [0,1,0,0,0,1|2,0,0]=4 10043 B18R2.6483 Cc1cccc(c1)OC/C=C/c2ccccc2 34a_100000210337_100016265936 [0,1,0,0,0,1|1,0,1]=4 10044 B18R2.6483 Cc1cccc(c1)OC/C=C/c2ccccc2 7a_100000210337_100016265936 [0,1,0,0,0,1|1,0,1]=4 10045 B18R2.6483 Cc1cccc(c1)OCC#Cc2ccccc2 34a_100000210337_100011352542 [0,1,0,0,0,1|1,0,1]=4 10046 B18R2.6483 Cc1cccc(c1)OCC#Cc2ccccc2 7a_100000210337_100011352542 [0,1,0,0,0,1|1,0,1]=4 10047 B18R2.6483 Cc1cccc(c1)OCCCc2ccccc2 34a_100000210337_100000211621 [0,1,0,0,0,1|1,0,0]=3 10048 B18R2.6483 Cc1cccc(c1)OCCCc2ccccc2 7a_100000210337_100000211621 [0,1,0,0,0,1|1,0,0]=3 10049 B18R2.6483 Cc1cccc(c1)OCCOc2ccccc2 34a_100000210337_100000184471 [0,1,0,0,0,1|2,0,0]=4 10050 B18R2.6483 Cc1cccc(c1)OCCOc2ccccc2 7a_100000210337_100000184471 [0,1,0,0,0,1|2,0,0]=4 10051 B18R2.6483 Cc1cccc(c1)OCCSc2ccccc2 34a_100000210337_100000246102 [0,1,0,0,0,1|2,0,0]=4 10052 B18R2.6483 Cc1cccc(c1)OCCSc2ccccc2 7a_100000210337_100000246102 [0,1,0,0,0,1|2,0,0]=4 10053 B18R2.6483 Cc1cccc(c1)OCOCc2ccccc2 34a_100000210337_100000763385 [0,1,0,0,0,1|0,0,0]=2 10054 B18R2.6483 Cc1cccc(c1)OCSCc2ccccc2 34a_100000210337_200011217039 [0,1,0,0,0,1|0,1,0]=3 10055 B18R2.6483 Cc1cccc(c1)SC/C=C/c2ccccc2 62a_100011215228_100016265936 [0,1,0,0,0,1|1,0,1]=4 10056 B18R2.6483 Cc1cccc(c1)SC/C=C/c2ccccc2 62a_100016265936_100011215228 [0,1,0,0,0,1|1,0,1]=4 10057 B18R2.6483 Cc1cccc(c1)SCC#Cc2ccccc2 62a_100011215228_100011352542 [0,1,0,0,0,1|1,0,1]=4 10058 B18R2.6483 Cc1cccc(c1)SCCCc2ccccc2 62a_100000211621_100011215228 [0,1,0,0,0,1|1,0,0]=3 10059 B18R2.6483 Cc1cccc(c1)SCCCc2ccccc2 62a_100011215228_100000211621 [0,1,0,0,0,1|1,0,0]=3 10060 B18R2.6483 Cc1cccc(c1)SCCOc2ccccc2 62a_100000184471_100011215228 [0,1,0,0,0,1|2,0,0]=4 10061 B18R2.6483 Cc1cccc(c1)SCCOc2ccccc2 62a_100011215228_100000184471 [0,1,0,0,0,1|2,0,0]=4 10062 B18R2.6483 Cc1cccc(c1)SCCSc2ccccc2 62a_100000246102_100011215228 [0,1,0,0,0,1|2,0,0]=4 10063 B18R2.6483 Cc1cccc(c1)SCCSc2ccccc2 62a_100011215228_100000246102 [0,1,0,0,0,1|2,0,0]=4 10064 B18R2.6483 Cc1cccc(c1)SCOCc2ccccc2 62a_100000763385_100011215228 [0,1,0,0,0,1|0,0,0]=2 10065 B18R2.6483 Cc1cccc(c1)SCOCc2ccccc2 62a_100011215228_100000763385 [0,1,0,0,0,1|0,0,0]=2 10066 B18R2.6483 Cc1cccc(c1)SCSCc2ccccc2 62a_100011215228_200011217039 [0,1,0,0,0,1|0,1,0]=3 10067 B18R2.6483 Cc1cccc(c1)SCSCc2ccccc2 62a_200011217039_100011215228 [0,1,0,0,0,1|0,1,0]=3 10068 B18R2.6483 Cc1cccc(n1)CCNCc2ccccc2 207a_100011824523_100015611070 [0,1,0,0,0,1|2,0,0]=4 10069 B18R2.6483 Cc1cccc(n1)CCNCc2ccccc2 2230a_100011824523_100015291786 [0,1,0,0,0,1|2,0,0]=4 10070 B18R2.6483 Cc1cccc(n1)CCNCc2ccccc2 270004a_100011824523_100015611070 [0,1,0,0,0,1|2,0,0]=4 10071 B18R2.6483 Cc1cccc(n1)CCNCc2ccccc2 34a_100011824523_100015291786 [0,1,0,0,0,1|2,0,0]=4 10072 B18R2.6483 Cc1cccc(n1)CNCCc2ccccc2 207a_100000106460_100011215050 [0,1,0,0,0,1|2,0,0]=4 10073 B18R2.6483 Cc1cccc(n1)CNCCc2ccccc2 2230a_100000106460_100000757606 [0,1,0,0,0,1|2,0,0]=4 10074 B18R2.6483 Cc1cccc(n1)CNCCc2ccccc2 270004a_100000106460_100011215050 [0,1,0,0,0,1|2,0,0]=4 10075 B18R2.6483 Cc1cccc(n1)CNCCc2ccccc2 34a_100000106460_100000757606 [0,1,0,0,0,1|2,0,0]=4 10076 B18R2.6483 Cc1cccc(n1)CNCCc2ccccc2 34a_100000701342_100000765856 [0,1,0,0,0,1|2,0,0]=4 10077 B18R2.6483 Cc1cccc(n1)COCCc2ccccc2 34a_100000210268_100000757606 [0,1,0,0,0,1|1,0,0]=3 10078 B18R2.6483 Cc1cccc(n1)COCCc2ccccc2 34a_100000690600_100000765856 [0,1,0,0,0,1|1,0,0]=3 10079 B18R2.6483 Cc1cccc(n1)COCCc2ccccc2 7a_100000210268_100000757606 [0,1,0,0,0,1|1,0,0]=3 10080 B18R2.6483 Cc1cccc(n1)COCCc2ccccn2 34a_100000210271_100000757606 [0,1,0,0,0,1|2,0,0]=4 10081 B18R2.6483 Cc1cccc(n1)COCCc2cccnc2 34a_100011217484_100000757606 [0,1,0,0,0,1|2,0,0]=4 10082 B18R2.6483 Cc1cccc(n1)COCCc2ccncc2 34a_100011216225_100000757606 [0,1,0,0,0,1|2,0,0]=4 10083 B18R2.6483 Cc1cccc(n1)CSCCc2ccccc2 62a_100000757606_100011218657 [0,1,0,0,0,1|1,1,0]=4 10084 B18R2.6483 Cc1cccc(n1)CSCCc2ccccc2 62a_100000765856_100000757606 [0,1,0,0,0,1|1,1,0]=4 10085 B18R2.6483 Cc1cccc(n1)CSCSc2ccccc2 62a_100000757606_100011218342 [0,1,0,0,0,1|1,1,0]=4 10086 B18R2.6483 Cc1cccc(n1)CSCSc2ccccc2 62a_100011218342_100000757606 [0,1,0,0,0,1|1,1,0]=4 10087 B18R2.6483 Cc1cccc(n1)SCCCc2ccccc2 62a_100000211621_100000742759 [0,1,0,0,0,1|2,0,0]=4 10088 B18R2.6483 Cc1cccc(n1)SCCCc2ccccc2 62a_100000742759_100000211621 [0,1,0,0,0,1|2,0,0]=4 10089 B18R2.6483 Cc1cccc(n1)SCOCc2ccccc2 62a_100000742759_100000763385 [0,1,0,0,0,1|1,0,0]=3 10090 B18R2.6483 Cc1cccc(n1)SCOCc2ccccc2 62a_100000763385_100000742759 [0,1,0,0,0,1|1,0,0]=3 10091 B18R2.6483 Cc1cccc(n1)SCSCc2ccccc2 62a_100000742759_200011217039 [0,1,0,0,0,1|1,1,0]=4 10092 B18R2.6483 Cc1cccc(n1)SCSCc2ccccc2 62a_200011217039_100000742759 [0,1,0,0,0,1|1,1,0]=4 10093 B18R2.6483 Cc1ccnc(c1)CNCCc2ccccc2 207a_100000106460_100011361488 [0,1,0,0,0,1|2,0,0]=4 10094 B18R2.6483 Cc1ccnc(c1)CNCCc2ccccc2 2230a_100000106460_100000718516 [0,1,0,0,0,1|2,0,0]=4 10095 B18R2.6483 Cc1ccnc(c1)CNCCc2ccccc2 270004a_100000106460_100011361488 [0,1,0,0,0,1|2,0,0]=4 10096 B18R2.6483 Cc1ccnc(c1)CNCCc2ccccc2 34a_100000106460_100000718516 [0,1,0,0,0,1|2,0,0]=4 10097 B18R2.6483 Cc1ccnc(c1)COCCc2ccccc2 34a_100000210268_100000718516 [0,1,0,0,0,1|1,0,0]=3 10098 B18R2.6483 Cc1ccnc(c1)COCCc2ccccc2 34a_100011998357_100000765856 [0,1,0,0,0,1|1,0,0]=3 10099 B18R2.6483 Cc1ccnc(c1)COCCc2ccccc2 7a_100000210268_100000718516 [0,1,0,0,0,1|1,0,0]=3 10100 B18R2.6483 Cc1ccnc(c1)COCCc2ccccn2 34a_100000210271_100000718516 [0,1,0,0,0,1|2,0,0]=4 10101 B18R2.6483 Cc1ccnc(c1)COCCc2cccnc2 34a_100011217484_100000718516 [0,1,0,0,0,1|2,0,0]=4 10102 B18R2.6483 Cc1ccnc(c1)COCCc2ccncc2 34a_100011216225_100000718516 [0,1,0,0,0,1|2,0,0]=4 10103 B18R2.6483 Cc1ccnc(c1)CSCCc2ccccc2 62a_100000718516_100011218657 [0,1,0,0,0,1|1,1,0]=4 10104 B18R2.6483 Cc1ccnc(c1)CSCCc2ccccc2 62a_100000765856_100000718516 [0,1,0,0,0,1|1,1,0]=4 10105 B18R2.6483 Cc1ccnc(c1)CSCSc2ccccc2 62a_100000718516_100011218342 [0,1,0,0,0,1|1,1,0]=4 10106 B18R2.6483 Cc1ccnc(c1)CSCSc2ccccc2 62a_100011218342_100000718516 [0,1,0,0,0,1|1,1,0]=4 10107 B18R2.6483 Cc1ccnc(c1)SCCCc2ccccc2 62a_100000211621_100000750283 [0,1,0,0,0,1|2,0,0]=4 10108 B18R2.6483 Cc1ccnc(c1)SCCCc2ccccc2 62a_100000750283_100000211621 [0,1,0,0,0,1|2,0,0]=4 10109 B18R2.6483 Cc1ccnc(c1)SCOCc2ccccc2 62a_100000750283_100000763385 [0,1,0,0,0,1|1,0,0]=3 10110 B18R2.6483 Cc1ccnc(c1)SCOCc2ccccc2 62a_100000763385_100000750283 [0,1,0,0,0,1|1,0,0]=3 10111 B18R2.6483 Cc1ccnc(c1)SCSCc2ccccc2 62a_100000750283_200011217039 [0,1,0,0,0,1|1,1,0]=4 10112 B18R2.6483 Cc1ccnc(c1)SCSCc2ccccc2 62a_200011217039_100000750283 [0,1,0,0,0,1|1,1,0]=4 10113 B18R2.6483 Cc1ccnc(n1)SCOCc2ccccc2 62a_100000763385_100011243806 [0,1,0,0,0,1|2,0,0]=4 10114 B18R2.6483 Cc1ccnc(n1)SCOCc2ccccc2 62a_100011243806_100000763385 [0,1,0,0,0,1|2,0,0]=4 10115 B18R2.6483 Cc1cncc(c1)CNCCc2ccccc2 207a_100000106460_100011998712 [0,1,0,0,0,1|2,0,0]=4 10116 B18R2.6483 Cc1cncc(c1)CNCCc2ccccc2 2230a_100000106460_100000716715 [0,1,0,0,0,1|2,0,0]=4 10117 B18R2.6483 Cc1cncc(c1)CNCCc2ccccc2 2230a_100000692839_100000765856 [0,1,0,0,0,1|2,0,0]=4 10118 B18R2.6483 Cc1cncc(c1)CNCCc2ccccc2 270004a_100000106460_100011998712 [0,1,0,0,0,1|2,0,0]=4 10119 B18R2.6483 Cc1cncc(c1)CNCCc2ccccc2 34a_100000106460_100000716715 [0,1,0,0,0,1|2,0,0]=4 10120 B18R2.6483 Cc1cncc(c1)CNCCc2ccccc2 34a_100000692839_100000765856 [0,1,0,0,0,1|2,0,0]=4 10121 B18R2.6483 Cc1cncc(c1)CNCSc2ccccc2 2230a_100000692839_100011218342 [0,1,0,0,0,1|2,0,0]=4 10122 B18R2.6483 Cc1cncc(c1)COCCc2ccccc2 34a_100000210268_100000716715 [0,1,0,0,0,1|1,0,0]=3 10123 B18R2.6483 Cc1cncc(c1)COCCc2ccccc2 34a_100011998709_100000765856 [0,1,0,0,0,1|1,0,0]=3 10124 B18R2.6483 Cc1cncc(c1)COCCc2ccccc2 7a_100000210268_100000716715 [0,1,0,0,0,1|1,0,0]=3 10125 B18R2.6483 Cc1cncc(c1)COCCc2ccccc2 7a_100011998709_100000765856 [0,1,0,0,0,1|1,0,0]=3 10126 B18R2.6483 Cc1cncc(c1)COCCc2ccccn2 34a_100000210271_100000716715 [0,1,0,0,0,1|2,0,0]=4 10127 B18R2.6483 Cc1cncc(c1)COCCc2ccccn2 7a_100011998709_100015183660 [0,1,0,0,0,1|2,0,0]=4 10128 B18R2.6483 Cc1cncc(c1)COCCc2cccnc2 34a_100011217484_100000716715 [0,1,0,0,0,1|2,0,0]=4 10129 B18R2.6483 Cc1cncc(c1)COCCc2cccnc2 7a_100011998709_200011713674 [0,1,0,0,0,1|2,0,0]=4 10130 B18R2.6483 Cc1cncc(c1)COCCc2ccncc2 34a_100011216225_100000716715 [0,1,0,0,0,1|2,0,0]=4 10131 B18R2.6483 Cc1cncc(c1)COCCc2ccncc2 7a_100011998709_100000723409 [0,1,0,0,0,1|2,0,0]=4 10132 B18R2.6483 Cc1cncc(c1)CSCCc2ccccc2 62a_100000716715_100011218657 [0,1,0,0,0,1|1,1,0]=4 10133 B18R2.6483 Cc1cncc(c1)CSCCc2ccccc2 62a_100000765856_100000716715 [0,1,0,0,0,1|1,1,0]=4 10134 B18R2.6483 Cc1cncc(c1)CSCSc2ccccc2 62a_100000716715_100011218342 [0,1,0,0,0,1|1,1,0]=4 10135 B18R2.6483 Cc1cncc(c1)CSCSc2ccccc2 62a_100011218342_100000716715 [0,1,0,0,0,1|1,1,0]=4 10136 B18R2.6483 Cc1cncc(c1)OCCCc2ccccc2 34a_100011830280_100000211621 [0,1,0,0,0,1|2,0,0]=4 10137 B18R2.6483 Cc1cncc(c1)OCCCc2ccccc2 7a_100011830280_100000211621 [0,1,0,0,0,1|2,0,0]=4 10138 B18R2.6483 Cc1cncc(c1)OCOCc2ccccc2 34a_100011830280_100000763385 [0,1,0,0,0,1|1,0,0]=3 10139 B18R2.6483 Cc1cncc(c1)OCSCc2ccccc2 34a_100011830280_200011217039 [0,1,0,0,0,1|1,1,0]=4 10140 B18R2.6483 Cc1cncc(c1)SCCCc2ccccc2 62a_100000211621_100000760492 [0,1,0,0,0,1|2,0,0]=4 10141 B18R2.6483 Cc1cncc(c1)SCCCc2ccccc2 62a_100000760492_100000211621 [0,1,0,0,0,1|2,0,0]=4 10142 B18R2.6483 Cc1cncc(c1)SCOCc2ccccc2 62a_100000760492_100000763385 [0,1,0,0,0,1|1,0,0]=3 10143 B18R2.6483 Cc1cncc(c1)SCOCc2ccccc2 62a_100000763385_100000760492 [0,1,0,0,0,1|1,0,0]=3 10144 B18R2.6483 Cc1cncc(c1)SCSCc2ccccc2 62a_100000760492_200011217039 [0,1,0,0,0,1|1,1,0]=4 10145 B18R2.6483 Cc1cncc(c1)SCSCc2ccccc2 62a_200011217039_100000760492 [0,1,0,0,0,1|1,1,0]=4 10146 B18R2.6483 Cc1cncc(n1)SCOCc2ccccc2 62a_100000754123_100000763385 [0,1,0,0,0,1|2,0,0]=4 10147 B18R2.6483 Cc1cncc(n1)SCOCc2ccccc2 62a_100000763385_100000754123 [0,1,0,0,0,1|2,0,0]=4 10148 B18R2.6483 Cc1cnnc(c1)COCCc2ccccc2 34a_100016212594_100000765856 [0,1,0,0,0,1|2,0,0]=4 10149 B18R2.6483 Cc1cnnc(c1)OCOCc2ccccc2 34a_100000766097_100000763385 [0,1,0,0,0,1|2,0,0]=4 10150 B18R2.6483 Cc1cnnc(c1)SCOCc2ccccc2 62a_100000070100_100000763385 [0,1,0,0,0,1|2,0,0]=4 10151 B18R2.6483 Cc1cnnc(c1)SCOCc2ccccc2 62a_100000763385_100000070100 [0,1,0,0,0,1|2,0,0]=4 10152 B18R2.6483 Cc1nccc(n1)SCOCc2ccccc2 62a_100000749937_100000763385 [0,1,0,0,0,1|2,0,0]=4 10153 B18R2.6483 Cc1nccc(n1)SCOCc2ccccc2 62a_100000763385_100000749937 [0,1,0,0,0,1|2,0,0]=4 10154 B18R2.6483 Clc1cc(ccn1)CNCCc2ccccc2 2230a_100000106460_100000764220 [0,1,0,0,0,1|2,0,0]=4 10155 B18R2.6483 Clc1cc(ccn1)CNCCc2ccccc2 2230a_100015205668_100000765856 [0,1,0,0,0,1|2,0,0]=4 10156 B18R2.6483 Clc1cc(ccn1)CNCCc2ccccc2 270004a_100000106460_100011290808 [0,1,0,0,0,1|2,0,0]=4 10157 B18R2.6483 Clc1cc(ccn1)CNCCc2ccccc2 34a_100000106460_100000764220 [0,1,0,0,0,1|2,0,0]=4 10158 B18R2.6483 Clc1cc(ccn1)CNCCc2ccccc2 34a_100015205668_100000765856 [0,1,0,0,0,1|2,0,0]=4 10159 B18R2.6483 Clc1cc(ccn1)CNCSc2ccccc2 2230a_100015205668_100011218342 [0,1,0,0,0,1|2,0,0]=4 10160 B18R2.6483 Clc1cc(ccn1)COCCc2ccccc2 34a_100000210268_100000764220 [0,1,0,0,0,1|1,0,0]=3 10161 B18R2.6483 Clc1cc(ccn1)COCCc2ccccc2 34a_100000748751_100000765856 [0,1,0,0,0,1|1,0,0]=3 10162 B18R2.6483 Clc1cc(ccn1)COCCc2ccccc2 7a_100000210268_100000764220 [0,1,0,0,0,1|1,0,0]=3 10163 B18R2.6483 Clc1cc(ccn1)COCCc2ccccn2 34a_100000210271_100000764220 [0,1,0,0,0,1|2,0,0]=4 10164 B18R2.6483 Clc1cc(ccn1)COCCc2cccnc2 34a_100011217484_100000764220 [0,1,0,0,0,1|2,0,0]=4 10165 B18R2.6483 Clc1cc(ccn1)COCCc2ccncc2 34a_100011216225_100000764220 [0,1,0,0,0,1|2,0,0]=4 10166 B18R2.6483 Clc1cc(ccn1)CSCCc2ccccc2 62a_100000764220_100011218657 [0,1,0,0,0,1|1,1,0]=4 10167 B18R2.6483 Clc1cc(ccn1)CSCCc2ccccc2 62a_100000765856_100000764220 [0,1,0,0,0,1|1,1,0]=4 10168 B18R2.6483 Clc1cc(ccn1)CSCSc2ccccc2 62a_100000764220_100011218342 [0,1,0,0,0,1|1,1,0]=4 10169 B18R2.6483 Clc1cc(ccn1)CSCSc2ccccc2 62a_100011218342_100000764220 [0,1,0,0,0,1|1,1,0]=4 10170 B18R2.6483 Clc1cc(ccn1)OCCCc2ccccc2 34a_100000762945_100000211621 [0,1,0,0,0,1|2,0,0]=4 10171 B18R2.6483 Clc1cc(ccn1)OCOCc2ccccc2 34a_100000762945_100000763385 [0,1,0,0,0,1|1,0,0]=3 10172 B18R2.6483 Clc1cc(ccn1)OCSCc2ccccc2 34a_100000762945_200011217039 [0,1,0,0,0,1|1,1,0]=4 10173 B18R2.6483 Clc1cc(ccn1)SCCCc2ccccc2 62a_100000035001_100000211621 [0,1,0,0,0,1|2,0,0]=4 10174 B18R2.6483 Clc1cc(ccn1)SCCCc2ccccc2 62a_100000211621_100000035001 [0,1,0,0,0,1|2,0,0]=4 10175 B18R2.6483 Clc1cc(ccn1)SCOCc2ccccc2 62a_100000035001_100000763385 [0,1,0,0,0,1|1,0,0]=3 10176 B18R2.6483 Clc1cc(ccn1)SCOCc2ccccc2 62a_100000763385_100000035001 [0,1,0,0,0,1|1,0,0]=3 10177 B18R2.6483 Clc1cc(ccn1)SCSCc2ccccc2 62a_100000035001_200011217039 [0,1,0,0,0,1|1,1,0]=4 10178 B18R2.6483 Clc1cc(ccn1)SCSCc2ccccc2 62a_200011217039_100000035001 [0,1,0,0,0,1|1,1,0]=4 10179 B18R2.6483 Clc1cc(cnn1)OCOCc2ccccc2 34a_200010734679_100000763385 [0,1,0,0,0,1|2,0,0]=4 10180 B18R2.6483 Clc1cc(ncn1)SCOCc2ccccc2 62a_100000763385_100010161198 [0,1,0,0,0,1|2,0,0]=4 10181 B18R2.6483 Clc1cc(ncn1)SCOCc2ccccc2 62a_100010161198_100000763385 [0,1,0,0,0,1|2,0,0]=4 10182 B18R2.6483 Clc1cccc(c1)C=NNCc2ccccc2 4a_100000007032_100000210801 [0,1,0,0,0,1|1,0,1]=4 10183 B18R2.6483 Clc1cccc(c1)CC=NNc2ccccc2 4a_100015195140_100000765889 [0,1,0,0,0,1|2,0,0]=4 10184 B18R2.6483 Clc1cccc(c1)CCNCc2ccccc2 207a_100000185263_100015611070 [0,1,0,0,0,1|1,0,0]=3 10185 B18R2.6483 Clc1cccc(c1)CCNCc2ccccc2 2230a_100000185263_100015291786 [0,1,0,0,0,1|1,0,0]=3 10186 B18R2.6483 Clc1cccc(c1)CCNCc2ccccc2 2230a_100015324214_100011713710 [0,1,0,0,0,1|1,0,0]=3 10187 B18R2.6483 Clc1cccc(c1)CCNCc2ccccc2 270004a_100000185263_100015611070 [0,1,0,0,0,1|1,0,0]=3 10188 B18R2.6483 Clc1cccc(c1)CCNCc2ccccc2 34a_100000185263_100015291786 [0,1,0,0,0,1|1,0,0]=3 10189 B18R2.6483 Clc1cccc(c1)CCNCc2ccccc2 34a_100015324214_100011713710 [0,1,0,0,0,1|1,0,0]=3 10190 B18R2.6483 Clc1cccc(c1)CCNCc2ccccn2 207a_100000185263_100000209966 [0,1,0,0,0,1|2,0,0]=4 10191 B18R2.6483 Clc1cccc(c1)CCNCc2ccccn2 2230a_100000185263_100000721315 [0,1,0,0,0,1|2,0,0]=4 10192 B18R2.6483 Clc1cccc(c1)CCNCc2ccccn2 270004a_100000185263_100000209966 [0,1,0,0,0,1|2,0,0]=4 10193 B18R2.6483 Clc1cccc(c1)CCNCc2ccccn2 34a_100000185263_100000721315 [0,1,0,0,0,1|2,0,0]=4 10194 B18R2.6483 Clc1cccc(c1)CCNCc2cccnc2 207a_100000185263_100000209961 [0,1,0,0,0,1|2,0,0]=4 10195 B18R2.6483 Clc1cccc(c1)CCNCc2cccnc2 2230a_100000185263_100000741622 [0,1,0,0,0,1|2,0,0]=4 10196 B18R2.6483 Clc1cccc(c1)CCNCc2cccnc2 270004a_100000185263_100000209961 [0,1,0,0,0,1|2,0,0]=4 10197 B18R2.6483 Clc1cccc(c1)CCNCc2cccnc2 34a_100000185263_100000733263 [0,1,0,0,0,1|2,0,0]=4 10198 B18R2.6483 Clc1cccc(c1)CCNCc2ccncc2 207a_100000185263_100000186114 [0,1,0,0,0,1|2,0,0]=4 10199 B18R2.6483 Clc1cccc(c1)CCNCc2ccncc2 2230a_100000185263_100015193705 [0,1,0,0,0,1|2,0,0]=4 10200 B18R2.6483 Clc1cccc(c1)CCOCc2ccccc2 34a_100000210790_100011713710 [0,1,0,0,0,1|0,0,0]=2 10201 B18R2.6483 Clc1cccc(c1)CCOCc2ccccc2 34a_100000754733_100015291786 [0,1,0,0,0,1|0,0,0]=2 10202 B18R2.6483 Clc1cccc(c1)CCOCc2ccccc2 7a_100000210790_100011713710 [0,1,0,0,0,1|0,0,0]=2 10203 B18R2.6483 Clc1cccc(c1)CCOCc2ccccc2 7a_100000754733_100000211182 [0,1,0,0,0,1|0,0,0]=2 10204 B18R2.6483 Clc1cccc(c1)CCOCc2ccccn2 34a_100000754733_100000721315 [0,1,0,0,0,1|1,0,0]=3 10205 B18R2.6483 Clc1cccc(c1)CCOCc2ccccn2 7a_100000754733_100000721315 [0,1,0,0,0,1|1,0,0]=3 10206 B18R2.6483 Clc1cccc(c1)CCOCc2cccnc2 34a_100000754733_100000733263 [0,1,0,0,0,1|1,0,0]=3 10207 B18R2.6483 Clc1cccc(c1)CCOCc2cccnc2 7a_100000754733_100000741622 [0,1,0,0,0,1|1,0,0]=3 10208 B18R2.6483 Clc1cccc(c1)CCOCc2cccnn2 34a_100000754733_100016990269 [0,1,0,0,0,1|2,0,0]=4 10209 B18R2.6483 Clc1cccc(c1)CCOCc2cccnn2 7a_100000754733_100016990269 [0,1,0,0,0,1|2,0,0]=4 10210 B18R2.6483 Clc1cccc(c1)CCOCc2ccncc2 7a_100000754733_100015193705 [0,1,0,0,0,1|1,0,0]=3 10211 B18R2.6483 Clc1cccc(c1)CCOCc2cnccn2 34a_100000754733_100016995436 [0,1,0,0,0,1|2,0,0]=4 10212 B18R2.6483 Clc1cccc(c1)CCOCc2cnccn2 7a_100000754733_100016995436 [0,1,0,0,0,1|2,0,0]=4 10213 B18R2.6483 Clc1cccc(c1)CCOCc2cncnc2 34a_100000754733_100015196519 [0,1,0,0,0,1|2,0,0]=4 10214 B18R2.6483 Clc1cccc(c1)CCOCc2cncnc2 7a_100000754733_100015196519 [0,1,0,0,0,1|2,0,0]=4 10215 B18R2.6483 Clc1cccc(c1)CCOCc2ncccn2 34a_100000754733_100000703007 [0,1,0,0,0,1|2,0,0]=4 10216 B18R2.6483 Clc1cccc(c1)CCOCc2ncccn2 7a_100000754733_100000703007 [0,1,0,0,0,1|2,0,0]=4 10217 B18R2.6483 Clc1cccc(c1)CCSCc2ccccc2 62a_100000211182_100011713710 [0,1,0,0,0,1|0,1,0]=3 10218 B18R2.6483 Clc1cccc(c1)CCSCc2ccccc2 62a_100011713710_100015291786 [0,1,0,0,0,1|0,1,0]=3 10219 B18R2.6483 Clc1cccc(c1)CCSCc2ccccn2 62a_100000721315_100011713710 [0,1,0,0,0,1|1,1,0]=4 10220 B18R2.6483 Clc1cccc(c1)CCSCc2ccccn2 62a_100011713710_100000721315 [0,1,0,0,0,1|1,1,0]=4 10221 B18R2.6483 Clc1cccc(c1)CCSCc2cccnc2 62a_100000741622_100011713710 [0,1,0,0,0,1|1,1,0]=4 10222 B18R2.6483 Clc1cccc(c1)CCSCc2cccnc2 62a_100011713710_100000741622 [0,1,0,0,0,1|1,1,0]=4 10223 B18R2.6483 Clc1cccc(c1)CCSCc2ccncc2 62a_100011713710_100015193705 [0,1,0,0,0,1|1,1,0]=4 10224 B18R2.6483 Clc1cccc(c1)CCSCc2ccncc2 62a_100015193705_100011713710 [0,1,0,0,0,1|1,1,0]=4 10225 B18R2.6483 Clc1cccc(c1)CNCCc2ccccc2 207a_100000106460_100000210801 [0,1,0,0,0,1|1,0,0]=3 10226 B18R2.6483 Clc1cccc(c1)CNCCc2ccccc2 2230a_100000106460_100000181238 [0,1,0,0,0,1|1,0,0]=3 10227 B18R2.6483 Clc1cccc(c1)CNCCc2ccccc2 2230a_100000174878_100000765856 [0,1,0,0,0,1|1,0,0]=3 10228 B18R2.6483 Clc1cccc(c1)CNCCc2ccccc2 270004a_100000106460_100000210801 [0,1,0,0,0,1|1,0,0]=3 10229 B18R2.6483 Clc1cccc(c1)CNCCc2ccccc2 34a_100000106460_100000187163 [0,1,0,0,0,1|1,0,0]=3 10230 B18R2.6483 Clc1cccc(c1)CNCCc2ccccc2 34a_100000174878_100000765856 [0,1,0,0,0,1|1,0,0]=3 10231 B18R2.6483 Clc1cccc(c1)CNCCc2ccccn2 207a_100000211156_100000210801 [0,1,0,0,0,1|2,0,0]=4 10232 B18R2.6483 Clc1cccc(c1)CNCCc2ccccn2 2230a_100000174878_100015183660 [0,1,0,0,0,1|2,0,0]=4 10233 B18R2.6483 Clc1cccc(c1)CNCCc2ccccn2 270004a_100000211156_100000210801 [0,1,0,0,0,1|2,0,0]=4 10234 B18R2.6483 Clc1cccc(c1)CNCCc2cccnc2 207a_100000736294_100000210801 [0,1,0,0,0,1|2,0,0]=4 10235 B18R2.6483 Clc1cccc(c1)CNCCc2cccnc2 2230a_100000174878_200011713674 [0,1,0,0,0,1|2,0,0]=4 10236 B18R2.6483 Clc1cccc(c1)CNCCc2cccnc2 2230a_100000736294_100000181238 [0,1,0,0,0,1|2,0,0]=4 10237 B18R2.6483 Clc1cccc(c1)CNCCc2cccnc2 270004a_100000736294_100000210801 [0,1,0,0,0,1|2,0,0]=4 10238 B18R2.6483 Clc1cccc(c1)CNCCc2ccncc2 207a_100000742849_100000210801 [0,1,0,0,0,1|2,0,0]=4 10239 B18R2.6483 Clc1cccc(c1)CNCCc2ccncc2 2230a_100000174878_100000723409 [0,1,0,0,0,1|2,0,0]=4 10240 B18R2.6483 Clc1cccc(c1)CNCCc2ccncc2 270004a_100000742849_100000210801 [0,1,0,0,0,1|2,0,0]=4 10241 B18R2.6483 Clc1cccc(c1)CNCSc2ccccc2 2230a_100000174878_100011218342 [0,1,0,0,0,1|1,0,0]=3 10242 B18R2.6483 Clc1cccc(c1)CNN=Cc2ccccc2 4a_100000685877_100015611070 [0,1,0,0,0,1|1,0,1]=4 10243 B18R2.6483 Clc1cccc(c1)COCCc2ccccc2 34a_100000210268_100000187163 [0,1,0,0,0,1|0,0,0]=2 10244 B18R2.6483 Clc1cccc(c1)COCCc2ccccc2 34a_100000241301_100000765856 [0,1,0,0,0,1|0,0,0]=2 10245 B18R2.6483 Clc1cccc(c1)COCCc2ccccc2 7a_100000210268_100000187163 [0,1,0,0,0,1|0,0,0]=2 10246 B18R2.6483 Clc1cccc(c1)COCCc2ccccc2 7a_100000241301_100000765856 [0,1,0,0,0,1|0,0,0]=2 10247 B18R2.6483 Clc1cccc(c1)COCCc2ccccn2 34a_100000210271_100000187163 [0,1,0,0,0,1|1,0,0]=3 10248 B18R2.6483 Clc1cccc(c1)COCCc2ccccn2 7a_100000241301_100015183660 [0,1,0,0,0,1|1,0,0]=3 10249 B18R2.6483 Clc1cccc(c1)COCCc2cccnc2 34a_100011217484_100000187163 [0,1,0,0,0,1|1,0,0]=3 10250 B18R2.6483 Clc1cccc(c1)COCCc2cccnc2 7a_100000241301_200011713674 [0,1,0,0,0,1|1,0,0]=3 10251 B18R2.6483 Clc1cccc(c1)COCCc2ccncc2 34a_100011216225_100000187163 [0,1,0,0,0,1|1,0,0]=3 10252 B18R2.6483 Clc1cccc(c1)COCCc2ccncc2 7a_100000241301_100000723409 [0,1,0,0,0,1|1,0,0]=3 10253 B18R2.6483 Clc1cccc(c1)COCCc2cnccn2 34a_100011349526_100000187163 [0,1,0,0,0,1|2,0,0]=4 10254 B18R2.6483 Clc1cccc(c1)COCCc2cncnc2 34a_100011709255_100000187163 [0,1,0,0,0,1|2,0,0]=4 10255 B18R2.6483 Clc1cccc(c1)CSCCc2ccccc2 62a_100000187163_100011218657 [0,1,0,0,0,1|0,1,0]=3 10256 B18R2.6483 Clc1cccc(c1)CSCCc2ccccc2 62a_100000765856_100000187163 [0,1,0,0,0,1|0,1,0]=3 10257 B18R2.6483 Clc1cccc(c1)CSCCc2ccccn2 62a_100000187163_100015183660 [0,1,0,0,0,1|1,1,0]=4 10258 B18R2.6483 Clc1cccc(c1)CSCCc2ccccn2 62a_100015183660_100000187163 [0,1,0,0,0,1|1,1,0]=4 10259 B18R2.6483 Clc1cccc(c1)CSCCc2cccnc2 62a_100000187163_200011713674 [0,1,0,0,0,1|1,1,0]=4 10260 B18R2.6483 Clc1cccc(c1)CSCCc2cccnc2 62a_200011713674_100000187163 [0,1,0,0,0,1|1,1,0]=4 10261 B18R2.6483 Clc1cccc(c1)CSCCc2ccncc2 62a_100000187163_100000723409 [0,1,0,0,0,1|1,1,0]=4 10262 B18R2.6483 Clc1cccc(c1)CSCCc2ccncc2 62a_100000723409_100000187163 [0,1,0,0,0,1|1,1,0]=4 10263 B18R2.6483 Clc1cccc(c1)CSCSc2ccccc2 62a_100000187163_100011218342 [0,1,0,0,0,1|0,1,0]=3 10264 B18R2.6483 Clc1cccc(c1)CSCSc2ccccc2 62a_100011218342_100000187163 [0,1,0,0,0,1|0,1,0]=3 10265 B18R2.6483 Clc1cccc(c1)NC/C=C/c2ccccc2 34a_100000185859_100016265936 [0,1,0,0,0,1|1,0,1]=4 10266 B18R2.6483 Clc1cccc(c1)NCC#Cc2ccccc2 34a_100000185859_100011352542 [0,1,0,0,0,1|1,0,1]=4 10267 B18R2.6483 Clc1cccc(c1)NCCCc2ccccc2 34a_100000185859_100000211621 [0,1,0,0,0,1|1,0,0]=3 10268 B18R2.6483 Clc1cccc(c1)NCCOc2ccccc2 34a_100000185859_100000184471 [0,1,0,0,0,1|2,0,0]=4 10269 B18R2.6483 Clc1cccc(c1)NCCSc2ccccc2 34a_100000185859_100000246102 [0,1,0,0,0,1|2,0,0]=4 10270 B18R2.6483 Clc1cccc(c1)NCOCc2ccccc2 34a_100000185859_100000763385 [0,1,0,0,0,1|0,0,0]=2 10271 B18R2.6483 Clc1cccc(c1)NCSCc2ccccc2 34a_100000185859_200011217039 [0,1,0,0,0,1|0,1,0]=3 10272 B18R2.6483 Clc1cccc(c1)NN=CCc2ccccc2 4a_100000184277_100000209964 [0,1,0,0,0,1|2,0,0]=4 10273 B18R2.6483 Clc1cccc(c1)OC/C=C/c2ccccc2 34a_100000210295_100016265936 [0,1,0,0,0,1|1,0,1]=4 10274 B18R2.6483 Clc1cccc(c1)OC/C=C/c2ccccc2 7a_100000210295_100016265936 [0,1,0,0,0,1|1,0,1]=4 10275 B18R2.6483 Clc1cccc(c1)OCC#Cc2ccccc2 34a_100000210295_100011352542 [0,1,0,0,0,1|1,0,1]=4 10276 B18R2.6483 Clc1cccc(c1)OCC#Cc2ccccc2 7a_100000210295_100011352542 [0,1,0,0,0,1|1,0,1]=4 10277 B18R2.6483 Clc1cccc(c1)OCCCc2ccccc2 34a_100000210295_100000211621 [0,1,0,0,0,1|1,0,0]=3 10278 B18R2.6483 Clc1cccc(c1)OCCCc2ccccc2 7a_100000210295_100000211621 [0,1,0,0,0,1|1,0,0]=3 10279 B18R2.6483 Clc1cccc(c1)OCCNc2ccccc2 34a_100000106764_100000181161 [0,1,0,0,0,1|2,0,0]=4 10280 B18R2.6483 Clc1cccc(c1)OCCOc2ccccc2 34a_100000210295_100000184471 [0,1,0,0,0,1|2,0,0]=4 10281 B18R2.6483 Clc1cccc(c1)OCCOc2ccccc2 34a_100000210340_100000181161 [0,1,0,0,0,1|2,0,0]=4 10282 B18R2.6483 Clc1cccc(c1)OCCOc2ccccc2 7a_100000210295_100000184471 [0,1,0,0,0,1|2,0,0]=4 10283 B18R2.6483 Clc1cccc(c1)OCCOc2ccccc2 7a_100000210340_100000181161 [0,1,0,0,0,1|2,0,0]=4 10284 B18R2.6483 Clc1cccc(c1)OCCSc2ccccc2 34a_100000210295_100000246102 [0,1,0,0,0,1|2,0,0]=4 10285 B18R2.6483 Clc1cccc(c1)OCCSc2ccccc2 62a_100000181161_100000041952 [0,1,0,0,0,1|2,0,0]=4 10286 B18R2.6483 Clc1cccc(c1)OCCSc2ccccc2 62a_100000719477_100000181161 [0,1,0,0,0,1|2,0,0]=4 10287 B18R2.6483 Clc1cccc(c1)OCCSc2ccccc2 7a_100000210295_100000246102 [0,1,0,0,0,1|2,0,0]=4 10288 B18R2.6483 Clc1cccc(c1)OCOCc2ccccc2 34a_100000210295_100000763385 [0,1,0,0,0,1|0,0,0]=2 10289 B18R2.6483 Clc1cccc(c1)OCSCc2ccccc2 34a_100000210295_200011217039 [0,1,0,0,0,1|0,1,0]=3 10290 B18R2.6483 Clc1cccc(c1)SC/C=C/c2ccccc2 62a_100000699651_100016265936 [0,1,0,0,0,1|1,0,1]=4 10291 B18R2.6483 Clc1cccc(c1)SC/C=C/c2ccccc2 62a_100016265936_100000699651 [0,1,0,0,0,1|1,0,1]=4 10292 B18R2.6483 Clc1cccc(c1)SCC#Cc2ccccc2 62a_100000699651_100011352542 [0,1,0,0,0,1|1,0,1]=4 10293 B18R2.6483 Clc1cccc(c1)SCCCc2ccccc2 62a_100000211621_100000699651 [0,1,0,0,0,1|1,0,0]=3 10294 B18R2.6483 Clc1cccc(c1)SCCCc2ccccc2 62a_100000699651_100000211621 [0,1,0,0,0,1|1,0,0]=3 10295 B18R2.6483 Clc1cccc(c1)SCCOc2ccccc2 62a_100000184471_100000699651 [0,1,0,0,0,1|2,0,0]=4 10296 B18R2.6483 Clc1cccc(c1)SCCOc2ccccc2 62a_100000699651_100000184471 [0,1,0,0,0,1|2,0,0]=4 10297 B18R2.6483 Clc1cccc(c1)SCCSc2ccccc2 62a_100000246102_100000699651 [0,1,0,0,0,1|2,0,0]=4 10298 B18R2.6483 Clc1cccc(c1)SCCSc2ccccc2 62a_100000699651_100000246102 [0,1,0,0,0,1|2,0,0]=4 10299 B18R2.6483 Clc1cccc(c1)SCOCc2ccccc2 62a_100000699651_100000763385 [0,1,0,0,0,1|0,0,0]=2 10300 B18R2.6483 Clc1cccc(c1)SCOCc2ccccc2 62a_100000763385_100000699651 [0,1,0,0,0,1|0,0,0]=2 10301 B18R2.6483 Clc1cccc(c1)SCSCc2ccccc2 62a_100000699651_200011217039 [0,1,0,0,0,1|0,1,0]=3 10302 B18R2.6483 Clc1cccc(c1)SCSCc2ccccc2 62a_200011217039_100000699651 [0,1,0,0,0,1|0,1,0]=3 10303 B18R2.6483 Clc1cccc(n1)CNCCc2ccccc2 2230a_100000106460_100000086093 [0,1,0,0,0,1|2,0,0]=4 10304 B18R2.6483 Clc1cccc(n1)CNCCc2ccccc2 2230a_100016990191_100000765856 [0,1,0,0,0,1|2,0,0]=4 10305 B18R2.6483 Clc1cccc(n1)CNCCc2ccccc2 270004a_100000106460_100011361687 [0,1,0,0,0,1|2,0,0]=4 10306 B18R2.6483 Clc1cccc(n1)CNCCc2ccccc2 34a_100000106460_100000086093 [0,1,0,0,0,1|2,0,0]=4 10307 B18R2.6483 Clc1cccc(n1)CNCSc2ccccc2 2230a_100016990191_100011218342 [0,1,0,0,0,1|2,0,0]=4 10308 B18R2.6483 Clc1cccc(n1)COCCc2ccccc2 34a_100000210268_100000086093 [0,1,0,0,0,1|1,0,0]=3 10309 B18R2.6483 Clc1cccc(n1)COCCc2ccccc2 34a_100011998359_100000765856 [0,1,0,0,0,1|1,0,0]=3 10310 B18R2.6483 Clc1cccc(n1)COCCc2ccccc2 7a_100000210268_100000086093 [0,1,0,0,0,1|1,0,0]=3 10311 B18R2.6483 Clc1cccc(n1)COCCc2ccccn2 34a_100000210271_100000086093 [0,1,0,0,0,1|2,0,0]=4 10312 B18R2.6483 Clc1cccc(n1)COCCc2cccnc2 34a_100011217484_100000086093 [0,1,0,0,0,1|2,0,0]=4 10313 B18R2.6483 Clc1cccc(n1)COCCc2ccncc2 34a_100011216225_100000086093 [0,1,0,0,0,1|2,0,0]=4 10314 B18R2.6483 Clc1cccc(n1)CSCCc2ccccc2 62a_100000086093_100011218657 [0,1,0,0,0,1|1,1,0]=4 10315 B18R2.6483 Clc1cccc(n1)CSCCc2ccccc2 62a_100000765856_100000086093 [0,1,0,0,0,1|1,1,0]=4 10316 B18R2.6483 Clc1cccc(n1)CSCSc2ccccc2 62a_100000086093_100011218342 [0,1,0,0,0,1|1,1,0]=4 10317 B18R2.6483 Clc1cccc(n1)CSCSc2ccccc2 62a_100011218342_100000086093 [0,1,0,0,0,1|1,1,0]=4 10318 B18R2.6483 Clc1cccc(n1)SCCCc2ccccc2 62a_100000051397_100000211621 [0,1,0,0,0,1|2,0,0]=4 10319 B18R2.6483 Clc1cccc(n1)SCCCc2ccccc2 62a_100000211621_100000051397 [0,1,0,0,0,1|2,0,0]=4 10320 B18R2.6483 Clc1cccc(n1)SCOCc2ccccc2 62a_100000051397_100000763385 [0,1,0,0,0,1|1,0,0]=3 10321 B18R2.6483 Clc1cccc(n1)SCOCc2ccccc2 62a_100000763385_100000051397 [0,1,0,0,0,1|1,0,0]=3 10322 B18R2.6483 Clc1cccc(n1)SCSCc2ccccc2 62a_100000051397_200011217039 [0,1,0,0,0,1|1,1,0]=4 10323 B18R2.6483 Clc1cccc(n1)SCSCc2ccccc2 62a_200011217039_100000051397 [0,1,0,0,0,1|1,1,0]=4 10324 B18R2.6483 Clc1ccnc(c1)CNCCc2ccccc2 2230a_100000106460_100016988179 [0,1,0,0,0,1|2,0,0]=4 10325 B18R2.6483 Clc1ccnc(c1)CNCCc2ccccc2 270004a_100000106460_100011998288 [0,1,0,0,0,1|2,0,0]=4 10326 B18R2.6483 Clc1ccnc(c1)CNCCc2ccccc2 34a_100000106460_100016988179 [0,1,0,0,0,1|2,0,0]=4 10327 B18R2.6483 Clc1ccnc(c1)COCCc2ccccc2 34a_100000210268_100016988179 [0,1,0,0,0,1|1,0,0]=3 10328 B18R2.6483 Clc1ccnc(c1)COCCc2ccccc2 34a_100000748867_100000765856 [0,1,0,0,0,1|1,0,0]=3 10329 B18R2.6483 Clc1ccnc(c1)COCCc2ccccc2 7a_100000210268_100016988179 [0,1,0,0,0,1|1,0,0]=3 10330 B18R2.6483 Clc1ccnc(c1)COCCc2ccccn2 34a_100000210271_100016988179 [0,1,0,0,0,1|2,0,0]=4 10331 B18R2.6483 Clc1ccnc(c1)COCCc2cccnc2 34a_100011217484_100016988179 [0,1,0,0,0,1|2,0,0]=4 10332 B18R2.6483 Clc1ccnc(c1)COCCc2ccncc2 34a_100011216225_100016988179 [0,1,0,0,0,1|2,0,0]=4 10333 B18R2.6483 Clc1ccnc(c1)CSCCc2ccccc2 62a_100000765856_100016988179 [0,1,0,0,0,1|1,1,0]=4 10334 B18R2.6483 Clc1ccnc(c1)CSCCc2ccccc2 62a_100016988179_100011218657 [0,1,0,0,0,1|1,1,0]=4 10335 B18R2.6483 Clc1ccnc(c1)CSCSc2ccccc2 62a_100011218342_100016988179 [0,1,0,0,0,1|1,1,0]=4 10336 B18R2.6483 Clc1ccnc(c1)CSCSc2ccccc2 62a_100016988179_100011218342 [0,1,0,0,0,1|1,1,0]=4 10337 B18R2.6483 Clc1ccnc(c1)SCCCc2ccccc2 62a_100000211621_100010167805 [0,1,0,0,0,1|2,0,0]=4 10338 B18R2.6483 Clc1ccnc(c1)SCCCc2ccccc2 62a_100010167805_100000211621 [0,1,0,0,0,1|2,0,0]=4 10339 B18R2.6483 Clc1ccnc(c1)SCOCc2ccccc2 62a_100000763385_100010167805 [0,1,0,0,0,1|1,0,0]=3 10340 B18R2.6483 Clc1ccnc(c1)SCOCc2ccccc2 62a_100010167805_100000763385 [0,1,0,0,0,1|1,0,0]=3 10341 B18R2.6483 Clc1ccnc(c1)SCSCc2ccccc2 62a_100010167805_200011217039 [0,1,0,0,0,1|1,1,0]=4 10342 B18R2.6483 Clc1ccnc(c1)SCSCc2ccccc2 62a_200011217039_100010167805 [0,1,0,0,0,1|1,1,0]=4 10343 B18R2.6483 Clc1cncc(c1)CNCCc2ccccc2 207a_100000106460_100000088910 [0,1,0,0,0,1|2,0,0]=4 10344 B18R2.6483 Clc1cncc(c1)CNCCc2ccccc2 2230a_100000106460_100016992070 [0,1,0,0,0,1|2,0,0]=4 10345 B18R2.6483 Clc1cncc(c1)CNCCc2ccccc2 2230a_200020614424_100000765856 [0,1,0,0,0,1|2,0,0]=4 10346 B18R2.6483 Clc1cncc(c1)CNCCc2ccccc2 270004a_100000106460_100000088910 [0,1,0,0,0,1|2,0,0]=4 10347 B18R2.6483 Clc1cncc(c1)CNCCc2ccccc2 34a_100000106460_100016992070 [0,1,0,0,0,1|2,0,0]=4 10348 B18R2.6483 Clc1cncc(c1)CNCSc2ccccc2 2230a_200020614424_100011218342 [0,1,0,0,0,1|2,0,0]=4 10349 B18R2.6483 Clc1cncc(c1)COCCc2ccccc2 34a_100000092867_100000765856 [0,1,0,0,0,1|1,0,0]=3 10350 B18R2.6483 Clc1cncc(c1)COCCc2ccccc2 34a_100000210268_100016992070 [0,1,0,0,0,1|1,0,0]=3 10351 B18R2.6483 Clc1cncc(c1)COCCc2ccccc2 7a_100000092867_100000765856 [0,1,0,0,0,1|1,0,0]=3 10352 B18R2.6483 Clc1cncc(c1)COCCc2ccccc2 7a_100000210268_100016992070 [0,1,0,0,0,1|1,0,0]=3 10353 B18R2.6483 Clc1cncc(c1)COCCc2ccccn2 34a_100000210271_100016992070 [0,1,0,0,0,1|2,0,0]=4 10354 B18R2.6483 Clc1cncc(c1)COCCc2ccccn2 7a_100000092867_100015183660 [0,1,0,0,0,1|2,0,0]=4 10355 B18R2.6483 Clc1cncc(c1)COCCc2cccnc2 34a_100011217484_100016992070 [0,1,0,0,0,1|2,0,0]=4 10356 B18R2.6483 Clc1cncc(c1)COCCc2cccnc2 7a_100000092867_200011713674 [0,1,0,0,0,1|2,0,0]=4 10357 B18R2.6483 Clc1cncc(c1)COCCc2ccncc2 34a_100011216225_100016992070 [0,1,0,0,0,1|2,0,0]=4 10358 B18R2.6483 Clc1cncc(c1)COCCc2ccncc2 7a_100000092867_100000723409 [0,1,0,0,0,1|2,0,0]=4 10359 B18R2.6483 Clc1cncc(c1)CSCCc2ccccc2 62a_100000765856_100016992070 [0,1,0,0,0,1|1,1,0]=4 10360 B18R2.6483 Clc1cncc(c1)CSCCc2ccccc2 62a_100016992070_100011218657 [0,1,0,0,0,1|1,1,0]=4 10361 B18R2.6483 Clc1cncc(c1)CSCSc2ccccc2 62a_100011218342_100016992070 [0,1,0,0,0,1|1,1,0]=4 10362 B18R2.6483 Clc1cncc(c1)CSCSc2ccccc2 62a_100016992070_100011218342 [0,1,0,0,0,1|1,1,0]=4 10363 B18R2.6483 Clc1cncc(c1)OCCCc2ccccc2 7a_100000032511_100000211621 [0,1,0,0,0,1|2,0,0]=4 10364 B18R2.6483 Clc1cncc(c1)SCCCc2ccccc2 62a_100000049639_100000211621 [0,1,0,0,0,1|2,0,0]=4 10365 B18R2.6483 Clc1cncc(c1)SCCCc2ccccc2 62a_100000211621_100000049639 [0,1,0,0,0,1|2,0,0]=4 10366 B18R2.6483 Clc1cncc(c1)SCOCc2ccccc2 62a_100000049639_100000763385 [0,1,0,0,0,1|1,0,0]=3 10367 B18R2.6483 Clc1cncc(c1)SCOCc2ccccc2 62a_100000763385_100000049639 [0,1,0,0,0,1|1,0,0]=3 10368 B18R2.6483 Clc1cncc(c1)SCSCc2ccccc2 62a_100000049639_200011217039 [0,1,0,0,0,1|1,1,0]=4 10369 B18R2.6483 Clc1cncc(c1)SCSCc2ccccc2 62a_200011217039_100000049639 [0,1,0,0,0,1|1,1,0]=4 10370 B18R2.6483 Clc1cncc(n1)SCOCc2ccccc2 62a_100000763385_100010892449 [0,1,0,0,0,1|2,0,0]=4 10371 B18R2.6483 Clc1cncc(n1)SCOCc2ccccc2 62a_100010892449_100000763385 [0,1,0,0,0,1|2,0,0]=4 10372 B18R2.6483 Clc1nccc(n1)COCCc2ccccc2 34a_100000210268_100000099655 [0,1,0,0,0,1|2,0,0]=4 10373 B18R2.6483 Clc1nccc(n1)COCCc2ccccc2 7a_100000210268_100000099655 [0,1,0,0,0,1|2,0,0]=4 10374 B18R2.6483 Clc1nccc(n1)SCOCc2ccccc2 62a_100000763385_100010154678 [0,1,0,0,0,1|2,0,0]=4 10375 B18R2.6483 Clc1nccc(n1)SCOCc2ccccc2 62a_100010154678_100000763385 [0,1,0,0,0,1|2,0,0]=4 10376 B18R2.6483 Fc1cc(ccn1)CNCCc2ccccc2 2230a_100015188774_100000765856 [0,1,0,0,0,1|2,0,0]=4 10377 B18R2.6483 Fc1cc(ccn1)CNCCc2ccccc2 270004a_100000106460_100000068331 [0,1,0,0,0,1|2,0,0]=4 10378 B18R2.6483 Fc1cc(ccn1)CNCCc2ccccc2 34a_100015188774_100000765856 [0,1,0,0,0,1|2,0,0]=4 10379 B18R2.6483 Fc1cc(ccn1)CNCSc2ccccc2 2230a_100015188774_100011218342 [0,1,0,0,0,1|2,0,0]=4 10380 B18R2.6483 Fc1cc(ccn1)COCCc2ccccc2 34a_100000082451_100000765856 [0,1,0,0,0,1|1,0,0]=3 10381 B18R2.6483 Fc1cc(ccn1)NCCCc2ccccc2 27a_100000211184_100009816116 [0,1,0,0,0,1|2,0,0]=4 10382 B18R2.6483 Fc1cc(ccn1)OCCCc2ccccc2 34a_100000732698_100000211621 [0,1,0,0,0,1|2,0,0]=4 10383 B18R2.6483 Fc1cc(ccn1)OCOCc2ccccc2 34a_100000732698_100000763385 [0,1,0,0,0,1|1,0,0]=3 10384 B18R2.6483 Fc1cc(ccn1)OCSCc2ccccc2 34a_100000732698_200011217039 [0,1,0,0,0,1|1,1,0]=4 10385 B18R2.6483 Fc1cc(ccn1)SCCCc2ccccc2 62a_100000211621_100009816116 [0,1,0,0,0,1|2,0,0]=4 10386 B18R2.6483 Fc1cc(ccn1)SCCCc2ccccc2 62a_100009816116_100000211621 [0,1,0,0,0,1|2,0,0]=4 10387 B18R2.6483 Fc1cc(ccn1)SCOCc2ccccc2 62a_100000763385_100009816116 [0,1,0,0,0,1|1,0,0]=3 10388 B18R2.6483 Fc1cc(ccn1)SCOCc2ccccc2 62a_100009816116_100000763385 [0,1,0,0,0,1|1,0,0]=3 10389 B18R2.6483 Fc1cc(ccn1)SCSCc2ccccc2 62a_100009816116_200011217039 [0,1,0,0,0,1|1,1,0]=4 10390 B18R2.6483 Fc1cc(ccn1)SCSCc2ccccc2 62a_200011217039_100009816116 [0,1,0,0,0,1|1,1,0]=4 10391 B18R2.6483 Fc1cc(ncn1)SCOCc2ccccc2 62a_100000763385_200009880791 [0,1,0,0,0,1|2,0,0]=4 10392 B18R2.6483 Fc1cc(ncn1)SCOCc2ccccc2 62a_200009880791_100000763385 [0,1,0,0,0,1|2,0,0]=4 10393 B18R2.6483 Fc1cccc(c1)C#CCNc2ccccc2 34a_100000106764_100010402994 [0,1,0,0,0,1|1,0,1]=4 10394 B18R2.6483 Fc1cccc(c1)C#CCOc2ccccc2 34a_100000210340_100010402994 [0,1,0,0,0,1|1,0,1]=4 10395 B18R2.6483 Fc1cccc(c1)C#CCOc2ccccc2 7a_100000210340_100010402994 [0,1,0,0,0,1|1,0,1]=4 10396 B18R2.6483 Fc1cccc(c1)C#CCSc2ccccc2 62a_100000719477_100010402994 [0,1,0,0,0,1|1,0,1]=4 10397 B18R2.6483 Fc1cccc(c1)C#CCSc2ccccc2 62a_100010402994_100000041952 [0,1,0,0,0,1|1,0,1]=4 10398 B18R2.6483 Fc1cccc(c1)C=NNCc2ccccc2 4a_100000007032_100000210812 [0,1,0,0,0,1|1,0,1]=4 10399 B18R2.6483 Fc1cccc(c1)CC=NNc2ccccc2 4a_100015195140_100011713417 [0,1,0,0,0,1|2,0,0]=4 10400 B18R2.6483 Fc1cccc(c1)CCCNc2ccccc2 34a_100000106764_200000698031 [0,1,0,0,0,1|1,0,0]=3 10401 B18R2.6483 Fc1cccc(c1)CCCOc2ccccc2 34a_100000210340_200000698031 [0,1,0,0,0,1|1,0,0]=3 10402 B18R2.6483 Fc1cccc(c1)CCCOc2ccccc2 7a_100000210340_200000698031 [0,1,0,0,0,1|1,0,0]=3 10403 B18R2.6483 Fc1cccc(c1)CCCOc2cccnc2 34a_100000210849_200000698031 [0,1,0,0,0,1|2,0,0]=4 10404 B18R2.6483 Fc1cccc(c1)CCCOc2cccnc2 7a_100000210849_200000698031 [0,1,0,0,0,1|2,0,0]=4 10405 B18R2.6483 Fc1cccc(c1)CCCOc2ccncc2 34a_100000212176_200000698031 [0,1,0,0,0,1|2,0,0]=4 10406 B18R2.6483 Fc1cccc(c1)CCCSc2ccccc2 62a_100000719477_200000698031 [0,1,0,0,0,1|1,0,0]=3 10407 B18R2.6483 Fc1cccc(c1)CCCSc2ccccc2 62a_200000698031_100000041952 [0,1,0,0,0,1|1,0,0]=3 10408 B18R2.6483 Fc1cccc(c1)CCCSc2ccccn2 62a_100011216584_200000698031 [0,1,0,0,0,1|2,0,0]=4 10409 B18R2.6483 Fc1cccc(c1)CCCSc2ccccn2 62a_200000698031_100011216584 [0,1,0,0,0,1|2,0,0]=4 10410 B18R2.6483 Fc1cccc(c1)CCCSc2cccnc2 62a_100000210063_200000698031 [0,1,0,0,0,1|2,0,0]=4 10411 B18R2.6483 Fc1cccc(c1)CCCSc2cccnc2 62a_200000698031_100000210063 [0,1,0,0,0,1|2,0,0]=4 10412 B18R2.6483 Fc1cccc(c1)CCCSc2ccncc2 62a_100000728582_200000698031 [0,1,0,0,0,1|2,0,0]=4 10413 B18R2.6483 Fc1cccc(c1)CCCSc2ccncc2 62a_200000698031_100000728582 [0,1,0,0,0,1|2,0,0]=4 10414 B18R2.6483 Fc1cccc(c1)CCNCc2ccccc2 207a_100000205154_100015611070 [0,1,0,0,0,1|1,0,0]=3 10415 B18R2.6483 Fc1cccc(c1)CCNCc2ccccc2 2230a_100000205154_100015291786 [0,1,0,0,0,1|1,0,0]=3 10416 B18R2.6483 Fc1cccc(c1)CCNCc2ccccc2 2230a_100015324214_100011217235 [0,1,0,0,0,1|1,0,0]=3 10417 B18R2.6483 Fc1cccc(c1)CCNCc2ccccc2 270004a_100000205154_100015611070 [0,1,0,0,0,1|1,0,0]=3 10418 B18R2.6483 Fc1cccc(c1)CCNCc2ccccc2 34a_100000205154_100015291786 [0,1,0,0,0,1|1,0,0]=3 10419 B18R2.6483 Fc1cccc(c1)CCNCc2ccccc2 34a_100015324214_100011217235 [0,1,0,0,0,1|1,0,0]=3 10420 B18R2.6483 Fc1cccc(c1)CCNCc2ccccn2 207a_100000205154_100000209966 [0,1,0,0,0,1|2,0,0]=4 10421 B18R2.6483 Fc1cccc(c1)CCNCc2ccccn2 2230a_100000205154_100000721315 [0,1,0,0,0,1|2,0,0]=4 10422 B18R2.6483 Fc1cccc(c1)CCNCc2ccccn2 270004a_100000205154_100000209966 [0,1,0,0,0,1|2,0,0]=4 10423 B18R2.6483 Fc1cccc(c1)CCNCc2ccccn2 34a_100000205154_100000721315 [0,1,0,0,0,1|2,0,0]=4 10424 B18R2.6483 Fc1cccc(c1)CCNCc2cccnc2 207a_100000205154_100000209961 [0,1,0,0,0,1|2,0,0]=4 10425 B18R2.6483 Fc1cccc(c1)CCNCc2cccnc2 2230a_100000205154_100000741622 [0,1,0,0,0,1|2,0,0]=4 10426 B18R2.6483 Fc1cccc(c1)CCNCc2cccnc2 270004a_100000205154_100000209961 [0,1,0,0,0,1|2,0,0]=4 10427 B18R2.6483 Fc1cccc(c1)CCNCc2cccnc2 34a_100000205154_100000733263 [0,1,0,0,0,1|2,0,0]=4 10428 B18R2.6483 Fc1cccc(c1)CCNCc2ccncc2 207a_100000205154_100000186114 [0,1,0,0,0,1|2,0,0]=4 10429 B18R2.6483 Fc1cccc(c1)CCNCc2ccncc2 2230a_100000205154_100015193705 [0,1,0,0,0,1|2,0,0]=4 10430 B18R2.6483 Fc1cccc(c1)CCOCc2ccccc2 34a_100000210790_100011217235 [0,1,0,0,0,1|0,0,0]=2 10431 B18R2.6483 Fc1cccc(c1)CCOCc2ccccc2 34a_100000763591_100015291786 [0,1,0,0,0,1|0,0,0]=2 10432 B18R2.6483 Fc1cccc(c1)CCOCc2ccccc2 7a_100000210790_100011217235 [0,1,0,0,0,1|0,0,0]=2 10433 B18R2.6483 Fc1cccc(c1)CCOCc2ccccc2 7a_100000763591_100000211182 [0,1,0,0,0,1|0,0,0]=2 10434 B18R2.6483 Fc1cccc(c1)CCOCc2ccccn2 34a_100000763591_100000721315 [0,1,0,0,0,1|1,0,0]=3 10435 B18R2.6483 Fc1cccc(c1)CCOCc2ccccn2 7a_100000763591_100000721315 [0,1,0,0,0,1|1,0,0]=3 10436 B18R2.6483 Fc1cccc(c1)CCOCc2cccnc2 34a_100000763591_100000733263 [0,1,0,0,0,1|1,0,0]=3 10437 B18R2.6483 Fc1cccc(c1)CCOCc2cccnc2 7a_100000763591_100000741622 [0,1,0,0,0,1|1,0,0]=3 10438 B18R2.6483 Fc1cccc(c1)CCOCc2cccnn2 34a_100000763591_100016990269 [0,1,0,0,0,1|2,0,0]=4 10439 B18R2.6483 Fc1cccc(c1)CCOCc2cccnn2 7a_100000763591_100016990269 [0,1,0,0,0,1|2,0,0]=4 10440 B18R2.6483 Fc1cccc(c1)CCOCc2ccncc2 7a_100000763591_100015193705 [0,1,0,0,0,1|1,0,0]=3 10441 B18R2.6483 Fc1cccc(c1)CCOCc2cnccn2 34a_100000763591_100016995436 [0,1,0,0,0,1|2,0,0]=4 10442 B18R2.6483 Fc1cccc(c1)CCOCc2cnccn2 7a_100000763591_100016995436 [0,1,0,0,0,1|2,0,0]=4 10443 B18R2.6483 Fc1cccc(c1)CCOCc2cncnc2 34a_100000763591_100015196519 [0,1,0,0,0,1|2,0,0]=4 10444 B18R2.6483 Fc1cccc(c1)CCOCc2cncnc2 7a_100000763591_100015196519 [0,1,0,0,0,1|2,0,0]=4 10445 B18R2.6483 Fc1cccc(c1)CCOCc2ncccn2 34a_100000763591_100000703007 [0,1,0,0,0,1|2,0,0]=4 10446 B18R2.6483 Fc1cccc(c1)CCOCc2ncccn2 7a_100000763591_100000703007 [0,1,0,0,0,1|2,0,0]=4 10447 B18R2.6483 Fc1cccc(c1)CCSCc2ccccc2 62a_100000211182_100011217235 [0,1,0,0,0,1|0,1,0]=3 10448 B18R2.6483 Fc1cccc(c1)CCSCc2ccccc2 62a_100011217235_100015291786 [0,1,0,0,0,1|0,1,0]=3 10449 B18R2.6483 Fc1cccc(c1)CCSCc2ccccn2 62a_100000721315_100011217235 [0,1,0,0,0,1|1,1,0]=4 10450 B18R2.6483 Fc1cccc(c1)CCSCc2ccccn2 62a_100011217235_100000721315 [0,1,0,0,0,1|1,1,0]=4 10451 B18R2.6483 Fc1cccc(c1)CCSCc2cccnc2 62a_100000741622_100011217235 [0,1,0,0,0,1|1,1,0]=4 10452 B18R2.6483 Fc1cccc(c1)CCSCc2cccnc2 62a_100011217235_100000741622 [0,1,0,0,0,1|1,1,0]=4 10453 B18R2.6483 Fc1cccc(c1)CCSCc2ccncc2 62a_100011217235_100015193705 [0,1,0,0,0,1|1,1,0]=4 10454 B18R2.6483 Fc1cccc(c1)CCSCc2ccncc2 62a_100015193705_100011217235 [0,1,0,0,0,1|1,1,0]=4 10455 B18R2.6483 Fc1cccc(c1)CNCCc2ccccc2 207a_100000106460_100000210812 [0,1,0,0,0,1|1,0,0]=3 10456 B18R2.6483 Fc1cccc(c1)CNCCc2ccccc2 2230a_100000106460_100000230114 [0,1,0,0,0,1|1,0,0]=3 10457 B18R2.6483 Fc1cccc(c1)CNCCc2ccccc2 2230a_100000174948_100000765856 [0,1,0,0,0,1|1,0,0]=3 10458 B18R2.6483 Fc1cccc(c1)CNCCc2ccccc2 270004a_100000106460_100000210812 [0,1,0,0,0,1|1,0,0]=3 10459 B18R2.6483 Fc1cccc(c1)CNCCc2ccccc2 34a_100000106460_100000187166 [0,1,0,0,0,1|1,0,0]=3 10460 B18R2.6483 Fc1cccc(c1)CNCCc2ccccc2 34a_100000174948_100000765856 [0,1,0,0,0,1|1,0,0]=3 10461 B18R2.6483 Fc1cccc(c1)CNCCc2ccccn2 207a_100000211156_100000210812 [0,1,0,0,0,1|2,0,0]=4 10462 B18R2.6483 Fc1cccc(c1)CNCCc2ccccn2 2230a_100000174948_100015183660 [0,1,0,0,0,1|2,0,0]=4 10463 B18R2.6483 Fc1cccc(c1)CNCCc2ccccn2 270004a_100000211156_100000210812 [0,1,0,0,0,1|2,0,0]=4 10464 B18R2.6483 Fc1cccc(c1)CNCCc2cccnc2 207a_100000736294_100000210812 [0,1,0,0,0,1|2,0,0]=4 10465 B18R2.6483 Fc1cccc(c1)CNCCc2cccnc2 2230a_100000174948_200011713674 [0,1,0,0,0,1|2,0,0]=4 10466 B18R2.6483 Fc1cccc(c1)CNCCc2cccnc2 2230a_100000736294_100000230114 [0,1,0,0,0,1|2,0,0]=4 10467 B18R2.6483 Fc1cccc(c1)CNCCc2cccnc2 270004a_100000736294_100000210812 [0,1,0,0,0,1|2,0,0]=4 10468 B18R2.6483 Fc1cccc(c1)CNCCc2ccncc2 207a_100000742849_100000210812 [0,1,0,0,0,1|2,0,0]=4 10469 B18R2.6483 Fc1cccc(c1)CNCCc2ccncc2 2230a_100000174948_100000723409 [0,1,0,0,0,1|2,0,0]=4 10470 B18R2.6483 Fc1cccc(c1)CNCCc2ccncc2 270004a_100000742849_100000210812 [0,1,0,0,0,1|2,0,0]=4 10471 B18R2.6483 Fc1cccc(c1)CNCSc2ccccc2 2230a_100000174948_100011218342 [0,1,0,0,0,1|1,0,0]=3 10472 B18R2.6483 Fc1cccc(c1)CNN=Cc2ccccc2 4a_100016993953_100015611070 [0,1,0,0,0,1|1,0,1]=4 10473 B18R2.6483 Fc1cccc(c1)COCCc2ccccc2 34a_100000210268_100000187166 [0,1,0,0,0,1|0,0,0]=2 10474 B18R2.6483 Fc1cccc(c1)COCCc2ccccc2 34a_100000210976_100000765856 [0,1,0,0,0,1|0,0,0]=2 10475 B18R2.6483 Fc1cccc(c1)COCCc2ccccc2 7a_100000210268_100000230114 [0,1,0,0,0,1|0,0,0]=2 10476 B18R2.6483 Fc1cccc(c1)COCCc2ccccc2 7a_100000210976_100000765856 [0,1,0,0,0,1|0,0,0]=2 10477 B18R2.6483 Fc1cccc(c1)COCCc2ccccn2 34a_100000210271_100000187166 [0,1,0,0,0,1|1,0,0]=3 10478 B18R2.6483 Fc1cccc(c1)COCCc2ccccn2 7a_100000210976_100015183660 [0,1,0,0,0,1|1,0,0]=3 10479 B18R2.6483 Fc1cccc(c1)COCCc2cccnc2 34a_100011217484_100000187166 [0,1,0,0,0,1|1,0,0]=3 10480 B18R2.6483 Fc1cccc(c1)COCCc2cccnc2 7a_100000210976_200011713674 [0,1,0,0,0,1|1,0,0]=3 10481 B18R2.6483 Fc1cccc(c1)COCCc2ccncc2 34a_100011216225_100000187166 [0,1,0,0,0,1|1,0,0]=3 10482 B18R2.6483 Fc1cccc(c1)COCCc2ccncc2 7a_100000210976_100000723409 [0,1,0,0,0,1|1,0,0]=3 10483 B18R2.6483 Fc1cccc(c1)COCCc2cnccn2 34a_100011349526_100000187166 [0,1,0,0,0,1|2,0,0]=4 10484 B18R2.6483 Fc1cccc(c1)COCCc2cncnc2 34a_100011709255_100000187166 [0,1,0,0,0,1|2,0,0]=4 10485 B18R2.6483 Fc1cccc(c1)CSCCc2ccccc2 62a_100000230114_100011218657 [0,1,0,0,0,1|0,1,0]=3 10486 B18R2.6483 Fc1cccc(c1)CSCCc2ccccc2 62a_100000765856_100000230114 [0,1,0,0,0,1|0,1,0]=3 10487 B18R2.6483 Fc1cccc(c1)CSCCc2ccccn2 62a_100000230114_100015183660 [0,1,0,0,0,1|1,1,0]=4 10488 B18R2.6483 Fc1cccc(c1)CSCCc2ccccn2 62a_100015183660_100000230114 [0,1,0,0,0,1|1,1,0]=4 10489 B18R2.6483 Fc1cccc(c1)CSCCc2cccnc2 62a_100000230114_200011713674 [0,1,0,0,0,1|1,1,0]=4 10490 B18R2.6483 Fc1cccc(c1)CSCCc2cccnc2 62a_200011713674_100000230114 [0,1,0,0,0,1|1,1,0]=4 10491 B18R2.6483 Fc1cccc(c1)CSCCc2ccncc2 62a_100000230114_100000723409 [0,1,0,0,0,1|1,1,0]=4 10492 B18R2.6483 Fc1cccc(c1)CSCCc2ccncc2 62a_100000723409_100000230114 [0,1,0,0,0,1|1,1,0]=4 10493 B18R2.6483 Fc1cccc(c1)CSCSc2ccccc2 62a_100000230114_100011218342 [0,1,0,0,0,1|0,1,0]=3 10494 B18R2.6483 Fc1cccc(c1)CSCSc2ccccc2 62a_100011218342_100000230114 [0,1,0,0,0,1|0,1,0]=3 10495 B18R2.6483 Fc1cccc(c1)NC/C=C/c2ccccc2 34a_100000210047_100016265936 [0,1,0,0,0,1|1,0,1]=4 10496 B18R2.6483 Fc1cccc(c1)NCC#Cc2ccccc2 34a_100000210047_100011352542 [0,1,0,0,0,1|1,0,1]=4 10497 B18R2.6483 Fc1cccc(c1)NCCCc2ccccc2 34a_100000210047_100000211621 [0,1,0,0,0,1|1,0,0]=3 10498 B18R2.6483 Fc1cccc(c1)NCCOc2ccccc2 34a_100000210047_100000184471 [0,1,0,0,0,1|2,0,0]=4 10499 B18R2.6483 Fc1cccc(c1)NCCSc2ccccc2 34a_100000210047_100000246102 [0,1,0,0,0,1|2,0,0]=4 10500 B18R2.6483 Fc1cccc(c1)NCOCc2ccccc2 34a_100000210047_100000763385 [0,1,0,0,0,1|0,0,0]=2 10501 B18R2.6483 Fc1cccc(c1)NCSCc2ccccc2 34a_100000210047_200011217039 [0,1,0,0,0,1|0,1,0]=3 10502 B18R2.6483 Fc1cccc(c1)NN=CCc2ccccc2 4a_100000745080_100000209964 [0,1,0,0,0,1|2,0,0]=4 10503 B18R2.6483 Fc1cccc(c1)OC/C=C/c2ccccc2 34a_100000210426_100016265936 [0,1,0,0,0,1|1,0,1]=4 10504 B18R2.6483 Fc1cccc(c1)OC/C=C/c2ccccc2 7a_100000210426_100016265936 [0,1,0,0,0,1|1,0,1]=4 10505 B18R2.6483 Fc1cccc(c1)OCC#Cc2ccccc2 34a_100000210426_100011352542 [0,1,0,0,0,1|1,0,1]=4 10506 B18R2.6483 Fc1cccc(c1)OCC#Cc2ccccc2 7a_100000210426_100011352542 [0,1,0,0,0,1|1,0,1]=4 10507 B18R2.6483 Fc1cccc(c1)OCCCc2ccccc2 34a_100000210426_100000211621 [0,1,0,0,0,1|1,0,0]=3 10508 B18R2.6483 Fc1cccc(c1)OCCCc2ccccc2 7a_100000210426_100000211621 [0,1,0,0,0,1|1,0,0]=3 10509 B18R2.6483 Fc1cccc(c1)OCCNc2ccccc2 34a_100000106764_100000739188 [0,1,0,0,0,1|2,0,0]=4 10510 B18R2.6483 Fc1cccc(c1)OCCOc2ccccc2 34a_100000210340_100000739188 [0,1,0,0,0,1|2,0,0]=4 10511 B18R2.6483 Fc1cccc(c1)OCCOc2ccccc2 34a_100000210426_100000184471 [0,1,0,0,0,1|2,0,0]=4 10512 B18R2.6483 Fc1cccc(c1)OCCOc2ccccc2 7a_100000210340_100000739188 [0,1,0,0,0,1|2,0,0]=4 10513 B18R2.6483 Fc1cccc(c1)OCCOc2ccccc2 7a_100000210426_100000184471 [0,1,0,0,0,1|2,0,0]=4 10514 B18R2.6483 Fc1cccc(c1)OCCSc2ccccc2 34a_100000210426_100000246102 [0,1,0,0,0,1|2,0,0]=4 10515 B18R2.6483 Fc1cccc(c1)OCCSc2ccccc2 62a_100000719477_100000739188 [0,1,0,0,0,1|2,0,0]=4 10516 B18R2.6483 Fc1cccc(c1)OCCSc2ccccc2 62a_100000739188_100000041952 [0,1,0,0,0,1|2,0,0]=4 10517 B18R2.6483 Fc1cccc(c1)OCCSc2ccccc2 7a_100000210426_100000246102 [0,1,0,0,0,1|2,0,0]=4 10518 B18R2.6483 Fc1cccc(c1)OCOCc2ccccc2 34a_100000210426_100000763385 [0,1,0,0,0,1|0,0,0]=2 10519 B18R2.6483 Fc1cccc(c1)OCSCc2ccccc2 34a_100000210426_200011217039 [0,1,0,0,0,1|0,1,0]=3 10520 B18R2.6483 Fc1cccc(c1)SC/C=C/c2ccccc2 62a_100000685547_100016265936 [0,1,0,0,0,1|1,0,1]=4 10521 B18R2.6483 Fc1cccc(c1)SC/C=C/c2ccccc2 62a_100016265936_100000685547 [0,1,0,0,0,1|1,0,1]=4 10522 B18R2.6483 Fc1cccc(c1)SCC#Cc2ccccc2 62a_100000685547_100011352542 [0,1,0,0,0,1|1,0,1]=4 10523 B18R2.6483 Fc1cccc(c1)SCCCc2ccccc2 62a_100000211621_100000685547 [0,1,0,0,0,1|1,0,0]=3 10524 B18R2.6483 Fc1cccc(c1)SCCCc2ccccc2 62a_100000685547_100000211621 [0,1,0,0,0,1|1,0,0]=3 10525 B18R2.6483 Fc1cccc(c1)SCCOc2ccccc2 62a_100000184471_100000685547 [0,1,0,0,0,1|2,0,0]=4 10526 B18R2.6483 Fc1cccc(c1)SCCOc2ccccc2 62a_100000685547_100000184471 [0,1,0,0,0,1|2,0,0]=4 10527 B18R2.6483 Fc1cccc(c1)SCCSc2ccccc2 62a_100000246102_100000685547 [0,1,0,0,0,1|2,0,0]=4 10528 B18R2.6483 Fc1cccc(c1)SCCSc2ccccc2 62a_100000685547_100000246102 [0,1,0,0,0,1|2,0,0]=4 10529 B18R2.6483 Fc1cccc(c1)SCOCc2ccccc2 62a_100000685547_100000763385 [0,1,0,0,0,1|0,0,0]=2 10530 B18R2.6483 Fc1cccc(c1)SCOCc2ccccc2 62a_100000763385_100000685547 [0,1,0,0,0,1|0,0,0]=2 10531 B18R2.6483 Fc1cccc(c1)SCSCc2ccccc2 62a_100000685547_200011217039 [0,1,0,0,0,1|0,1,0]=3 10532 B18R2.6483 Fc1cccc(c1)SCSCc2ccccc2 62a_200011217039_100000685547 [0,1,0,0,0,1|0,1,0]=3 10533 B18R2.6483 Fc1cccc(n1)CNCCc2ccccc2 2230a_100000106460_100009819644 [0,1,0,0,0,1|2,0,0]=4 10534 B18R2.6483 Fc1cccc(n1)CNCCc2ccccc2 2230a_100015188798_100000765856 [0,1,0,0,0,1|2,0,0]=4 10535 B18R2.6483 Fc1cccc(n1)CNCCc2ccccc2 270004a_100000106460_100000050434 [0,1,0,0,0,1|2,0,0]=4 10536 B18R2.6483 Fc1cccc(n1)CNCCc2ccccc2 34a_100000106460_100009819644 [0,1,0,0,0,1|2,0,0]=4 10537 B18R2.6483 Fc1cccc(n1)CNCCc2ccccc2 34a_100015188798_100000765856 [0,1,0,0,0,1|2,0,0]=4 10538 B18R2.6483 Fc1cccc(n1)CNCSc2ccccc2 2230a_100015188798_100011218342 [0,1,0,0,0,1|2,0,0]=4 10539 B18R2.6483 Fc1cccc(n1)COCCc2ccccc2 34a_100000086748_100000765856 [0,1,0,0,0,1|1,0,0]=3 10540 B18R2.6483 Fc1cccc(n1)COCCc2ccccc2 34a_100000210268_100009819644 [0,1,0,0,0,1|1,0,0]=3 10541 B18R2.6483 Fc1cccc(n1)COCCc2ccccc2 7a_100000210268_100009819644 [0,1,0,0,0,1|1,0,0]=3 10542 B18R2.6483 Fc1cccc(n1)COCCc2ccccn2 34a_100000210271_100009819644 [0,1,0,0,0,1|2,0,0]=4 10543 B18R2.6483 Fc1cccc(n1)COCCc2cccnc2 34a_100011217484_100009819644 [0,1,0,0,0,1|2,0,0]=4 10544 B18R2.6483 Fc1cccc(n1)COCCc2ccncc2 34a_100011216225_100009819644 [0,1,0,0,0,1|2,0,0]=4 10545 B18R2.6483 Fc1cccc(n1)CSCCc2ccccc2 62a_100000765856_100009819644 [0,1,0,0,0,1|1,1,0]=4 10546 B18R2.6483 Fc1cccc(n1)CSCCc2ccccc2 62a_100009819644_100011218657 [0,1,0,0,0,1|1,1,0]=4 10547 B18R2.6483 Fc1cccc(n1)CSCSc2ccccc2 62a_100009819644_100011218342 [0,1,0,0,0,1|1,1,0]=4 10548 B18R2.6483 Fc1cccc(n1)CSCSc2ccccc2 62a_100011218342_100009819644 [0,1,0,0,0,1|1,1,0]=4 10549 B18R2.6483 Fc1cccc(n1)NCCCc2ccccc2 27a_100000211184_100009815982 [0,1,0,0,0,1|2,0,0]=4 10550 B18R2.6483 Fc1cccc(n1)OCCCc2ccccc2 34a_100011432558_100000211621 [0,1,0,0,0,1|2,0,0]=4 10551 B18R2.6483 Fc1cccc(n1)OCOCc2ccccc2 34a_100011432558_100000763385 [0,1,0,0,0,1|1,0,0]=3 10552 B18R2.6483 Fc1cccc(n1)OCSCc2ccccc2 34a_100011432558_200011217039 [0,1,0,0,0,1|1,1,0]=4 10553 B18R2.6483 Fc1cccc(n1)SCCCc2ccccc2 62a_100000211621_100009815982 [0,1,0,0,0,1|2,0,0]=4 10554 B18R2.6483 Fc1cccc(n1)SCCCc2ccccc2 62a_100009815982_100000211621 [0,1,0,0,0,1|2,0,0]=4 10555 B18R2.6483 Fc1cccc(n1)SCOCc2ccccc2 62a_100000763385_100009815982 [0,1,0,0,0,1|1,0,0]=3 10556 B18R2.6483 Fc1cccc(n1)SCOCc2ccccc2 62a_100009815982_100000763385 [0,1,0,0,0,1|1,0,0]=3 10557 B18R2.6483 Fc1cccc(n1)SCSCc2ccccc2 62a_100009815982_200011217039 [0,1,0,0,0,1|1,1,0]=4 10558 B18R2.6483 Fc1cccc(n1)SCSCc2ccccc2 62a_200011217039_100009815982 [0,1,0,0,0,1|1,1,0]=4 10559 B18R2.6483 Fc1ccnc(c1)NCCCc2ccccc2 27a_100000211184_100000764206 [0,1,0,0,0,1|2,0,0]=4 10560 B18R2.6483 Fc1ccnc(c1)SCCCc2ccccc2 62a_100000211621_100000764206 [0,1,0,0,0,1|2,0,0]=4 10561 B18R2.6483 Fc1ccnc(c1)SCCCc2ccccc2 62a_100000764206_100000211621 [0,1,0,0,0,1|2,0,0]=4 10562 B18R2.6483 Fc1ccnc(c1)SCOCc2ccccc2 62a_100000763385_100000764206 [0,1,0,0,0,1|1,0,0]=3 10563 B18R2.6483 Fc1ccnc(c1)SCOCc2ccccc2 62a_100000764206_100000763385 [0,1,0,0,0,1|1,0,0]=3 10564 B18R2.6483 Fc1ccnc(c1)SCSCc2ccccc2 62a_100000764206_200011217039 [0,1,0,0,0,1|1,1,0]=4 10565 B18R2.6483 Fc1ccnc(c1)SCSCc2ccccc2 62a_200011217039_100000764206 [0,1,0,0,0,1|1,1,0]=4 10566 B18R2.6483 Fc1cncc(c1)CNCCc2ccccc2 207a_100000106460_100011361476 [0,1,0,0,0,1|2,0,0]=4 10567 B18R2.6483 Fc1cncc(c1)CNCCc2ccccc2 2230a_100000106460_100000725299 [0,1,0,0,0,1|2,0,0]=4 10568 B18R2.6483 Fc1cncc(c1)CNCCc2ccccc2 2230a_100011962886_100000765856 [0,1,0,0,0,1|2,0,0]=4 10569 B18R2.6483 Fc1cncc(c1)CNCCc2ccccc2 270004a_100000106460_100011361476 [0,1,0,0,0,1|2,0,0]=4 10570 B18R2.6483 Fc1cncc(c1)CNCCc2ccccc2 34a_100000106460_100000725299 [0,1,0,0,0,1|2,0,0]=4 10571 B18R2.6483 Fc1cncc(c1)CNCCc2ccccc2 34a_100011962886_100000765856 [0,1,0,0,0,1|2,0,0]=4 10572 B18R2.6483 Fc1cncc(c1)CNCSc2ccccc2 2230a_100011962886_100011218342 [0,1,0,0,0,1|2,0,0]=4 10573 B18R2.6483 Fc1cncc(c1)COCCc2ccccc2 34a_100000210268_100000725299 [0,1,0,0,0,1|1,0,0]=3 10574 B18R2.6483 Fc1cncc(c1)COCCc2ccccc2 34a_100011962875_100000765856 [0,1,0,0,0,1|1,0,0]=3 10575 B18R2.6483 Fc1cncc(c1)COCCc2ccccc2 7a_100000210268_100000725299 [0,1,0,0,0,1|1,0,0]=3 10576 B18R2.6483 Fc1cncc(c1)COCCc2ccccc2 7a_100011962875_100000765856 [0,1,0,0,0,1|1,0,0]=3 10577 B18R2.6483 Fc1cncc(c1)COCCc2ccccn2 34a_100000210271_100000725299 [0,1,0,0,0,1|2,0,0]=4 10578 B18R2.6483 Fc1cncc(c1)COCCc2ccccn2 7a_100011962875_100015183660 [0,1,0,0,0,1|2,0,0]=4 10579 B18R2.6483 Fc1cncc(c1)COCCc2cccnc2 34a_100011217484_100000725299 [0,1,0,0,0,1|2,0,0]=4 10580 B18R2.6483 Fc1cncc(c1)COCCc2cccnc2 7a_100011962875_200011713674 [0,1,0,0,0,1|2,0,0]=4 10581 B18R2.6483 Fc1cncc(c1)COCCc2ccncc2 34a_100011216225_100000725299 [0,1,0,0,0,1|2,0,0]=4 10582 B18R2.6483 Fc1cncc(c1)COCCc2ccncc2 7a_100011962875_100000723409 [0,1,0,0,0,1|2,0,0]=4 10583 B18R2.6483 Fc1cncc(c1)CSCCc2ccccc2 62a_100000725299_100011218657 [0,1,0,0,0,1|1,1,0]=4 10584 B18R2.6483 Fc1cncc(c1)CSCCc2ccccc2 62a_100000765856_100000725299 [0,1,0,0,0,1|1,1,0]=4 10585 B18R2.6483 Fc1cncc(c1)CSCSc2ccccc2 62a_100000725299_100011218342 [0,1,0,0,0,1|1,1,0]=4 10586 B18R2.6483 Fc1cncc(c1)CSCSc2ccccc2 62a_100011218342_100000725299 [0,1,0,0,0,1|1,1,0]=4 10587 B18R2.6483 Fc1cncc(c1)OCCCc2ccccc2 34a_100011830296_100000211621 [0,1,0,0,0,1|2,0,0]=4 10588 B18R2.6483 Fc1cncc(c1)OCCCc2ccccc2 7a_100011830296_100000211621 [0,1,0,0,0,1|2,0,0]=4 10589 B18R2.6483 Fc1cncc(c1)OCOCc2ccccc2 34a_100011830296_100000763385 [0,1,0,0,0,1|1,0,0]=3 10590 B18R2.6483 Fc1cncc(c1)OCSCc2ccccc2 34a_100011830296_200011217039 [0,1,0,0,0,1|1,1,0]=4 10591 B18R2.6483 Fc1cncc(c1)SCCCc2ccccc2 62a_100000211621_100000744099 [0,1,0,0,0,1|2,0,0]=4 10592 B18R2.6483 Fc1cncc(c1)SCCCc2ccccc2 62a_100000744099_100000211621 [0,1,0,0,0,1|2,0,0]=4 10593 B18R2.6483 Fc1cncc(c1)SCOCc2ccccc2 62a_100000744099_100000763385 [0,1,0,0,0,1|1,0,0]=3 10594 B18R2.6483 Fc1cncc(c1)SCOCc2ccccc2 62a_100000763385_100000744099 [0,1,0,0,0,1|1,0,0]=3 10595 B18R2.6483 Fc1cncc(c1)SCSCc2ccccc2 62a_100000744099_200011217039 [0,1,0,0,0,1|1,1,0]=4 10596 B18R2.6483 Fc1cncc(c1)SCSCc2ccccc2 62a_200011217039_100000744099 [0,1,0,0,0,1|1,1,0]=4 10597 B18R2.6483 Fc1cncc(n1)SCOCc2ccccc2 62a_100000763385_200009863489 [0,1,0,0,0,1|2,0,0]=4 10598 B18R2.6483 Fc1cncc(n1)SCOCc2ccccc2 62a_200009863489_100000763385 [0,1,0,0,0,1|2,0,0]=4 10599 B18R2.6483 Ic1cccc(c1)C=NNCc2ccccc2 4a_100000007032_100000014684 [0,1,0,0,0,1|1,0,1]=4 10600 B18R2.6483 Ic1cccc(c1)CNCCc2ccccc2 207a_100000106460_100000014684 [0,1,0,0,0,1|1,0,0]=3 10601 B18R2.6483 Ic1cccc(c1)CNCCc2ccccc2 2230a_100000106179_100000765856 [0,1,0,0,0,1|1,0,0]=3 10602 B18R2.6483 Ic1cccc(c1)CNCCc2ccccc2 2230a_100000106460_100011218688 [0,1,0,0,0,1|1,0,0]=3 10603 B18R2.6483 Ic1cccc(c1)CNCCc2ccccc2 270004a_100000106460_100000014684 [0,1,0,0,0,1|1,0,0]=3 10604 B18R2.6483 Ic1cccc(c1)CNCCc2ccccc2 34a_100000106179_100000765856 [0,1,0,0,0,1|1,0,0]=3 10605 B18R2.6483 Ic1cccc(c1)CNCCc2ccccc2 34a_100000106460_100011218688 [0,1,0,0,0,1|1,0,0]=3 10606 B18R2.6483 Ic1cccc(c1)CNCCc2ccccn2 207a_100000211156_100000014684 [0,1,0,0,0,1|2,0,0]=4 10607 B18R2.6483 Ic1cccc(c1)CNCCc2ccccn2 2230a_100000106179_100015183660 [0,1,0,0,0,1|2,0,0]=4 10608 B18R2.6483 Ic1cccc(c1)CNCCc2ccccn2 270004a_100000211156_100000014684 [0,1,0,0,0,1|2,0,0]=4 10609 B18R2.6483 Ic1cccc(c1)CNCCc2cccnc2 207a_100000736294_100000014684 [0,1,0,0,0,1|2,0,0]=4 10610 B18R2.6483 Ic1cccc(c1)CNCCc2cccnc2 2230a_100000106179_200011713674 [0,1,0,0,0,1|2,0,0]=4 10611 B18R2.6483 Ic1cccc(c1)CNCCc2cccnc2 2230a_100000736294_100011218688 [0,1,0,0,0,1|2,0,0]=4 10612 B18R2.6483 Ic1cccc(c1)CNCCc2cccnc2 270004a_100000736294_100000014684 [0,1,0,0,0,1|2,0,0]=4 10613 B18R2.6483 Ic1cccc(c1)CNCCc2ccncc2 207a_100000742849_100000014684 [0,1,0,0,0,1|2,0,0]=4 10614 B18R2.6483 Ic1cccc(c1)CNCCc2ccncc2 2230a_100000106179_100000723409 [0,1,0,0,0,1|2,0,0]=4 10615 B18R2.6483 Ic1cccc(c1)CNCCc2ccncc2 270004a_100000742849_100000014684 [0,1,0,0,0,1|2,0,0]=4 10616 B18R2.6483 Ic1cccc(c1)CNCSc2ccccc2 2230a_100000106179_100011218342 [0,1,0,0,0,1|1,0,0]=3 10617 B18R2.6483 Ic1cccc(c1)COCCc2ccccc2 34a_100000210268_100011218688 [0,1,0,0,0,1|0,0,0]=2 10618 B18R2.6483 Ic1cccc(c1)COCCc2ccccc2 34a_100011215336_100000765856 [0,1,0,0,0,1|0,0,0]=2 10619 B18R2.6483 Ic1cccc(c1)COCCc2ccccc2 7a_100000210268_100011218688 [0,1,0,0,0,1|0,0,0]=2 10620 B18R2.6483 Ic1cccc(c1)COCCc2ccccc2 7a_100011215336_100000765856 [0,1,0,0,0,1|0,0,0]=2 10621 B18R2.6483 Ic1cccc(c1)COCCc2ccccn2 34a_100000210271_100011218688 [0,1,0,0,0,1|1,0,0]=3 10622 B18R2.6483 Ic1cccc(c1)COCCc2ccccn2 7a_100011215336_100015183660 [0,1,0,0,0,1|1,0,0]=3 10623 B18R2.6483 Ic1cccc(c1)COCCc2cccnc2 34a_100011217484_100011218688 [0,1,0,0,0,1|1,0,0]=3 10624 B18R2.6483 Ic1cccc(c1)COCCc2cccnc2 7a_100011215336_200011713674 [0,1,0,0,0,1|1,0,0]=3 10625 B18R2.6483 Ic1cccc(c1)COCCc2ccncc2 34a_100011216225_100011218688 [0,1,0,0,0,1|1,0,0]=3 10626 B18R2.6483 Ic1cccc(c1)COCCc2ccncc2 7a_100011215336_100000723409 [0,1,0,0,0,1|1,0,0]=3 10627 B18R2.6483 Ic1cccc(c1)COCCc2cnccn2 34a_100011349526_100011218688 [0,1,0,0,0,1|2,0,0]=4 10628 B18R2.6483 Ic1cccc(c1)COCCc2cncnc2 34a_100011709255_100011218688 [0,1,0,0,0,1|2,0,0]=4 10629 B18R2.6483 Ic1cccc(c1)CSCCc2ccccc2 62a_100000765856_100011218688 [0,1,0,0,0,1|0,1,0]=3 10630 B18R2.6483 Ic1cccc(c1)CSCCc2ccccc2 62a_100011218688_100011218657 [0,1,0,0,0,1|0,1,0]=3 10631 B18R2.6483 Ic1cccc(c1)CSCCc2ccccn2 62a_100011218688_100015183660 [0,1,0,0,0,1|1,1,0]=4 10632 B18R2.6483 Ic1cccc(c1)CSCCc2ccccn2 62a_100015183660_100011218688 [0,1,0,0,0,1|1,1,0]=4 10633 B18R2.6483 Ic1cccc(c1)CSCCc2cccnc2 62a_100011218688_200011713674 [0,1,0,0,0,1|1,1,0]=4 10634 B18R2.6483 Ic1cccc(c1)CSCCc2cccnc2 62a_200011713674_100011218688 [0,1,0,0,0,1|1,1,0]=4 10635 B18R2.6483 Ic1cccc(c1)CSCCc2ccncc2 62a_100000723409_100011218688 [0,1,0,0,0,1|1,1,0]=4 10636 B18R2.6483 Ic1cccc(c1)CSCCc2ccncc2 62a_100011218688_100000723409 [0,1,0,0,0,1|1,1,0]=4 10637 B18R2.6483 Ic1cccc(c1)CSCSc2ccccc2 62a_100011218342_100011218688 [0,1,0,0,0,1|0,1,0]=3 10638 B18R2.6483 Ic1cccc(c1)CSCSc2ccccc2 62a_100011218688_100011218342 [0,1,0,0,0,1|0,1,0]=3 10639 B18R2.6483 Ic1cccc(c1)NC/C=C/c2ccccc2 34a_100000211102_100016265936 [0,1,0,0,0,1|1,0,1]=4 10640 B18R2.6483 Ic1cccc(c1)NCC#Cc2ccccc2 34a_100000211102_100011352542 [0,1,0,0,0,1|1,0,1]=4 10641 B18R2.6483 Ic1cccc(c1)NCCCc2ccccc2 34a_100000211102_100000211621 [0,1,0,0,0,1|1,0,0]=3 10642 B18R2.6483 Ic1cccc(c1)NCCOc2ccccc2 34a_100000211102_100000184471 [0,1,0,0,0,1|2,0,0]=4 10643 B18R2.6483 Ic1cccc(c1)NCCSc2ccccc2 34a_100000211102_100000246102 [0,1,0,0,0,1|2,0,0]=4 10644 B18R2.6483 Ic1cccc(c1)NCOCc2ccccc2 34a_100000211102_100000763385 [0,1,0,0,0,1|0,0,0]=2 10645 B18R2.6483 Ic1cccc(c1)NCSCc2ccccc2 34a_100000211102_200011217039 [0,1,0,0,0,1|0,1,0]=3 10646 B18R2.6483 Ic1cccc(c1)NN=CCc2ccccc2 4a_100020605690_100000209964 [0,1,0,0,0,1|2,0,0]=4 10647 B18R2.6483 Ic1cccc(c1)OC/C=C/c2ccccc2 34a_100000211634_100016265936 [0,1,0,0,0,1|1,0,1]=4 10648 B18R2.6483 Ic1cccc(c1)OC/C=C/c2ccccc2 7a_100000211634_100016265936 [0,1,0,0,0,1|1,0,1]=4 10649 B18R2.6483 Ic1cccc(c1)OCC#Cc2ccccc2 34a_100000211634_100011352542 [0,1,0,0,0,1|1,0,1]=4 10650 B18R2.6483 Ic1cccc(c1)OCC#Cc2ccccc2 7a_100000211634_100011352542 [0,1,0,0,0,1|1,0,1]=4 10651 B18R2.6483 Ic1cccc(c1)OCCCc2ccccc2 34a_100000211634_100000211621 [0,1,0,0,0,1|1,0,0]=3 10652 B18R2.6483 Ic1cccc(c1)OCCCc2ccccc2 7a_100000211634_100000211621 [0,1,0,0,0,1|1,0,0]=3 10653 B18R2.6483 Ic1cccc(c1)OCCOc2ccccc2 34a_100000211634_100000184471 [0,1,0,0,0,1|2,0,0]=4 10654 B18R2.6483 Ic1cccc(c1)OCCOc2ccccc2 7a_100000211634_100000184471 [0,1,0,0,0,1|2,0,0]=4 10655 B18R2.6483 Ic1cccc(c1)OCCSc2ccccc2 34a_100000211634_100000246102 [0,1,0,0,0,1|2,0,0]=4 10656 B18R2.6483 Ic1cccc(c1)OCCSc2ccccc2 7a_100000211634_100000246102 [0,1,0,0,0,1|2,0,0]=4 10657 B18R2.6483 Ic1cccc(c1)OCOCc2ccccc2 34a_100000211634_100000763385 [0,1,0,0,0,1|0,0,0]=2 10658 B18R2.6483 Ic1cccc(c1)OCSCc2ccccc2 34a_100000211634_200011217039 [0,1,0,0,0,1|0,1,0]=3 10659 B18R2.6483 Nc1cc(ccn1)OCCCc2ccccc2 34a_100011834064_100000211621 [0,1,0,0,0,1|2,0,0]=4 10660 B18R2.6483 Nc1cc(ccn1)OCOCc2ccccc2 34a_100011834064_100000763385 [0,1,0,0,0,1|1,0,0]=3 10661 B18R2.6483 Nc1cc(ccn1)OCSCc2ccccc2 34a_100011834064_200011217039 [0,1,0,0,0,1|1,1,0]=4 10662 B18R2.6483 Nc1cc(ccn1)SCCCc2ccccc2 62a_100000049665_100000211621 [0,1,0,0,0,1|2,0,0]=4 10663 B18R2.6483 Nc1cc(ccn1)SCCCc2ccccc2 62a_100000211621_100000049665 [0,1,0,0,0,1|2,0,0]=4 10664 B18R2.6483 Nc1cc(ccn1)SCOCc2ccccc2 62a_100000049665_100000763385 [0,1,0,0,0,1|1,0,0]=3 10665 B18R2.6483 Nc1cc(ccn1)SCOCc2ccccc2 62a_100000763385_100000049665 [0,1,0,0,0,1|1,0,0]=3 10666 B18R2.6483 Nc1cc(ccn1)SCSCc2ccccc2 62a_100000049665_200011217039 [0,1,0,0,0,1|1,1,0]=4 10667 B18R2.6483 Nc1cc(ccn1)SCSCc2ccccc2 62a_200011217039_100000049665 [0,1,0,0,0,1|1,1,0]=4 10668 B18R2.6483 Nc1cc(cnn1)OCOCc2ccccc2 34a_200015193112_100000763385 [0,1,0,0,0,1|2,0,0]=4 10669 B18R2.6483 Nc1cc(cnn1)SCOCc2ccccc2 62a_100000130277_100000763385 [0,1,0,0,0,1|2,0,0]=4 10670 B18R2.6483 Nc1cc(cnn1)SCOCc2ccccc2 62a_100000763385_100000130277 [0,1,0,0,0,1|2,0,0]=4 10671 B18R2.6483 Nc1cc(ncn1)SCOCc2ccccc2 62a_100000701291_100000763385 [0,1,0,0,0,1|2,0,0]=4 10672 B18R2.6483 Nc1cc(ncn1)SCOCc2ccccc2 62a_100000763385_100000701291 [0,1,0,0,0,1|2,0,0]=4 10673 B18R2.6483 Nc1cccc(c1)CCOCc2ccccc2 34a_100011996697_100015291786 [0,1,0,0,0,1|0,0,0]=2 10674 B18R2.6483 Nc1cccc(c1)CCOCc2ccccn2 34a_100011996697_100000721315 [0,1,0,0,0,1|1,0,0]=3 10675 B18R2.6483 Nc1cccc(c1)CCOCc2cccnc2 34a_100011996697_100000733263 [0,1,0,0,0,1|1,0,0]=3 10676 B18R2.6483 Nc1cccc(c1)CCOCc2cccnn2 34a_100011996697_100016990269 [0,1,0,0,0,1|2,0,0]=4 10677 B18R2.6483 Nc1cccc(c1)CCOCc2cnccn2 34a_100011996697_100016995436 [0,1,0,0,0,1|2,0,0]=4 10678 B18R2.6483 Nc1cccc(c1)CCOCc2cncnc2 34a_100011996697_100015196519 [0,1,0,0,0,1|2,0,0]=4 10679 B18R2.6483 Nc1cccc(c1)CCOCc2ncccn2 34a_100011996697_100000703007 [0,1,0,0,0,1|2,0,0]=4 10680 B18R2.6483 Nc1cccc(c1)COCCc2ccccc2 34a_100000211919_100000765856 [0,1,0,0,0,1|0,0,0]=2 10681 B18R2.6483 Nc1cccc(c1)OC/C=C/c2ccccc2 34a_100000210217_100016265936 [0,1,0,0,0,1|1,0,1]=4 10682 B18R2.6483 Nc1cccc(c1)OCC#Cc2ccccc2 34a_100000210217_100011352542 [0,1,0,0,0,1|1,0,1]=4 10683 B18R2.6483 Nc1cccc(c1)OCCCc2ccccc2 34a_100000210217_100000211621 [0,1,0,0,0,1|1,0,0]=3 10684 B18R2.6483 Nc1cccc(c1)OCCOc2ccccc2 34a_100000210217_100000184471 [0,1,0,0,0,1|2,0,0]=4 10685 B18R2.6483 Nc1cccc(c1)OCCSc2ccccc2 34a_100000210217_100000246102 [0,1,0,0,0,1|2,0,0]=4 10686 B18R2.6483 Nc1cccc(c1)OCOCc2ccccc2 34a_100000210217_100000763385 [0,1,0,0,0,1|0,0,0]=2 10687 B18R2.6483 Nc1cccc(c1)OCSCc2ccccc2 34a_100000210217_200011217039 [0,1,0,0,0,1|0,1,0]=3 10688 B18R2.6483 Nc1cccc(c1)SC/C=C/c2ccccc2 62a_100000210019_100016265936 [0,1,0,0,0,1|1,0,1]=4 10689 B18R2.6483 Nc1cccc(c1)SC/C=C/c2ccccc2 62a_100016265936_100000210019 [0,1,0,0,0,1|1,0,1]=4 10690 B18R2.6483 Nc1cccc(c1)SCC#Cc2ccccc2 62a_100000210019_100011352542 [0,1,0,0,0,1|1,0,1]=4 10691 B18R2.6483 Nc1cccc(c1)SCCCc2ccccc2 62a_100000210019_100000211621 [0,1,0,0,0,1|1,0,0]=3 10692 B18R2.6483 Nc1cccc(c1)SCCCc2ccccc2 62a_100000211621_100000210019 [0,1,0,0,0,1|1,0,0]=3 10693 B18R2.6483 Nc1cccc(c1)SCCOc2ccccc2 62a_100000184471_100000210019 [0,1,0,0,0,1|2,0,0]=4 10694 B18R2.6483 Nc1cccc(c1)SCCOc2ccccc2 62a_100000210019_100000184471 [0,1,0,0,0,1|2,0,0]=4 10695 B18R2.6483 Nc1cccc(c1)SCCSc2ccccc2 62a_100000210019_100000246102 [0,1,0,0,0,1|2,0,0]=4 10696 B18R2.6483 Nc1cccc(c1)SCCSc2ccccc2 62a_100000246102_100000210019 [0,1,0,0,0,1|2,0,0]=4 10697 B18R2.6483 Nc1cccc(c1)SCOCc2ccccc2 62a_100000210019_100000763385 [0,1,0,0,0,1|0,0,0]=2 10698 B18R2.6483 Nc1cccc(c1)SCOCc2ccccc2 62a_100000763385_100000210019 [0,1,0,0,0,1|0,0,0]=2 10699 B18R2.6483 Nc1cccc(c1)SCSCc2ccccc2 62a_100000210019_200011217039 [0,1,0,0,0,1|0,1,0]=3 10700 B18R2.6483 Nc1cccc(c1)SCSCc2ccccc2 62a_200011217039_100000210019 [0,1,0,0,0,1|0,1,0]=3 10701 B18R2.6483 Nc1cccc(n1)SCCCc2ccccc2 62a_100000211621_100000740741 [0,1,0,0,0,1|2,0,0]=4 10702 B18R2.6483 Nc1cccc(n1)SCCCc2ccccc2 62a_100000740741_100000211621 [0,1,0,0,0,1|2,0,0]=4 10703 B18R2.6483 Nc1cccc(n1)SCOCc2ccccc2 62a_100000740741_100000763385 [0,1,0,0,0,1|1,0,0]=3 10704 B18R2.6483 Nc1cccc(n1)SCOCc2ccccc2 62a_100000763385_100000740741 [0,1,0,0,0,1|1,0,0]=3 10705 B18R2.6483 Nc1cccc(n1)SCSCc2ccccc2 62a_100000740741_200011217039 [0,1,0,0,0,1|1,1,0]=4 10706 B18R2.6483 Nc1cccc(n1)SCSCc2ccccc2 62a_200011217039_100000740741 [0,1,0,0,0,1|1,1,0]=4 10707 B18R2.6483 Nc1ccnc(c1)COCCc2ccccc2 34a_100000692640_100000765856 [0,1,0,0,0,1|1,0,0]=3 10708 B18R2.6483 Nc1ccnc(c1)SCCCc2ccccc2 62a_100000211621_100009814236 [0,1,0,0,0,1|2,0,0]=4 10709 B18R2.6483 Nc1ccnc(c1)SCCCc2ccccc2 62a_100009814236_100000211621 [0,1,0,0,0,1|2,0,0]=4 10710 B18R2.6483 Nc1ccnc(c1)SCOCc2ccccc2 62a_100000763385_100009814236 [0,1,0,0,0,1|1,0,0]=3 10711 B18R2.6483 Nc1ccnc(c1)SCOCc2ccccc2 62a_100009814236_100000763385 [0,1,0,0,0,1|1,0,0]=3 10712 B18R2.6483 Nc1ccnc(c1)SCSCc2ccccc2 62a_100009814236_200011217039 [0,1,0,0,0,1|1,1,0]=4 10713 B18R2.6483 Nc1ccnc(c1)SCSCc2ccccc2 62a_200011217039_100009814236 [0,1,0,0,0,1|1,1,0]=4 10714 B18R2.6483 Nc1ccnc(n1)SCOCc2ccccc2 62a_100000757536_100000763385 [0,1,0,0,0,1|2,0,0]=4 10715 B18R2.6483 Nc1ccnc(n1)SCOCc2ccccc2 62a_100000763385_100000757536 [0,1,0,0,0,1|2,0,0]=4 10716 B18R2.6483 Nc1cncc(c1)COCCc2ccccc2 34a_100000085308_100000765856 [0,1,0,0,0,1|1,0,0]=3 10717 B18R2.6483 Nc1cncc(c1)OCCCc2ccccc2 34a_100011997051_100000211621 [0,1,0,0,0,1|2,0,0]=4 10718 B18R2.6483 Nc1cncc(c1)OCOCc2ccccc2 34a_100011997051_100000763385 [0,1,0,0,0,1|1,0,0]=3 10719 B18R2.6483 Nc1cncc(c1)OCSCc2ccccc2 34a_100011997051_200011217039 [0,1,0,0,0,1|1,1,0]=4 10720 B18R2.6483 Nc1cncc(c1)SCCCc2ccccc2 62a_100000211621_100000687067 [0,1,0,0,0,1|2,0,0]=4 10721 B18R2.6483 Nc1cncc(c1)SCCCc2ccccc2 62a_100000687067_100000211621 [0,1,0,0,0,1|2,0,0]=4 10722 B18R2.6483 Nc1cncc(c1)SCOCc2ccccc2 62a_100000687067_100000763385 [0,1,0,0,0,1|1,0,0]=3 10723 B18R2.6483 Nc1cncc(c1)SCOCc2ccccc2 62a_100000763385_100000687067 [0,1,0,0,0,1|1,0,0]=3 10724 B18R2.6483 Nc1cncc(c1)SCSCc2ccccc2 62a_100000687067_200011217039 [0,1,0,0,0,1|1,1,0]=4 10725 B18R2.6483 Nc1cncc(c1)SCSCc2ccccc2 62a_200011217039_100000687067 [0,1,0,0,0,1|1,1,0]=4 10726 B18R2.6483 Nc1cncc(n1)SCOCc2ccccc2 62a_100000747728_100000763385 [0,1,0,0,0,1|2,0,0]=4 10727 B18R2.6483 Nc1cncc(n1)SCOCc2ccccc2 62a_100000763385_100000747728 [0,1,0,0,0,1|2,0,0]=4 10728 B18R2.6483 Nc1cnnc(c1)SCOCc2ccccc2 62a_100000763385_100011996757 [0,1,0,0,0,1|2,0,0]=4 10729 B18R2.6483 Nc1cnnc(c1)SCOCc2ccccc2 62a_100011996757_100000763385 [0,1,0,0,0,1|2,0,0]=4 10730 B18R2.6483 Nc1nccc(n1)SCOCc2ccccc2 62a_100000055538_100000763385 [0,1,0,0,0,1|2,0,0]=4 10731 B18R2.6483 Nc1nccc(n1)SCOCc2ccccc2 62a_100000763385_100000055538 [0,1,0,0,0,1|2,0,0]=4 10732 B18R2.6483 O=c1cc(cc[nH]1)NCCCc2ccccc2 27a_100000211184_100000061649 [0,1,0,0,0,1|2,0,0]=4 10733 B18R2.6483 O=c1cc(cc[nH]1)OCCCc2ccccc2 34a_100000032262_100000211621 [0,1,0,0,0,1|2,0,0]=4 10734 B18R2.6483 O=c1cc(cc[nH]1)OCOCc2ccccc2 34a_100000032262_100000763385 [0,1,0,0,0,1|1,0,0]=3 10735 B18R2.6483 O=c1cc(cc[nH]1)OCSCc2ccccc2 34a_100000032262_200011217039 [0,1,0,0,0,1|1,1,0]=4 10736 B18R2.6483 O=c1cc(cc[nH]1)SCCCc2ccccc2 62a_100000211621_100009816521 [0,1,0,0,0,1|2,0,0]=4 10737 B18R2.6483 O=c1cc(cc[nH]1)SCCCc2ccccc2 62a_100009816521_100000211621 [0,1,0,0,0,1|2,0,0]=4 10738 B18R2.6483 O=c1cc(cc[nH]1)SCOCc2ccccc2 62a_100000763385_100009816521 [0,1,0,0,0,1|1,0,0]=3 10739 B18R2.6483 O=c1cc(cc[nH]1)SCOCc2ccccc2 62a_100009816521_100000763385 [0,1,0,0,0,1|1,0,0]=3 10740 B18R2.6483 O=c1cc(cc[nH]1)SCSCc2ccccc2 62a_100009816521_200011217039 [0,1,0,0,0,1|1,1,0]=4 10741 B18R2.6483 O=c1cc(cc[nH]1)SCSCc2ccccc2 62a_200011217039_100009816521 [0,1,0,0,0,1|1,1,0]=4 10742 B18R2.6483 O=c1cc(cn[nH]1)SCOCc2ccccc2 62a_100000763385_100010197405 [0,1,0,0,0,1|2,0,0]=4 10743 B18R2.6483 O=c1cc(nc[nH]1)SCOCc2ccccc2 62a_100012002517_100000763385 [0,1,0,0,0,1|2,0,0]=4 10744 B18R2.6483 O=c1cc[nH]c(c1)SCCCc2ccccc2 62a_100009817434_100000211621 [0,1,0,0,0,1|2,0,0]=4 10745 B18R2.6483 O=c1cc[nH]c(c1)SCOCc2ccccc2 62a_100009817434_100000763385 [0,1,0,0,0,1|1,0,0]=3 10746 B18R2.6483 O=c1cc[nH]c(c1)SCSCc2ccccc2 62a_100009817434_200011217039 [0,1,0,0,0,1|1,1,0]=4 10747 B18R2.6483 O=c1cccc([nH]1)CNCCc2ccccc2 207a_100000106460_100011935257 [0,1,0,0,0,1|2,0,0]=4 10748 B18R2.6483 O=c1cccc([nH]1)CNCCc2ccccc2 2230a_100000696482_100000765856 [0,1,0,0,0,1|2,0,0]=4 10749 B18R2.6483 O=c1cccc([nH]1)CNCSc2ccccc2 2230a_100000696482_100011218342 [0,1,0,0,0,1|2,0,0]=4 10750 B18R2.6483 O=c1cccc([nH]1)OCCCc2ccccc2 34a_100000033347_100000211621 [0,1,0,0,0,1|2,0,0]=4 10751 B18R2.6483 O=c1cccc([nH]1)OCOCc2ccccc2 34a_100000033347_100000763385 [0,1,0,0,0,1|1,0,0]=3 10752 B18R2.6483 O=c1cccc([nH]1)OCSCc2ccccc2 34a_100000033347_200011217039 [0,1,0,0,0,1|1,1,0]=4 10753 B18R2.6483 O=c1cccc([nH]1)SCCCc2ccccc2 62a_100000211621_100000752884 [0,1,0,0,0,1|2,0,0]=4 10754 B18R2.6483 O=c1cccc([nH]1)SCOCc2ccccc2 62a_100000763385_100000752884 [0,1,0,0,0,1|1,0,0]=3 10755 B18R2.6483 O=c1cccc([nH]1)SCSCc2ccccc2 62a_200011217039_100000752884 [0,1,0,0,0,1|1,1,0]=4 10756 B18R2.6483 O=c1nc(cc[nH]1)SCOCc2ccccc2 62a_100000763385_200000134032 [0,1,0,0,0,1|2,0,0]=4 10757 B18R2.6483 Oc1cc(ccn1)CNCCc2ccccc2 207a_100000106460_100000688113 [0,1,0,0,0,1|2,0,0]=4 10758 B18R2.6483 Oc1cc(ncn1)SCOCc2ccccc2 62a_100000763385_100000765262 [0,1,0,0,0,1|2,0,0]=4 10759 B18R2.6483 Oc1cccc(c1)C=NNCc2ccccc2 4a_100000007032_100000188321 [0,1,0,0,0,1|1,0,1]=4 10760 B18R2.6483 Oc1cccc(c1)CCNCc2ccccc2 2230a_100000747277_100015291786 [0,1,0,0,0,1|1,0,0]=3 10761 B18R2.6483 Oc1cccc(c1)CCNCc2ccccc2 34a_100000747277_100015291786 [0,1,0,0,0,1|1,0,0]=3 10762 B18R2.6483 Oc1cccc(c1)CCNCc2ccccn2 2230a_100000747277_100000721315 [0,1,0,0,0,1|2,0,0]=4 10763 B18R2.6483 Oc1cccc(c1)CCNCc2ccccn2 34a_100000747277_100000721315 [0,1,0,0,0,1|2,0,0]=4 10764 B18R2.6483 Oc1cccc(c1)CCNCc2cccnc2 2230a_100000747277_100000741622 [0,1,0,0,0,1|2,0,0]=4 10765 B18R2.6483 Oc1cccc(c1)CCNCc2cccnc2 34a_100000747277_100000733263 [0,1,0,0,0,1|2,0,0]=4 10766 B18R2.6483 Oc1cccc(c1)CCNCc2ccncc2 2230a_100000747277_100015193705 [0,1,0,0,0,1|2,0,0]=4 10767 B18R2.6483 Oc1cccc(c1)CNCCc2ccccc2 207a_100000106460_100000188321 [0,1,0,0,0,1|1,0,0]=3 10768 B18R2.6483 Oc1cccc(c1)CNCCc2ccccc2 2230a_100000106460_100011660834 [0,1,0,0,0,1|1,0,0]=3 10769 B18R2.6483 Oc1cccc(c1)CNCCc2ccccc2 2230a_100000743036_100000765856 [0,1,0,0,0,1|1,0,0]=3 10770 B18R2.6483 Oc1cccc(c1)CNCCc2ccccc2 270004a_100000106460_100000188321 [0,1,0,0,0,1|1,0,0]=3 10771 B18R2.6483 Oc1cccc(c1)CNCCc2ccccc2 34a_100000106460_100011660834 [0,1,0,0,0,1|1,0,0]=3 10772 B18R2.6483 Oc1cccc(c1)CNCCc2ccccc2 34a_100000743036_100000765856 [0,1,0,0,0,1|1,0,0]=3 10773 B18R2.6483 Oc1cccc(c1)CNCCc2ccccn2 207a_100000211156_100000188321 [0,1,0,0,0,1|2,0,0]=4 10774 B18R2.6483 Oc1cccc(c1)CNCCc2ccccn2 2230a_100000743036_100015183660 [0,1,0,0,0,1|2,0,0]=4 10775 B18R2.6483 Oc1cccc(c1)CNCCc2ccccn2 270004a_100000211156_100000188321 [0,1,0,0,0,1|2,0,0]=4 10776 B18R2.6483 Oc1cccc(c1)CNCCc2cccnc2 207a_100000736294_100000188321 [0,1,0,0,0,1|2,0,0]=4 10777 B18R2.6483 Oc1cccc(c1)CNCCc2cccnc2 2230a_100000736294_100011660834 [0,1,0,0,0,1|2,0,0]=4 10778 B18R2.6483 Oc1cccc(c1)CNCCc2cccnc2 2230a_100000743036_200011713674 [0,1,0,0,0,1|2,0,0]=4 10779 B18R2.6483 Oc1cccc(c1)CNCCc2cccnc2 270004a_100000736294_100000188321 [0,1,0,0,0,1|2,0,0]=4 10780 B18R2.6483 Oc1cccc(c1)CNCCc2ccncc2 207a_100000742849_100000188321 [0,1,0,0,0,1|2,0,0]=4 10781 B18R2.6483 Oc1cccc(c1)CNCCc2ccncc2 2230a_100000743036_100000723409 [0,1,0,0,0,1|2,0,0]=4 10782 B18R2.6483 Oc1cccc(c1)CNCCc2ccncc2 270004a_100000742849_100000188321 [0,1,0,0,0,1|2,0,0]=4 10783 B18R2.6483 Oc1cccc(c1)CNCSc2ccccc2 2230a_100000743036_100011218342 [0,1,0,0,0,1|1,0,0]=3 10784 B18R2.6483 Oc1cccc(c1)COCCc2ccccc2 34a_100000210268_100011660834 [0,1,0,0,0,1|0,0,0]=2 10785 B18R2.6483 Oc1cccc(c1)COCCc2ccccc2 7a_100000210268_100000084143 [0,1,0,0,0,1|0,0,0]=2 10786 B18R2.6483 Oc1cccc(c1)COCCc2ccccn2 34a_100000210271_100011660834 [0,1,0,0,0,1|1,0,0]=3 10787 B18R2.6483 Oc1cccc(c1)COCCc2cccnc2 34a_100011217484_100011660834 [0,1,0,0,0,1|1,0,0]=3 10788 B18R2.6483 Oc1cccc(c1)COCCc2ccncc2 34a_100011216225_100011660834 [0,1,0,0,0,1|1,0,0]=3 10789 B18R2.6483 Oc1cccc(c1)COCCc2cnccn2 34a_100011349526_100011660834 [0,1,0,0,0,1|2,0,0]=4 10790 B18R2.6483 Oc1cccc(c1)COCCc2cncnc2 34a_100011709255_100011660834 [0,1,0,0,0,1|2,0,0]=4 10791 B18R2.6483 Oc1cccc(c1)CSCCc2ccccc2 62a_100000765856_100011660834 [0,1,0,0,0,1|0,1,0]=3 10792 B18R2.6483 Oc1cccc(c1)CSCCc2ccccc2 62a_100011660834_100011218657 [0,1,0,0,0,1|0,1,0]=3 10793 B18R2.6483 Oc1cccc(c1)CSCCc2ccccn2 62a_100011660834_100015183660 [0,1,0,0,0,1|1,1,0]=4 10794 B18R2.6483 Oc1cccc(c1)CSCCc2ccccn2 62a_100015183660_100011660834 [0,1,0,0,0,1|1,1,0]=4 10795 B18R2.6483 Oc1cccc(c1)CSCCc2cccnc2 62a_100011660834_200011713674 [0,1,0,0,0,1|1,1,0]=4 10796 B18R2.6483 Oc1cccc(c1)CSCCc2cccnc2 62a_200011713674_100011660834 [0,1,0,0,0,1|1,1,0]=4 10797 B18R2.6483 Oc1cccc(c1)CSCCc2ccncc2 62a_100000723409_100011660834 [0,1,0,0,0,1|1,1,0]=4 10798 B18R2.6483 Oc1cccc(c1)CSCCc2ccncc2 62a_100011660834_100000723409 [0,1,0,0,0,1|1,1,0]=4 10799 B18R2.6483 Oc1cccc(c1)CSCSc2ccccc2 62a_100011218342_100011660834 [0,1,0,0,0,1|0,1,0]=3 10800 B18R2.6483 Oc1cccc(c1)CSCSc2ccccc2 62a_100011660834_100011218342 [0,1,0,0,0,1|0,1,0]=3 10801 B18R2.6483 Oc1cccc(c1)NC/C=C/c2ccccc2 34a_100000210217_100016265936 [0,1,0,0,0,1|1,0,1]=4 10802 B18R2.6483 Oc1cccc(c1)NCC#Cc2ccccc2 34a_100000210217_100011352542 [0,1,0,0,0,1|1,0,1]=4 10803 B18R2.6483 Oc1cccc(c1)NCCCc2ccccc2 34a_100000210217_100000211621 [0,1,0,0,0,1|1,0,0]=3 10804 B18R2.6483 Oc1cccc(c1)NCCOc2ccccc2 34a_100000210217_100000184471 [0,1,0,0,0,1|2,0,0]=4 10805 B18R2.6483 Oc1cccc(c1)NCCSc2ccccc2 34a_100000210217_100000246102 [0,1,0,0,0,1|2,0,0]=4 10806 B18R2.6483 Oc1cccc(c1)NCOCc2ccccc2 34a_100000210217_100000763385 [0,1,0,0,0,1|0,0,0]=2 10807 B18R2.6483 Oc1cccc(c1)NCSCc2ccccc2 34a_100000210217_200011217039 [0,1,0,0,0,1|0,1,0]=3 10808 B18R2.6483 Oc1cccc(c1)SC/C=C/c2ccccc2 62a_100016265936_100000211634 [0,1,0,0,0,1|1,0,1]=4 10809 B18R2.6483 Oc1cccc(c1)SCCCc2ccccc2 62a_100000211621_100000211634 [0,1,0,0,0,1|1,0,0]=3 10810 B18R2.6483 Oc1cccc(c1)SCCOc2ccccc2 62a_100000184471_100000211634 [0,1,0,0,0,1|2,0,0]=4 10811 B18R2.6483 Oc1cccc(c1)SCCSc2ccccc2 62a_100000246102_100000211634 [0,1,0,0,0,1|2,0,0]=4 10812 B18R2.6483 Oc1cccc(c1)SCOCc2ccccc2 62a_100000763385_100000211634 [0,1,0,0,0,1|0,0,0]=2 10813 B18R2.6483 Oc1cccc(c1)SCSCc2ccccc2 62a_200011217039_100000211634 [0,1,0,0,0,1|0,1,0]=3 10814 B18R2.6483 Oc1ccnc(c1)SCCCc2ccccc2 62a_100000211621_100000762945 [0,1,0,0,0,1|2,0,0]=4 10815 B18R2.6483 Oc1ccnc(c1)SCOCc2ccccc2 62a_100000763385_100000762945 [0,1,0,0,0,1|1,0,0]=3 10816 B18R2.6483 Oc1ccnc(c1)SCSCc2ccccc2 62a_200011217039_100000762945 [0,1,0,0,0,1|1,1,0]=4 10817 B18R2.6483 Oc1ccnc(n1)SCOCc2ccccc2 62a_100000763385_100011649813 [0,1,0,0,0,1|2,0,0]=4 10818 B18R2.6483 Oc1cncc(c1)CNCCc2ccccc2 207a_100000106460_100012187055 [0,1,0,0,0,1|2,0,0]=4 10819 B18R2.6483 Oc1cncc(c1)CNCCc2ccccc2 270004a_100000106460_100012187055 [0,1,0,0,0,1|2,0,0]=4 10820 B18R2.6483 Oc1cncc(c1)SCCCc2ccccc2 62a_100000211621_100000754920 [0,1,0,0,0,1|2,0,0]=4 10821 B18R2.6483 Oc1cncc(c1)SCCCc2ccccc2 62a_100000754920_100000211621 [0,1,0,0,0,1|2,0,0]=4 10822 B18R2.6483 Oc1cncc(c1)SCOCc2ccccc2 62a_100000754920_100000763385 [0,1,0,0,0,1|1,0,0]=3 10823 B18R2.6483 Oc1cncc(c1)SCOCc2ccccc2 62a_100000763385_100000754920 [0,1,0,0,0,1|1,0,0]=3 10824 B18R2.6483 Oc1cncc(c1)SCSCc2ccccc2 62a_100000754920_200011217039 [0,1,0,0,0,1|1,1,0]=4 10825 B18R2.6483 Oc1cncc(c1)SCSCc2ccccc2 62a_200011217039_100000754920 [0,1,0,0,0,1|1,1,0]=4 10826 B18R2.6483 Oc1cncc(n1)SCOCc2ccccc2 62a_100000763385_100011269956 [0,1,0,0,0,1|2,0,0]=4 10827 B18R2.6483 Oc1cnnc(c1)SCOCc2ccccc2 62a_100000763385_200010734679 [0,1,0,0,0,1|2,0,0]=4 10828 B18R2.6483 [O-][n+]1cccc(c1)COCCc2ccccc2 34a_100000037817_100000765856 [0,1,0,0,0,1|1,0,0]=3 10829 B18R2.6483 [O-][n+]1cccc(c1)COCCc2ccccc2 7a_100000037817_100000765856 [0,1,0,0,0,1|1,0,0]=3 10830 B18R2.6483 [O-][n+]1cccc(c1)COCCc2ccccn2 7a_100000037817_100015183660 [0,1,0,0,0,1|2,0,0]=4 10831 B18R2.6483 [O-][n+]1cccc(c1)COCCc2cccnc2 7a_100000037817_200011713674 [0,1,0,0,0,1|2,0,0]=4 10832 B18R2.6483 [O-][n+]1cccc(c1)COCCc2ccncc2 7a_100000037817_100000723409 [0,1,0,0,0,1|2,0,0]=4 10833 B18R2.6483 [O-][n+]1cccc(c1)OCCCc2ccccc2 34a_100000039713_100000211621 [0,1,0,0,0,1|2,0,0]=4 10834 B18R2.6483 [O-][n+]1cccc(c1)OCCCc2ccccc2 7a_100000039713_100000211621 [0,1,0,0,0,1|2,0,0]=4 10835 B18R2.6483 [O-][n+]1cccc(c1)OCOCc2ccccc2 34a_100000039713_100000763385 [0,1,0,0,0,1|1,0,0]=3 10836 B18R2.6483 [O-][n+]1cccc(c1)OCSCc2ccccc2 34a_100000039713_200011217039 [0,1,0,0,0,1|1,1,0]=4 10837 B18R2.6483 [O-][n+]1cccc(c1)SCCCc2ccccc2 62a_100000211621_100009815978 [0,1,0,0,0,1|2,0,0]=4 10838 B18R2.6483 [O-][n+]1cccc(c1)SCOCc2ccccc2 62a_100000763385_100009815978 [0,1,0,0,0,1|1,0,0]=3 10839 B18R2.6483 [O-][n+]1cccc(c1)SCSCc2ccccc2 62a_200011217039_100009815978 [0,1,0,0,0,1|1,1,0]=4 10840 B18R2.6483 [O-][n+]1ccnc(c1)SCOCc2ccccc2 62a_100000763385_100009880115 [0,1,0,0,0,1|2,0,0]=4 10841 B18R2.6483 [S]c1cccc(c1)SC/C=C/c2ccccc2 62a_100016265936_114929384022 [0,1,0,0,0,1|1,0,1]=4 10842 B18R2.6483 [S]c1cccc(c1)SC/C=C/c2ccccc2 62a_114929384022_100016265936 [0,1,0,0,0,1|1,0,1]=4 10843 B18R2.6483 [S]c1cccc(c1)SCC#Cc2ccccc2 62a_114929384022_100011352542 [0,1,0,0,0,1|1,0,1]=4 10844 B18R2.6483 [S]c1cccc(c1)SCCCc2ccccc2 62a_100000211621_114929384022 [0,1,0,0,0,1|1,0,0]=3 10845 B18R2.6483 [S]c1cccc(c1)SCCCc2ccccc2 62a_114929384022_100000211621 [0,1,0,0,0,1|1,0,0]=3 10846 B18R2.6483 [S]c1cccc(c1)SCCOc2ccccc2 62a_100000184471_114929384022 [0,1,0,0,0,1|2,0,0]=4 10847 B18R2.6483 [S]c1cccc(c1)SCCOc2ccccc2 62a_114929384022_100000184471 [0,1,0,0,0,1|2,0,0]=4 10848 B18R2.6483 [S]c1cccc(c1)SCCSc2ccccc2 62a_100000246102_114929384022 [0,1,0,0,0,1|2,0,0]=4 10849 B18R2.6483 [S]c1cccc(c1)SCCSc2ccccc2 62a_114929384022_100000246102 [0,1,0,0,0,1|2,0,0]=4 10850 B18R2.6483 [S]c1cccc(c1)SCOCc2ccccc2 62a_100000763385_114929384022 [0,1,0,0,0,1|0,0,0]=2 10851 B18R2.6483 [S]c1cccc(c1)SCOCc2ccccc2 62a_114929384022_100000763385 [0,1,0,0,0,1|0,0,0]=2 10852 B18R2.6483 [S]c1cccc(c1)SCSCc2ccccc2 62a_114929384022_200011217039 [0,1,0,0,0,1|0,1,0]=3 10853 B18R2.6483 [S]c1cccc(c1)SCSCc2ccccc2 62a_200011217039_114929384022 [0,1,0,0,0,1|0,1,0]=3 10854 B18R2.7189 CC(=NNCc1ccccc1)c2ccccc2 4a_100000007032_100000185851 [0,1,0,0,0,1|1,0,1]=4 10855 B18R2.7189 CC(C=NNc1ccccc1)c2ccccc2 4a_100015195140_100000212034 [0,1,0,0,0,1|2,0,0]=4 10856 B18R2.7189 CC(CNCc1ccccc1)c2ccccc2 207a_100000701038_100015611070 [0,1,0,0,0,1|1,0,0]=3 10857 B18R2.7189 CC(CNCc1ccccc1)c2ccccc2 2230a_100000701038_100015291786 [0,1,0,0,0,1|1,0,0]=3 10858 B18R2.7189 CC(CNCc1ccccc1)c2ccccc2 2230a_100015324214_100000756946 [0,1,0,0,0,1|1,0,0]=3 10859 B18R2.7189 CC(CNCc1ccccc1)c2ccccc2 270004a_100000701038_100015611070 [0,1,0,0,0,1|1,0,0]=3 10860 B18R2.7189 CC(CNCc1ccccc1)c2ccccc2 270004a_100015324214_100000212034 [0,1,0,0,0,1|1,0,0]=3 10861 B18R2.7189 CC(CNCc1ccccc1)c2ccccc2 34a_100000701038_100015291786 [0,1,0,0,0,1|1,0,0]=3 10862 B18R2.7189 CC(CNCc1ccccc1)c2ccccc2 34a_100015324214_100000756946 [0,1,0,0,0,1|1,0,0]=3 10863 B18R2.7189 CC(CNCc1ccccn1)c2ccccc2 207a_100000701038_100000209966 [0,1,0,0,0,1|2,0,0]=4 10864 B18R2.7189 CC(CNCc1ccccn1)c2ccccc2 2230a_100000701038_100000721315 [0,1,0,0,0,1|2,0,0]=4 10865 B18R2.7189 CC(CNCc1ccccn1)c2ccccc2 270004a_100000210449_100000212034 [0,1,0,0,0,1|2,0,0]=4 10866 B18R2.7189 CC(CNCc1ccccn1)c2ccccc2 270004a_100000701038_100000209966 [0,1,0,0,0,1|2,0,0]=4 10867 B18R2.7189 CC(CNCc1ccccn1)c2ccccc2 34a_100000701038_100000721315 [0,1,0,0,0,1|2,0,0]=4 10868 B18R2.7189 CC(CNCc1cccnc1)c2ccccc2 207a_100000701038_100000209961 [0,1,0,0,0,1|2,0,0]=4 10869 B18R2.7189 CC(CNCc1cccnc1)c2ccccc2 2230a_100000701038_100000741622 [0,1,0,0,0,1|2,0,0]=4 10870 B18R2.7189 CC(CNCc1cccnc1)c2ccccc2 270004a_100000210453_100000212034 [0,1,0,0,0,1|2,0,0]=4 10871 B18R2.7189 CC(CNCc1cccnc1)c2ccccc2 270004a_100000701038_100000209961 [0,1,0,0,0,1|2,0,0]=4 10872 B18R2.7189 CC(CNCc1cccnc1)c2ccccc2 34a_100000701038_100000733263 [0,1,0,0,0,1|2,0,0]=4 10873 B18R2.7189 CC(CNCc1ccncc1)c2ccccc2 207a_100000701038_100000186114 [0,1,0,0,0,1|2,0,0]=4 10874 B18R2.7189 CC(CNCc1ccncc1)c2ccccc2 2230a_100000701038_100015193705 [0,1,0,0,0,1|2,0,0]=4 10875 B18R2.7189 CC(COCc1ccccc1)c2ccccc2 34a_100000210790_100000756946 [0,1,0,0,0,1|0,0,0]=2 10876 B18R2.7189 CC(COCc1ccccc1)c2ccccc2 34a_100011215166_100015291786 [0,1,0,0,0,1|0,0,0]=2 10877 B18R2.7189 CC(COCc1ccccc1)c2ccccc2 7a_100000210790_100000756946 [0,1,0,0,0,1|0,0,0]=2 10878 B18R2.7189 CC(COCc1ccccc1)c2ccccc2 7a_100011215166_100000211182 [0,1,0,0,0,1|0,0,0]=2 10879 B18R2.7189 CC(COCc1ccccn1)c2ccccc2 34a_100011215166_100000721315 [0,1,0,0,0,1|1,0,0]=3 10880 B18R2.7189 CC(COCc1ccccn1)c2ccccc2 7a_100011215166_100000721315 [0,1,0,0,0,1|1,0,0]=3 10881 B18R2.7189 CC(COCc1cccnc1)c2ccccc2 34a_100011215166_100000733263 [0,1,0,0,0,1|1,0,0]=3 10882 B18R2.7189 CC(COCc1cccnc1)c2ccccc2 7a_100011215166_100000741622 [0,1,0,0,0,1|1,0,0]=3 10883 B18R2.7189 CC(COCc1cccnn1)c2ccccc2 34a_100011215166_100016990269 [0,1,0,0,0,1|2,0,0]=4 10884 B18R2.7189 CC(COCc1cccnn1)c2ccccc2 7a_100011215166_100016990269 [0,1,0,0,0,1|2,0,0]=4 10885 B18R2.7189 CC(COCc1ccncc1)c2ccccc2 7a_100011215166_100015193705 [0,1,0,0,0,1|1,0,0]=3 10886 B18R2.7189 CC(COCc1cnccn1)c2ccccc2 34a_100011215166_100016995436 [0,1,0,0,0,1|2,0,0]=4 10887 B18R2.7189 CC(COCc1cnccn1)c2ccccc2 7a_100011215166_100016995436 [0,1,0,0,0,1|2,0,0]=4 10888 B18R2.7189 CC(COCc1cncnc1)c2ccccc2 34a_100011215166_100015196519 [0,1,0,0,0,1|2,0,0]=4 10889 B18R2.7189 CC(COCc1cncnc1)c2ccccc2 7a_100011215166_100015196519 [0,1,0,0,0,1|2,0,0]=4 10890 B18R2.7189 CC(COCc1ncccn1)c2ccccc2 34a_100011215166_100000703007 [0,1,0,0,0,1|2,0,0]=4 10891 B18R2.7189 CC(COCc1ncccn1)c2ccccc2 7a_100011215166_100000703007 [0,1,0,0,0,1|2,0,0]=4 10892 B18R2.7189 CC(CSCc1ccccc1)c2ccccc2 62a_100000211182_100000756946 [0,1,0,0,0,1|0,1,0]=3 10893 B18R2.7189 CC(CSCc1ccccc1)c2ccccc2 62a_100000756946_100015291786 [0,1,0,0,0,1|0,1,0]=3 10894 B18R2.7189 CC(CSCc1ccccn1)c2ccccc2 62a_100000721315_100000756946 [0,1,0,0,0,1|1,1,0]=4 10895 B18R2.7189 CC(CSCc1ccccn1)c2ccccc2 62a_100000756946_100000721315 [0,1,0,0,0,1|1,1,0]=4 10896 B18R2.7189 CC(CSCc1cccnc1)c2ccccc2 62a_100000741622_100000756946 [0,1,0,0,0,1|1,1,0]=4 10897 B18R2.7189 CC(CSCc1cccnc1)c2ccccc2 62a_100000756946_100000741622 [0,1,0,0,0,1|1,1,0]=4 10898 B18R2.7189 CC(CSCc1ccncc1)c2ccccc2 62a_100000756946_100015193705 [0,1,0,0,0,1|1,1,0]=4 10899 B18R2.7189 CC(CSCc1ccncc1)c2ccccc2 62a_100015193705_100000756946 [0,1,0,0,0,1|1,1,0]=4 10900 B18R2.7189 CC(NCCc1ccccc1)c2ccccc2 2230a_100000106460_100000230085 [0,1,0,0,0,1|1,0,0]=3 10901 B18R2.7189 CC(NCCc1ccccc1)c2ccccc2 269862a_100000106460_100000185851 [0,1,0,0,0,1|1,0,0]=3 10902 B18R2.7189 CC(NCCc1ccccc1)c2ccccc2 34a_100000106460_100000211855 [0,1,0,0,0,1|1,0,0]=3 10903 B18R2.7189 CC(NCCc1ccccc1)c2ccccn2 2230a_100000181244_100000765856 [0,1,0,0,0,1|2,0,0]=4 10904 B18R2.7189 CC(NCCc1ccccc1)c2ccccn2 269862a_100000106460_100000210467 [0,1,0,0,0,1|2,0,0]=4 10905 B18R2.7189 CC(NCCc1ccccc1)c2cccnc2 2230a_100000195435_100000765856 [0,1,0,0,0,1|2,0,0]=4 10906 B18R2.7189 CC(NCCc1ccccc1)c2cccnc2 269862a_100000106460_100000210468 [0,1,0,0,0,1|2,0,0]=4 10907 B18R2.7189 CC(NCCc1ccccc1)c2ccncc2 2230a_100000181269_100000765856 [0,1,0,0,0,1|2,0,0]=4 10908 B18R2.7189 CC(NCCc1ccccc1)c2ccncc2 269862a_100000106460_100000185792 [0,1,0,0,0,1|2,0,0]=4 10909 B18R2.7189 CC(NCCc1ccccn1)c2ccccc2 269862a_100000211156_100000185851 [0,1,0,0,0,1|2,0,0]=4 10910 B18R2.7189 CC(NCCc1cccnc1)c2ccccc2 2230a_100000736294_100000230085 [0,1,0,0,0,1|2,0,0]=4 10911 B18R2.7189 CC(NCCc1cccnc1)c2ccccc2 269862a_100000736294_100000185851 [0,1,0,0,0,1|2,0,0]=4 10912 B18R2.7189 CC(NCCc1ccncc1)c2ccccc2 269862a_100000742849_100000185851 [0,1,0,0,0,1|2,0,0]=4 10913 B18R2.7189 CC(NCSc1ccccc1)c2ccccn2 2230a_100000181244_100011218342 [0,1,0,0,0,1|2,0,0]=4 10914 B18R2.7189 CC(NCSc1ccccc1)c2cccnc2 2230a_100000195435_100011218342 [0,1,0,0,0,1|2,0,0]=4 10915 B18R2.7189 CC(NCSc1ccccc1)c2ccncc2 2230a_100000181269_100011218342 [0,1,0,0,0,1|2,0,0]=4 10916 B18R2.7189 CC(OCCc1ccccc1)c2ccccc2 34a_100000210268_100000211855 [0,1,0,0,0,1|0,0,0]=2 10917 B18R2.7189 CC(OCCc1ccccc1)c2ccccc2 7a_100000210268_100000230085 [0,1,0,0,0,1|0,0,0]=2 10918 B18R2.7189 CC(OCCc1ccccc1)c2cnccn2 7a_100000210268_200000703233 [0,1,0,0,0,1|2,0,0]=4 10919 B18R2.7189 CC(OCCc1ccccn1)c2ccccc2 34a_100000210271_100000211855 [0,1,0,0,0,1|1,0,0]=3 10920 B18R2.7189 CC(OCCc1cccnc1)c2ccccc2 34a_100011217484_100000211855 [0,1,0,0,0,1|1,0,0]=3 10921 B18R2.7189 CC(OCCc1ccncc1)c2ccccc2 34a_100011216225_100000211855 [0,1,0,0,0,1|1,0,0]=3 10922 B18R2.7189 CC(OCCc1cnccn1)c2ccccc2 34a_100011349526_100000211855 [0,1,0,0,0,1|2,0,0]=4 10923 B18R2.7189 CC(OCCc1cncnc1)c2ccccc2 34a_100011709255_100000211855 [0,1,0,0,0,1|2,0,0]=4 10924 B18R2.7189 CC(SCCc1ccccc1)c2ccccc2 62a_100000230085_100011218657 [0,1,0,0,0,1|0,1,0]=3 10925 B18R2.7189 CC(SCCc1ccccc1)c2ccccc2 62a_100000765856_100000230085 [0,1,0,0,0,1|0,1,0]=3 10926 B18R2.7189 CC(SCCc1ccccn1)c2ccccc2 62a_100000230085_100015183660 [0,1,0,0,0,1|1,1,0]=4 10927 B18R2.7189 CC(SCCc1ccccn1)c2ccccc2 62a_100015183660_100000230085 [0,1,0,0,0,1|1,1,0]=4 10928 B18R2.7189 CC(SCCc1cccnc1)c2ccccc2 62a_100000230085_200011713674 [0,1,0,0,0,1|1,1,0]=4 10929 B18R2.7189 CC(SCCc1cccnc1)c2ccccc2 62a_200011713674_100000230085 [0,1,0,0,0,1|1,1,0]=4 10930 B18R2.7189 CC(SCCc1ccncc1)c2ccccc2 62a_100000230085_100000723409 [0,1,0,0,0,1|1,1,0]=4 10931 B18R2.7189 CC(SCCc1ccncc1)c2ccccc2 62a_100000723409_100000230085 [0,1,0,0,0,1|1,1,0]=4 10932 B18R2.7189 CC(SCSc1ccccc1)c2ccccc2 62a_100000230085_100011218342 [0,1,0,0,0,1|0,1,0]=3 10933 B18R2.7189 CC(SCSc1ccccc1)c2ccccc2 62a_100011218342_100000230085 [0,1,0,0,0,1|0,1,0]=3 10934 B18R2.7189 CN(C/C=C/c1ccccc1)c2ccccc2 2230a_100000210012_100016265936 [0,1,0,0,0,1|1,0,1]=4 10935 B18R2.7189 CN(C/C=C/c1ccccc1)c2ccccc2 269982a_100000210012_100016265936 [0,1,0,0,0,1|1,0,1]=4 10936 B18R2.7189 CN(C/C=C/c1ccccc1)c2ccccc2 34a_100000210012_100016265936 [0,1,0,0,0,1|1,0,1]=4 10937 B18R2.7189 CN(CC#Cc1ccccc1)c2ccccc2 2230a_100000210012_100011352542 [0,1,0,0,0,1|1,0,1]=4 10938 B18R2.7189 CN(CC#Cc1ccccc1)c2ccccc2 269982a_100000210012_100011352542 [0,1,0,0,0,1|1,0,1]=4 10939 B18R2.7189 CN(CC#Cc1ccccc1)c2ccccc2 34a_100000210012_100011352542 [0,1,0,0,0,1|1,0,1]=4 10940 B18R2.7189 CN(CCCc1ccccc1)c2ccccc2 2230a_100000210012_100000211621 [0,1,0,0,0,1|1,0,0]=3 10941 B18R2.7189 CN(CCCc1ccccc1)c2ccccc2 269982a_100000210012_100000211621 [0,1,0,0,0,1|1,0,0]=3 10942 B18R2.7189 CN(CCCc1ccccc1)c2ccccc2 34a_100000210012_100000211621 [0,1,0,0,0,1|1,0,0]=3 10943 B18R2.7189 CN(CCOc1ccccc1)c2ccccc2 2230a_100000210012_100000184471 [0,1,0,0,0,1|2,0,0]=4 10944 B18R2.7189 CN(CCOc1ccccc1)c2ccccc2 269982a_100000210012_100000184471 [0,1,0,0,0,1|2,0,0]=4 10945 B18R2.7189 CN(CCOc1ccccc1)c2ccccc2 34a_100000210012_100000184471 [0,1,0,0,0,1|2,0,0]=4 10946 B18R2.7189 CN(CCSc1ccccc1)c2ccccc2 2230a_100000210012_100000246102 [0,1,0,0,0,1|2,0,0]=4 10947 B18R2.7189 CN(CCSc1ccccc1)c2ccccc2 269982a_100000210012_100000246102 [0,1,0,0,0,1|2,0,0]=4 10948 B18R2.7189 CN(CCSc1ccccc1)c2ccccc2 34a_100000210012_100000246102 [0,1,0,0,0,1|2,0,0]=4 10949 B18R2.7189 CN(COCc1ccccc1)c2ccccc2 2230a_100000210012_100000763385 [0,1,0,0,0,1|0,0,0]=2 10950 B18R2.7189 CN(COCc1ccccc1)c2ccccc2 34a_100000210012_100000763385 [0,1,0,0,0,1|0,0,0]=2 10951 B18R2.7189 CN(CSCc1ccccc1)c2ccccc2 2230a_100000210012_200011217039 [0,1,0,0,0,1|0,1,0]=3 10952 B18R2.7189 CN(CSCc1ccccc1)c2ccccc2 269982a_100000210012_200011217039 [0,1,0,0,0,1|0,1,0]=3 10953 B18R2.7189 CN(CSCc1ccccc1)c2ccccc2 34a_100000210012_200011217039 [0,1,0,0,0,1|0,1,0]=3 10954 B18R2.7189 C[C@@H](NCCc1ccccc1)c2ccccc2 2230a_100000751104_100000765856 [0,1,0,0,0,1|1,0,0]=3 10955 B18R2.7189 C[C@@H](NCCc1ccccn1)c2ccccc2 2230a_100000751104_100015183660 [0,1,0,0,0,1|2,0,0]=4 10956 B18R2.7189 C[C@@H](NCCc1cccnc1)c2ccccc2 2230a_100000751104_200011713674 [0,1,0,0,0,1|2,0,0]=4 10957 B18R2.7189 C[C@@H](NCCc1ccncc1)c2ccccc2 2230a_100000751104_100000723409 [0,1,0,0,0,1|2,0,0]=4 10958 B18R2.7189 C[C@@H](NCSc1ccccc1)c2ccccc2 2230a_100000751104_100011218342 [0,1,0,0,0,1|1,0,0]=3 10959 B18R2.7189 C[C@@H](OCCc1ccccc1)c2ccccc2 34a_100000761318_100000765856 [0,1,0,0,0,1|0,0,0]=2 10960 B18R2.7189 C[C@@H](OCCc1ccccc1)c2ccccc2 7a_100000761318_100000765856 [0,1,0,0,0,1|0,0,0]=2 10961 B18R2.7189 C[C@@H](OCCc1ccccn1)c2ccccc2 7a_100000761318_100015183660 [0,1,0,0,0,1|1,0,0]=3 10962 B18R2.7189 C[C@@H](OCCc1cccnc1)c2ccccc2 7a_100000761318_200011713674 [0,1,0,0,0,1|1,0,0]=3 10963 B18R2.7189 C[C@@H](OCCc1ccncc1)c2ccccc2 7a_100000761318_100000723409 [0,1,0,0,0,1|1,0,0]=3 10964 B18R2.7189 N[C@H](COCc1ccccc1)c2ccccc2 34a_100000751927_100015291786 [0,1,0,0,0,1|0,0,0]=2 10965 B18R2.7189 N[C@H](COCc1ccccc1)c2ccncc2 34a_100138412524_100015291786 [0,1,0,0,0,1|1,0,0]=3 10966 B18R2.7189 N[C@H](COCc1ccccn1)c2ccccc2 34a_100000751927_100000721315 [0,1,0,0,0,1|1,0,0]=3 10967 B18R2.7189 N[C@H](COCc1ccccn1)c2ccncc2 34a_100138412524_100000721315 [0,1,0,0,0,1|2,0,0]=4 10968 B18R2.7189 N[C@H](COCc1cccnc1)c2ccccc2 34a_100000751927_100000733263 [0,1,0,0,0,1|1,0,0]=3 10969 B18R2.7189 N[C@H](COCc1cccnc1)c2ccncc2 34a_100138412524_100000733263 [0,1,0,0,0,1|2,0,0]=4 10970 B18R2.7189 N[C@H](COCc1cccnn1)c2ccccc2 34a_100000751927_100016990269 [0,1,0,0,0,1|2,0,0]=4 10971 B18R2.7189 N[C@H](COCc1cnccn1)c2ccccc2 34a_100000751927_100016995436 [0,1,0,0,0,1|2,0,0]=4 10972 B18R2.7189 N[C@H](COCc1cncnc1)c2ccccc2 34a_100000751927_100015196519 [0,1,0,0,0,1|2,0,0]=4 10973 B18R2.7189 N[C@H](COCc1ncccn1)c2ccccc2 34a_100000751927_100000703007 [0,1,0,0,0,1|2,0,0]=4 10974 B18R2.7189 O=C(C/C=C/c1ccccc1)c2ccccc2 1458a_100000185807_100016265936 [0,1,0,0,0,1|1,0,1]=4 10975 B18R2.7189 O=C(CC#Cc1ccccc1)c2ccccc2 1458a_100000185807_100011352542 [0,1,0,0,0,1|1,0,1]=4 10976 B18R2.7189 O=C(CCCc1ccccc1)c2ccccc2 1458a_100000185807_100000211621 [0,1,0,0,0,1|1,0,0]=3 10977 B18R2.7189 O=C(CCOc1ccccc1)c2ccccc2 1458a_100000185807_100000184471 [0,1,0,0,0,1|1,0,1]=4 10978 B18R2.7189 O=C(CCOc1ccccc1)c2ccccc2 7a_100000210340_100000750707 [0,1,0,0,0,1|1,0,1]=4 10979 B18R2.7189 O=C(CCSc1ccccc1)c2ccccc2 1458a_100000185807_100000246102 [0,1,0,0,0,1|1,0,1]=4 10980 B18R2.7189 O=C(CCSc1ccccc1)c2ccccc2 62a_100000719477_100000750707 [0,1,0,0,0,1|1,0,1]=4 10981 B18R2.7189 O=C(CCSc1ccccc1)c2ccccc2 62a_100000750707_100000041952 [0,1,0,0,0,1|1,0,1]=4 10982 B18R2.7189 O=C(CNCc1ccccc1)c2ccccn2 34a_100015324214_100000027445 [0,1,0,0,0,1|2,0,0]=4 10983 B18R2.7189 O=C(COCc1ccccc1)c2ccccc2 7a_100000210790_100000211460 [0,1,0,0,0,1|0,0,0]=2 10984 B18R2.7189 O=C(COCc1ccccc1)c2ccccn2 34a_100000210790_100000027445 [0,1,0,0,0,1|1,0,0]=3 10985 B18R2.7189 O=C(COCc1ccccc1)c2ccccn2 7a_100000210790_100000027445 [0,1,0,0,0,1|1,0,0]=3 10986 B18R2.7189 O=C(COCc1ccccc1)c2ccncc2 7a_100000210790_100015248511 [0,1,0,0,0,1|1,0,0]=3 10987 B18R2.7189 O=C(CSCc1ccccc1)c2ccccc2 1458a_100000185807_200011217039 [0,1,0,0,0,1|0,1,0]=3 10988 B18R2.7189 O=C(CSCc1ccccc1)c2ccccc2 62a_100000211182_100000211460 [0,1,0,0,0,1|0,1,0]=3 10989 B18R2.7189 O=C(CSCc1ccccc1)c2ccccc2 62a_100000211460_100015291786 [0,1,0,0,0,1|0,1,0]=3 10990 B18R2.7189 O=C(CSCc1ccccc1)c2ccccn2 62a_100000027445_100015291786 [0,1,0,0,0,1|1,1,0]=4 10991 B18R2.7189 O=C(CSCc1ccccc1)c2ccccn2 62a_100000211182_100000027445 [0,1,0,0,0,1|1,1,0]=4 10992 B18R2.7189 O=C(CSCc1ccccc1)c2cccnc2 62a_100000211182_100000757877 [0,1,0,0,0,1|1,1,0]=4 10993 B18R2.7189 O=C(CSCc1ccccc1)c2cccnc2 62a_100000757877_100015291786 [0,1,0,0,0,1|1,1,0]=4 10994 B18R2.7189 O=C(CSCc1ccccc1)c2ccncc2 62a_100000027454_100015291786 [0,1,0,0,0,1|1,1,0]=4 10995 B18R2.7189 O=C(CSCc1ccccc1)c2ccncc2 62a_100000211182_100000027454 [0,1,0,0,0,1|1,1,0]=4 10996 B18R2.7189 O=C(CSCc1ccccn1)c2ccccc2 62a_100000211460_100000721315 [0,1,0,0,0,1|1,1,0]=4 10997 B18R2.7189 O=C(CSCc1ccccn1)c2ccccc2 62a_100000721315_100000211460 [0,1,0,0,0,1|1,1,0]=4 10998 B18R2.7189 O=C(CSCc1cccnc1)c2ccccc2 62a_100000211460_100000741622 [0,1,0,0,0,1|1,1,0]=4 10999 B18R2.7189 O=C(CSCc1cccnc1)c2ccccc2 62a_100000741622_100000211460 [0,1,0,0,0,1|1,1,0]=4 11000 B18R2.7189 O=C(CSCc1ccncc1)c2ccccc2 62a_100000211460_100015193705 [0,1,0,0,0,1|1,1,0]=4 11001 B18R2.7189 O=C(CSCc1ccncc1)c2ccccc2 62a_100015193705_100000211460 [0,1,0,0,0,1|1,1,0]=4 11002 B18R2.7189 O=C(NCCc1ccccc1)c2ccccc2 11a_100000106460_100000185807 [0,1,0,0,0,1|1,0,1]=4 11003 B18R2.7189 O=C(NCCc1ccccc1)c2ccccc2 1626a_100000106460_100000185807 [0,1,0,0,0,1|1,0,1]=4 11004 B18R2.7189 O=C(NCCc1ccccc1)c2ccccc2 240690a_100000106460_100000185807 [0,1,0,0,0,1|1,0,1]=4 11005 B18R2.7189 O=C(NCCc1ccccc1)c2ccccc2 527a_100000106460_100000185807 [0,1,0,0,0,1|1,0,1]=4 11006 B18R2.7189 O=C(NNCc1ccccc1)c2ccccc2 22a_100000007032_100000185807 [0,1,0,0,0,1|1,0,1]=4 11007 B18R2.7189 O=C(OCOc1ccccc1)c2ccccc2 7a_100000210340_100000073877 [0,1,0,0,0,1|0,0,1]=3 11008 B18R2.7189 O=C(OCOc1cccnc1)c2ccccc2 7a_100000210849_100000073877 [0,1,0,0,0,1|1,0,1]=4 11009 B18R2.7189 O=C(OCSc1ccccc1)c2ccccc2 62a_100000073877_100000041952 [0,1,0,0,0,1|0,0,1]=3 11010 B18R2.7189 O=C(OCSc1ccccc1)c2ccccc2 62a_100000719477_100000073877 [0,1,0,0,0,1|0,0,1]=3 11011 B18R2.7189 O=C(OCSc1ccccn1)c2ccccc2 62a_100000073877_100011216584 [0,1,0,0,0,1|1,0,1]=4 11012 B18R2.7189 O=C(OCSc1ccccn1)c2ccccc2 62a_100011216584_100000073877 [0,1,0,0,0,1|1,0,1]=4 11013 B18R2.7189 O=C(OCSc1cccnc1)c2ccccc2 62a_100000073877_100000210063 [0,1,0,0,0,1|1,0,1]=4 11014 B18R2.7189 O=C(OCSc1cccnc1)c2ccccc2 62a_100000210063_100000073877 [0,1,0,0,0,1|1,0,1]=4 11015 B18R2.7189 O=C(OCSc1ccncc1)c2ccccc2 62a_100000073877_100000728582 [0,1,0,0,0,1|1,0,1]=4 11016 B18R2.7189 O=C(OCSc1ccncc1)c2ccccc2 62a_100000728582_100000073877 [0,1,0,0,0,1|1,0,1]=4 11017 B18R2.7189 O=S(CCOc1ccccc1)c2ccccc2 7a_100000210340_100000740319 [0,1,0,0,0,1|2,0,0]=4 11018 B18R2.7189 O=S(CCSc1ccccc1)c2ccccc2 62a_100000719477_100000740319 [0,1,0,0,0,1|2,0,0]=4 11019 B18R2.7189 O=S(CSCc1ccccc1)c2ccccc2 62a_100000211182_100000031784 [0,1,0,0,0,1|0,1,0]=3 11020 B18R2.7189 O=S(CSCc1ccccn1)c2ccccc2 62a_100000721315_100000031784 [0,1,0,0,0,1|1,1,0]=4 11021 B18R2.7189 O=S(CSCc1cccnc1)c2ccccc2 62a_100000741622_100000031784 [0,1,0,0,0,1|1,1,0]=4 11022 B18R2.7189 O=S(CSCc1ccncc1)c2ccccc2 62a_100015193705_100000031784 [0,1,0,0,0,1|1,1,0]=4 11023 B18R2.7189 OC(CNCc1ccccc1)c2ccccc2 207a_100000210709_100015611070 [0,1,0,0,0,1|1,0,0]=3 11024 B18R2.7189 OC(CNCc1ccccc1)c2ccccc2 2230a_100000210709_100015291786 [0,1,0,0,0,1|1,0,0]=3 11025 B18R2.7189 OC(CNCc1ccccc1)c2ccccc2 2230a_100015324214_100000185958 [0,1,0,0,0,1|1,0,0]=3 11026 B18R2.7189 OC(CNCc1ccccc1)c2ccccc2 270004a_100000210709_100015611070 [0,1,0,0,0,1|1,0,0]=3 11027 B18R2.7189 OC(CNCc1ccccc1)c2ccccc2 34a_100015324214_100000185958 [0,1,0,0,0,1|1,0,0]=3 11028 B18R2.7189 OC(CNCc1ccccc1)c2ccccn2 207a_100000691469_100015611070 [0,1,0,0,0,1|2,0,0]=4 11029 B18R2.7189 OC(CNCc1ccccc1)c2ccccn2 2230a_100000691469_100015291786 [0,1,0,0,0,1|2,0,0]=4 11030 B18R2.7189 OC(CNCc1ccccc1)c2ccccn2 270004a_100000691469_100015611070 [0,1,0,0,0,1|2,0,0]=4 11031 B18R2.7189 OC(CNCc1ccccc1)c2cccnc2 207a_100020605170_100015611070 [0,1,0,0,0,1|2,0,0]=4 11032 B18R2.7189 OC(CNCc1ccccc1)c2cccnc2 2230a_100020605170_100015291786 [0,1,0,0,0,1|2,0,0]=4 11033 B18R2.7189 OC(CNCc1ccccc1)c2cccnc2 270004a_100020605170_100015611070 [0,1,0,0,0,1|2,0,0]=4 11034 B18R2.7189 OC(CNCc1ccccn1)c2ccccc2 207a_100000210709_100000209966 [0,1,0,0,0,1|2,0,0]=4 11035 B18R2.7189 OC(CNCc1ccccn1)c2ccccc2 2230a_100000210709_100000721315 [0,1,0,0,0,1|2,0,0]=4 11036 B18R2.7189 OC(CNCc1ccccn1)c2ccccc2 270004a_100000210709_100000209966 [0,1,0,0,0,1|2,0,0]=4 11037 B18R2.7189 OC(CNCc1cccnc1)c2ccccc2 207a_100000210709_100000209961 [0,1,0,0,0,1|2,0,0]=4 11038 B18R2.7189 OC(CNCc1cccnc1)c2ccccc2 2230a_100000210709_100000741622 [0,1,0,0,0,1|2,0,0]=4 11039 B18R2.7189 OC(CNCc1cccnc1)c2ccccc2 270004a_100000210709_100000209961 [0,1,0,0,0,1|2,0,0]=4 11040 B18R2.7189 OC(CNCc1ccncc1)c2ccccc2 207a_100000210709_100000186114 [0,1,0,0,0,1|2,0,0]=4 11041 B18R2.7189 OC(CNCc1ccncc1)c2ccccc2 2230a_100000210709_100015193705 [0,1,0,0,0,1|2,0,0]=4 11042 B18R2.7189 OC(COCc1ccccc1)c2ccccc2 34a_100000210790_100000185958 [0,1,0,0,0,1|0,0,0]=2 11043 B18R2.7189 OC(COCc1ccccc1)c2ccccc2 7a_100000210790_100000185958 [0,1,0,0,0,1|0,0,0]=2 11044 B18R2.7189 OC(CSCc1ccccc1)c2ccccc2 62a_100000185958_100015291786 [0,1,0,0,0,1|0,1,0]=3 11045 B18R2.7189 OC(CSCc1ccccc1)c2ccccc2 62a_100000211182_100000185958 [0,1,0,0,0,1|0,1,0]=3 11046 B18R2.7189 OC(CSCc1ccccn1)c2ccccc2 62a_100000185958_100000721315 [0,1,0,0,0,1|1,1,0]=4 11047 B18R2.7189 OC(CSCc1ccccn1)c2ccccc2 62a_100000721315_100000185958 [0,1,0,0,0,1|1,1,0]=4 11048 B18R2.7189 OC(CSCc1cccnc1)c2ccccc2 62a_100000185958_100000741622 [0,1,0,0,0,1|1,1,0]=4 11049 B18R2.7189 OC(CSCc1cccnc1)c2ccccc2 62a_100000741622_100000185958 [0,1,0,0,0,1|1,1,0]=4 11050 B18R2.7189 OC(CSCc1ccncc1)c2ccccc2 62a_100000185958_100015193705 [0,1,0,0,0,1|1,1,0]=4 11051 B18R2.7189 OC(CSCc1ccncc1)c2ccccc2 62a_100015193705_100000185958 [0,1,0,0,0,1|1,1,0]=4 11052 B18R2.7189 O[C@H](CCNc1ccccc1)c2ccccc2 34a_100000106764_100000729684 [0,1,0,0,0,1|1,0,0]=3 11053 B18R2.7189 O[C@H](CCOc1ccccc1)c2ccccc2 34a_100000210340_100000729684 [0,1,0,0,0,1|1,0,0]=3 11054 B18R2.7189 O[C@H](CCOc1ccccc1)c2ccccc2 7a_100000210340_100000729684 [0,1,0,0,0,1|1,0,0]=3 11055 B18R2.7189 O[C@H](CCOc1cccnc1)c2ccccc2 34a_100000210849_100000729684 [0,1,0,0,0,1|2,0,0]=4 11056 B18R2.7189 O[C@H](CCOc1cccnc1)c2ccccc2 7a_100000210849_100000729684 [0,1,0,0,0,1|2,0,0]=4 11057 B18R2.7189 O[C@H](CCOc1ccncc1)c2ccccc2 34a_100000212176_100000729684 [0,1,0,0,0,1|2,0,0]=4 11058 B18R2.7189 O[C@H](CCSc1ccccc1)c2ccccc2 62a_100000719477_100000729684 [0,1,0,0,0,1|1,0,0]=3 11059 B18R2.7189 O[C@H](CCSc1ccccc1)c2ccccc2 62a_100000729684_100000041952 [0,1,0,0,0,1|1,0,0]=3 11060 B18R2.7189 O[C@H](CCSc1ccccn1)c2ccccc2 62a_100000729684_100011216584 [0,1,0,0,0,1|2,0,0]=4 11061 B18R2.7189 O[C@H](CCSc1ccccn1)c2ccccc2 62a_100011216584_100000729684 [0,1,0,0,0,1|2,0,0]=4 11062 B18R2.7189 O[C@H](CCSc1cccnc1)c2ccccc2 62a_100000210063_100000729684 [0,1,0,0,0,1|2,0,0]=4 11063 B18R2.7189 O[C@H](CCSc1cccnc1)c2ccccc2 62a_100000729684_100000210063 [0,1,0,0,0,1|2,0,0]=4 11064 B18R2.7189 O[C@H](CCSc1ccncc1)c2ccccc2 62a_100000728582_100000729684 [0,1,0,0,0,1|2,0,0]=4 11065 B18R2.7189 O[C@H](CCSc1ccncc1)c2ccccc2 62a_100000729684_100000728582 [0,1,0,0,0,1|2,0,0]=4 11066 B18R2.7189 O[C@H](CNCc1ccccc1)c2ccccc2 2230a_100015324214_100011933945 [0,1,0,0,0,1|1,0,0]=3 11067 B18R2.7189 O[C@H](CNCc1ccccc1)c2ccccc2 34a_100015324214_100011933945 [0,1,0,0,0,1|1,0,0]=3 11068 B18R2.7189 O[C@H](COCc1ccccc1)c2ccccc2 34a_100000210790_100011933945 [0,1,0,0,0,1|0,0,0]=2 11069 B18R2.7189 O[C@H](COCc1ccccc1)c2ccccc2 7a_100000210790_100011933945 [0,1,0,0,0,1|0,0,0]=2 11070 B18R2.7189 O[C@H](CSCc1ccccc1)c2ccccc2 62a_100000211182_100011933945 [0,1,0,0,0,1|0,1,0]=3 11071 B18R2.7189 O[C@H](CSCc1ccccc1)c2ccccc2 62a_100011933945_100015291786 [0,1,0,0,0,1|0,1,0]=3 11072 B18R2.7189 O[C@H](CSCc1ccccn1)c2ccccc2 62a_100000721315_100011933945 [0,1,0,0,0,1|1,1,0]=4 11073 B18R2.7189 O[C@H](CSCc1ccccn1)c2ccccc2 62a_100011933945_100000721315 [0,1,0,0,0,1|1,1,0]=4 11074 B18R2.7189 O[C@H](CSCc1cccnc1)c2ccccc2 62a_100000741622_100011933945 [0,1,0,0,0,1|1,1,0]=4 11075 B18R2.7189 O[C@H](CSCc1cccnc1)c2ccccc2 62a_100011933945_100000741622 [0,1,0,0,0,1|1,1,0]=4 11076 B18R2.7189 O[C@H](CSCc1ccncc1)c2ccccc2 62a_100011933945_100015193705 [0,1,0,0,0,1|1,1,0]=4 11077 B18R2.7189 O[C@H](CSCc1ccncc1)c2ccccc2 62a_100015193705_100011933945 [0,1,0,0,0,1|1,1,0]=4 11078 B18R2.4796 O=c1cccccc1OCCc2ccccc2 34a_100000036025_100000765856 [0,1,0,0,0,1|2,0,0]=4 11079 B18R2.4796 O=c1cccccc1OCCc2ccccc2 7a_100000036025_100000765856 [0,1,0,0,0,1|2,0,0]=4 11080 B18R2.199 CCN(Cc1ccccc1)Cc2ccccc2 2230a_100000185734_100000210202 [0,2,0,0,0,0|1,0,0]=3 11081 B18R2.199 CCN(Cc1ccccc1)Cc2ccccc2 2230a_100000186914_100015291786 [0,2,0,0,0,0|1,0,0]=3 11082 B18R2.199 CCN(Cc1ccccc1)Cc2ccccc2 269982a_100000185734_100000204670 [0,2,0,0,0,0|1,0,0]=3 11083 B18R2.199 CCN(Cc1ccccc1)Cc2ccccc2 269982a_100000186914_100000211182 [0,2,0,0,0,0|1,0,0]=3 11084 B18R2.199 CCN(Cc1ccccc1)Cc2ccccc2 270004a_100000186914_100015611070 [0,2,0,0,0,0|1,0,0]=3 11085 B18R2.199 CCN(Cc1ccccc1)Cc2ccccn2 2230a_100000186914_100000721315 [0,2,0,0,0,0|2,0,0]=4 11086 B18R2.199 CCN(Cc1ccccc1)Cc2ccccn2 2230a_100000201164_100015291786 [0,2,0,0,0,0|2,0,0]=4 11087 B18R2.199 CCN(Cc1ccccc1)Cc2ccccn2 269982a_100000186914_100000721315 [0,2,0,0,0,0|2,0,0]=4 11088 B18R2.199 CCN(Cc1ccccc1)Cc2ccccn2 269982a_100000201164_100000211182 [0,2,0,0,0,0|2,0,0]=4 11089 B18R2.199 CCN(Cc1ccccc1)Cc2ccccn2 270004a_100000186914_100000209966 [0,2,0,0,0,0|2,0,0]=4 11090 B18R2.199 CCN(Cc1ccccc1)Cc2ccccn2 270004a_100000201164_100015611070 [0,2,0,0,0,0|2,0,0]=4 11091 B18R2.199 CCN(Cc1ccccc1)Cc2cccnc2 2230a_100000186914_100000741622 [0,2,0,0,0,0|2,0,0]=4 11092 B18R2.199 CCN(Cc1ccccc1)Cc2cccnc2 2230a_100000186920_100015291786 [0,2,0,0,0,0|2,0,0]=4 11093 B18R2.199 CCN(Cc1ccccc1)Cc2cccnc2 269982a_100000186914_100000733263 [0,2,0,0,0,0|2,0,0]=4 11094 B18R2.199 CCN(Cc1ccccc1)Cc2cccnc2 269982a_100000186920_100000211182 [0,2,0,0,0,0|2,0,0]=4 11095 B18R2.199 CCN(Cc1ccccc1)Cc2cccnc2 270004a_100000186914_100000209961 [0,2,0,0,0,0|2,0,0]=4 11096 B18R2.199 CCN(Cc1ccccc1)Cc2cccnc2 270004a_100000186920_100015611070 [0,2,0,0,0,0|2,0,0]=4 11097 B18R2.199 CCN(Cc1ccccc1)Cc2ccncc2 2230a_100000186914_100015193705 [0,2,0,0,0,0|2,0,0]=4 11098 B18R2.199 CCN(Cc1ccccc1)Cc2ccncc2 2230a_100000186919_100015291786 [0,2,0,0,0,0|2,0,0]=4 11099 B18R2.199 CCN(Cc1ccccc1)Cc2ccncc2 269982a_100000186794_100000204670 [0,2,0,0,0,0|2,0,0]=4 11100 B18R2.199 CCN(Cc1ccccc1)Cc2ccncc2 269982a_100000186914_100015193705 [0,2,0,0,0,0|2,0,0]=4 11101 B18R2.199 CCN(Cc1ccccc1)Cc2ccncc2 269982a_100000186919_100000211182 [0,2,0,0,0,0|2,0,0]=4 11102 B18R2.199 CCN(Cc1ccccc1)Cc2ccncc2 270004a_100000186919_100015611070 [0,2,0,0,0,0|2,0,0]=4 11103 B18R2.199 CNC(Cc1ccccc1)Cc2ccccc2 2230a_100000261440_200000210301 [0,2,0,0,0,0|1,0,0]=3 11104 B18R2.199 COC(Cc1ccccc1)Cc2ccccc2 34a_100000285930_200000210301 [0,2,0,0,0,0|1,0,0]=3 11105 B18R2.199 COC(Cc1ccccc1)Cc2ccccc2 7a_100000285930_200000210301 [0,2,0,0,0,0|1,0,0]=3 11106 B18R2.199 FCN(Cc1ccccc1)Cc2ccccc2 269982a_100000185734_100015361967 [0,2,0,0,0,0|1,0,0]=3 11107 B18R2.199 FCN(Cc1ccccc1)Cc2ccncc2 269982a_100000186794_100015361967 [0,2,0,0,0,0|2,0,0]=4 11108 B18R2.199 N#CC(Cc1ccccc1)Oc2ccccc2 7a_100000210340_100000183401 [0,2,0,0,0,0|2,0,0]=4 11109 B18R2.199 N#CC(Cc1ccccc1)Sc2ccccc2 62a_100000183401_100000041952 [0,2,0,0,0,0|2,0,0]=4 11110 B18R2.199 N#CC(Cc1ccccc1)Sc2ccccc2 62a_100000719477_100000183401 [0,2,0,0,0,0|2,0,0]=4 11111 B18R2.199 [13CH3]NC(Cc1ccccc1)Cc2ccccc2 2230a_100000261440_200025704644 [0,2,0,0,0,0|1,0,0]=3 11112 B18R2.199 [13CH3]OC(Cc1ccccc1)Cc2ccccc2 34a_100000285930_200025704644 [0,2,0,0,0,0|1,0,0]=3 11113 B18R2.199 [13CH3]OC(Cc1ccccc1)Cc2ccccc2 7a_100000285930_200025704644 [0,2,0,0,0,0|1,0,0]=3 11114 B18R2.266 CC(Cc1ccccc1)Nc2ccc(cc2)Br 34a_100000210018_200011218536 [0,2,0,0,0,0|2,0,0]=4 11115 B18R2.266 CC(Cc1ccccc1)Nc2ccc(cc2)Cl 34a_100000210052_200011218536 [0,2,0,0,0,0|2,0,0]=4 11116 B18R2.266 CC(Cc1ccccc1)Nc2ccc(cc2)F 34a_100000185862_200011218536 [0,2,0,0,0,0|2,0,0]=4 11117 B18R2.266 CC(Cc1ccccc1)Nc2ccc(cc2)I 34a_100000185761_200011218536 [0,2,0,0,0,0|2,0,0]=4 11118 B18R2.266 CC(Cc1ccccc1)Nc2ccc(cc2)O 34a_100000185829_200011218536 [0,2,0,0,0,0|2,0,0]=4 11119 B18R2.266 CC(Cc1ccccc1)Oc2ccc(cc2)Br 34a_100000185759_200011218536 [0,2,0,0,0,0|2,0,0]=4 11120 B18R2.266 CC(Cc1ccccc1)Oc2ccc(cc2)Br 7a_100000185759_200011218536 [0,2,0,0,0,0|2,0,0]=4 11121 B18R2.266 CC(Cc1ccccc1)Oc2ccc(cc2)Cl 34a_100000210216_200011218536 [0,2,0,0,0,0|2,0,0]=4 11122 B18R2.266 CC(Cc1ccccc1)Oc2ccc(cc2)Cl 7a_100000210216_200011218536 [0,2,0,0,0,0|2,0,0]=4 11123 B18R2.266 CC(Cc1ccccc1)Oc2ccc(cc2)F 34a_100000210339_200011218536 [0,2,0,0,0,0|2,0,0]=4 11124 B18R2.266 CC(Cc1ccccc1)Oc2ccc(cc2)I 34a_100000212066_200011218536 [0,2,0,0,0,0|2,0,0]=4 11125 B18R2.266 CC(Cc1ccccc1)Oc2ccc(cc2)I 7a_100000212066_200011218536 [0,2,0,0,0,0|2,0,0]=4 11126 B18R2.266 CC(Cc1ccccc1)Oc2ccc(cc2)N 34a_100000185829_200011218536 [0,2,0,0,0,0|2,0,0]=4 11127 B18R2.266 CC(Cc1ccccc1)Sc2ccc(cc2)Br 62a_100000752885_200011218536 [0,2,0,0,0,0|2,0,0]=4 11128 B18R2.266 CC(Cc1ccccc1)Sc2ccc(cc2)Br 62a_200011218536_100000752885 [0,2,0,0,0,0|2,0,0]=4 11129 B18R2.266 CC(Cc1ccccc1)Sc2ccc(cc2)Cl 62a_100000755918_200011218536 [0,2,0,0,0,0|2,0,0]=4 11130 B18R2.266 CC(Cc1ccccc1)Sc2ccc(cc2)Cl 62a_200011218536_100000755918 [0,2,0,0,0,0|2,0,0]=4 11131 B18R2.266 CC(Cc1ccccc1)Sc2ccc(cc2)F 62a_100000211213_200011218536 [0,2,0,0,0,0|2,0,0]=4 11132 B18R2.266 CC(Cc1ccccc1)Sc2ccc(cc2)F 62a_200011218536_100000211213 [0,2,0,0,0,0|2,0,0]=4 11133 B18R2.266 CC(Cc1ccccc1)Sc2ccc(cc2)N 62a_100000185761_200011218536 [0,2,0,0,0,0|2,0,0]=4 11134 B18R2.266 CC(Cc1ccccc1)Sc2ccc(cc2)N 62a_200011218536_100000185761 [0,2,0,0,0,0|2,0,0]=4 11135 B18R2.266 CC(Cc1ccccc1)Sc2ccc(cc2)O 62a_200011218536_100000185759 [0,2,0,0,0,0|2,0,0]=4 11136 B18R2.266 CN(Cc1ccc(cc1)Br)Cc2ccccn2 2230a_100000180866_100000721315 [0,2,0,0,0,0|2,0,0]=4 11137 B18R2.266 CN(Cc1ccc(cc1)Br)Cc2ccccn2 2230a_100000207498_100011217064 [0,2,0,0,0,0|2,0,0]=4 11138 B18R2.266 CN(Cc1ccc(cc1)Br)Cc2ccccn2 269982a_100000180866_100000721315 [0,2,0,0,0,0|2,0,0]=4 11139 B18R2.266 CN(Cc1ccc(cc1)Br)Cc2ccccn2 269982a_100000207498_100011217064 [0,2,0,0,0,0|2,0,0]=4 11140 B18R2.266 CN(Cc1ccc(cc1)Br)Cc2ccccn2 26a_100000207498_100000185759 [0,2,0,0,0,0|2,0,0]=4 11141 B18R2.266 CN(Cc1ccc(cc1)Br)Cc2ccccn2 270004a_100000180866_100000209966 [0,2,0,0,0,0|2,0,0]=4 11142 B18R2.266 CN(Cc1ccc(cc1)Br)Cc2ccccn2 270004a_100000207498_100000186029 [0,2,0,0,0,0|2,0,0]=4 11143 B18R2.266 CN(Cc1ccc(cc1)Br)Cc2cccnc2 2230a_100000180866_100000741622 [0,2,0,0,0,0|2,0,0]=4 11144 B18R2.266 CN(Cc1ccc(cc1)Br)Cc2cccnc2 2230a_100000184577_100011217064 [0,2,0,0,0,0|2,0,0]=4 11145 B18R2.266 CN(Cc1ccc(cc1)Br)Cc2cccnc2 269982a_100000180866_100000733263 [0,2,0,0,0,0|2,0,0]=4 11146 B18R2.266 CN(Cc1ccc(cc1)Br)Cc2cccnc2 269982a_100000184577_100011217064 [0,2,0,0,0,0|2,0,0]=4 11147 B18R2.266 CN(Cc1ccc(cc1)Br)Cc2cccnc2 26a_100000184577_100000185759 [0,2,0,0,0,0|2,0,0]=4 11148 B18R2.266 CN(Cc1ccc(cc1)Br)Cc2cccnc2 270004a_100000180866_100000209961 [0,2,0,0,0,0|2,0,0]=4 11149 B18R2.266 CN(Cc1ccc(cc1)Br)Cc2cccnc2 270004a_100000184577_100000186029 [0,2,0,0,0,0|2,0,0]=4 11150 B18R2.266 CN(Cc1ccc(cc1)Cl)Cc2ccccn2 2230a_100000184517_100000721315 [0,2,0,0,0,0|2,0,0]=4 11151 B18R2.266 CN(Cc1ccc(cc1)Cl)Cc2ccccn2 2230a_100000207498_100000694040 [0,2,0,0,0,0|2,0,0]=4 11152 B18R2.266 CN(Cc1ccc(cc1)Cl)Cc2ccccn2 269982a_100000184517_100000721315 [0,2,0,0,0,0|2,0,0]=4 11153 B18R2.266 CN(Cc1ccc(cc1)Cl)Cc2ccccn2 269982a_100000207498_100000187161 [0,2,0,0,0,0|2,0,0]=4 11154 B18R2.266 CN(Cc1ccc(cc1)Cl)Cc2ccccn2 270004a_100000184517_100000209966 [0,2,0,0,0,0|2,0,0]=4 11155 B18R2.266 CN(Cc1ccc(cc1)Cl)Cc2ccccn2 270004a_100000207498_100000189385 [0,2,0,0,0,0|2,0,0]=4 11156 B18R2.266 CN(Cc1ccc(cc1)Cl)Cc2ccccn2 34a_100000184517_100000721315 [0,2,0,0,0,0|2,0,0]=4 11157 B18R2.266 CN(Cc1ccc(cc1)Cl)Cc2cccnc2 2230a_100000184517_100000741622 [0,2,0,0,0,0|2,0,0]=4 11158 B18R2.266 CN(Cc1ccc(cc1)Cl)Cc2cccnc2 2230a_100000184577_100000694040 [0,2,0,0,0,0|2,0,0]=4 11159 B18R2.266 CN(Cc1ccc(cc1)Cl)Cc2cccnc2 269982a_100000184517_100000733263 [0,2,0,0,0,0|2,0,0]=4 11160 B18R2.266 CN(Cc1ccc(cc1)Cl)Cc2cccnc2 269982a_100000184577_100000187161 [0,2,0,0,0,0|2,0,0]=4 11161 B18R2.266 CN(Cc1ccc(cc1)Cl)Cc2cccnc2 270004a_100000184517_100000209961 [0,2,0,0,0,0|2,0,0]=4 11162 B18R2.266 CN(Cc1ccc(cc1)Cl)Cc2cccnc2 270004a_100000184577_100000189385 [0,2,0,0,0,0|2,0,0]=4 11163 B18R2.266 CN(Cc1ccc(cc1)Cl)Cc2cccnc2 34a_100000184517_100000733263 [0,2,0,0,0,0|2,0,0]=4 11164 B18R2.266 CN(Cc1ccc(cc1)F)Cc2ccccn2 2230a_100000184576_100000721315 [0,2,0,0,0,0|2,0,0]=4 11165 B18R2.266 CN(Cc1ccc(cc1)F)Cc2ccccn2 2230a_100000207498_100000198546 [0,2,0,0,0,0|2,0,0]=4 11166 B18R2.266 CN(Cc1ccc(cc1)F)Cc2ccccn2 269982a_100000184576_100000721315 [0,2,0,0,0,0|2,0,0]=4 11167 B18R2.266 CN(Cc1ccc(cc1)F)Cc2ccccn2 269982a_100000207498_100000198546 [0,2,0,0,0,0|2,0,0]=4 11168 B18R2.266 CN(Cc1ccc(cc1)F)Cc2ccccn2 270004a_100000184576_100000209966 [0,2,0,0,0,0|2,0,0]=4 11169 B18R2.266 CN(Cc1ccc(cc1)F)Cc2ccccn2 270004a_100000207498_100000210084 [0,2,0,0,0,0|2,0,0]=4 11170 B18R2.266 CN(Cc1ccc(cc1)F)Cc2ccccn2 34a_100000184576_100000721315 [0,2,0,0,0,0|2,0,0]=4 11171 B18R2.266 CN(Cc1ccc(cc1)F)Cc2cccnc2 2230a_100000184576_100000741622 [0,2,0,0,0,0|2,0,0]=4 11172 B18R2.266 CN(Cc1ccc(cc1)F)Cc2cccnc2 2230a_100000184577_100000198546 [0,2,0,0,0,0|2,0,0]=4 11173 B18R2.266 CN(Cc1ccc(cc1)F)Cc2cccnc2 2230a_200000262393_200000210301 [0,2,0,0,0,0|2,0,0]=4 11174 B18R2.266 CN(Cc1ccc(cc1)F)Cc2cccnc2 269982a_100000184576_100000733263 [0,2,0,0,0,0|2,0,0]=4 11175 B18R2.266 CN(Cc1ccc(cc1)F)Cc2cccnc2 269982a_100000184577_100000198546 [0,2,0,0,0,0|2,0,0]=4 11176 B18R2.266 CN(Cc1ccc(cc1)F)Cc2cccnc2 269982a_200000262393_200000210301 [0,2,0,0,0,0|2,0,0]=4 11177 B18R2.266 CN(Cc1ccc(cc1)F)Cc2cccnc2 270004a_100000184576_100000209961 [0,2,0,0,0,0|2,0,0]=4 11178 B18R2.266 CN(Cc1ccc(cc1)F)Cc2cccnc2 270004a_100000184577_100000210084 [0,2,0,0,0,0|2,0,0]=4 11179 B18R2.266 CN(Cc1ccc(cc1)F)Cc2cccnc2 34a_100000184576_100000733263 [0,2,0,0,0,0|2,0,0]=4 11180 B18R2.266 CN(Cc1ccc(cc1)F)Cc2cccnc2 34a_200000262393_200000210301 [0,2,0,0,0,0|2,0,0]=4 11181 B18R2.266 CN(Cc1ccc(cc1)I)Cc2ccccn2 2230a_100000207498_100000189116 [0,2,0,0,0,0|2,0,0]=4 11182 B18R2.266 CN(Cc1ccc(cc1)I)Cc2ccccn2 269982a_100000207498_100000189116 [0,2,0,0,0,0|2,0,0]=4 11183 B18R2.266 CN(Cc1ccc(cc1)I)Cc2cccnc2 2230a_100000184577_100000189116 [0,2,0,0,0,0|2,0,0]=4 11184 B18R2.266 CN(Cc1ccc(cc1)I)Cc2cccnc2 269982a_100000184577_100000189116 [0,2,0,0,0,0|2,0,0]=4 11185 B18R2.266 CN(Cc1ccc(cc1)O)Cc2ccccn2 2230a_100000207500_100000721315 [0,2,0,0,0,0|2,0,0]=4 11186 B18R2.266 CN(Cc1ccc(cc1)O)Cc2ccccn2 269982a_100000207500_100000721315 [0,2,0,0,0,0|2,0,0]=4 11187 B18R2.266 CN(Cc1ccc(cc1)O)Cc2ccccn2 270004a_100000207500_100000209966 [0,2,0,0,0,0|2,0,0]=4 11188 B18R2.266 CN(Cc1ccc(cc1)O)Cc2cccnc2 2230a_100000207500_100000741622 [0,2,0,0,0,0|2,0,0]=4 11189 B18R2.266 CN(Cc1ccc(cc1)O)Cc2cccnc2 269982a_100000207500_100000733263 [0,2,0,0,0,0|2,0,0]=4 11190 B18R2.266 CN(Cc1ccc(cc1)O)Cc2cccnc2 270004a_100000207500_100000209961 [0,2,0,0,0,0|2,0,0]=4 11191 B18R2.266 CN(Cc1ccccc1)Cc2ccc(cc2)Br 2230a_100000180866_100015291786 [0,2,0,0,0,0|1,0,0]=3 11192 B18R2.266 CN(Cc1ccccc1)Cc2ccc(cc2)Br 2230a_100000186898_100011217064 [0,2,0,0,0,0|1,0,0]=3 11193 B18R2.266 CN(Cc1ccccc1)Cc2ccc(cc2)Br 2230a_100000195849_200000210301 [0,2,0,0,0,0|1,0,0]=3 11194 B18R2.266 CN(Cc1ccccc1)Cc2ccc(cc2)Br 269982a_100000180866_100000211182 [0,2,0,0,0,0|1,0,0]=3 11195 B18R2.266 CN(Cc1ccccc1)Cc2ccc(cc2)Br 269982a_100000186898_100011217064 [0,2,0,0,0,0|1,0,0]=3 11196 B18R2.266 CN(Cc1ccccc1)Cc2ccc(cc2)Br 269982a_100000195849_200000210301 [0,2,0,0,0,0|1,0,0]=3 11197 B18R2.266 CN(Cc1ccccc1)Cc2ccc(cc2)Br 26a_100000186898_100000185759 [0,2,0,0,0,0|1,0,0]=3 11198 B18R2.266 CN(Cc1ccccc1)Cc2ccc(cc2)Br 270004a_100000180866_100015611070 [0,2,0,0,0,0|1,0,0]=3 11199 B18R2.266 CN(Cc1ccccc1)Cc2ccc(cc2)Br 270004a_100000186898_100000186029 [0,2,0,0,0,0|1,0,0]=3 11200 B18R2.266 CN(Cc1ccccc1)Cc2ccc(cc2)Br 34a_100000195849_200000210301 [0,2,0,0,0,0|1,0,0]=3 11201 B18R2.266 CN(Cc1ccccc1)Cc2ccc(cc2)Cl 2230a_100000184517_100015291786 [0,2,0,0,0,0|1,0,0]=3 11202 B18R2.266 CN(Cc1ccccc1)Cc2ccc(cc2)Cl 2230a_100000186898_100000694040 [0,2,0,0,0,0|1,0,0]=3 11203 B18R2.266 CN(Cc1ccccc1)Cc2ccc(cc2)Cl 269982a_100000184517_100000211182 [0,2,0,0,0,0|1,0,0]=3 11204 B18R2.266 CN(Cc1ccccc1)Cc2ccc(cc2)Cl 269982a_100000186898_100000187161 [0,2,0,0,0,0|1,0,0]=3 11205 B18R2.266 CN(Cc1ccccc1)Cc2ccc(cc2)Cl 270004a_100000184517_100015611070 [0,2,0,0,0,0|1,0,0]=3 11206 B18R2.266 CN(Cc1ccccc1)Cc2ccc(cc2)Cl 270004a_100000186898_100000189385 [0,2,0,0,0,0|1,0,0]=3 11207 B18R2.266 CN(Cc1ccccc1)Cc2ccc(cc2)Cl 34a_100000184517_100015291786 [0,2,0,0,0,0|1,0,0]=3 11208 B18R2.266 CN(Cc1ccccc1)Cc2ccc(cc2)F 2230a_100000184576_100015291786 [0,2,0,0,0,0|1,0,0]=3 11209 B18R2.266 CN(Cc1ccccc1)Cc2ccc(cc2)F 2230a_100000186898_100000198546 [0,2,0,0,0,0|1,0,0]=3 11210 B18R2.266 CN(Cc1ccccc1)Cc2ccc(cc2)F 269982a_100000184576_100000211182 [0,2,0,0,0,0|1,0,0]=3 11211 B18R2.266 CN(Cc1ccccc1)Cc2ccc(cc2)F 269982a_100000186898_100000198546 [0,2,0,0,0,0|1,0,0]=3 11212 B18R2.266 CN(Cc1ccccc1)Cc2ccc(cc2)F 270004a_100000184576_100015611070 [0,2,0,0,0,0|1,0,0]=3 11213 B18R2.266 CN(Cc1ccccc1)Cc2ccc(cc2)F 270004a_100000186898_100000210084 [0,2,0,0,0,0|1,0,0]=3 11214 B18R2.266 CN(Cc1ccccc1)Cc2ccc(cc2)F 34a_100000184576_100015291786 [0,2,0,0,0,0|1,0,0]=3 11215 B18R2.266 CN(Cc1ccccc1)Cc2ccc(cc2)I 2230a_100000186898_100000189116 [0,2,0,0,0,0|1,0,0]=3 11216 B18R2.266 CN(Cc1ccccc1)Cc2ccc(cc2)I 269982a_100000186898_100000189116 [0,2,0,0,0,0|1,0,0]=3 11217 B18R2.266 CN(Cc1ccccc1)Cc2ccc(cc2)O 2230a_100000207500_100015291786 [0,2,0,0,0,0|1,0,0]=3 11218 B18R2.266 CN(Cc1ccccc1)Cc2ccc(cc2)O 269982a_100000207500_100000211182 [0,2,0,0,0,0|1,0,0]=3 11219 B18R2.266 CN(Cc1ccccc1)Cc2ccc(cc2)O 270004a_100000207500_100015611070 [0,2,0,0,0,0|1,0,0]=3 11220 B18R2.266 CN(Cc1ccccc1)Cc2ccc(cn2)Br 2230a_100000186898_100000702658 [0,2,0,0,0,0|2,0,0]=4 11221 B18R2.266 CN(Cc1ccccc1)Cc2ccc(cn2)Br 269982a_100000186898_100000702658 [0,2,0,0,0,0|2,0,0]=4 11222 B18R2.266 CN(Cc1ccccc1)Cc2ccc(cn2)Br 270004a_100000186898_100000754260 [0,2,0,0,0,0|2,0,0]=4 11223 B18R2.266 CN(Cc1ccccc1)Cc2ccc(cn2)Cl 2230a_100000186898_100012066911 [0,2,0,0,0,0|2,0,0]=4 11224 B18R2.266 CN(Cc1ccccc1)Cc2ccc(cn2)Cl 269982a_100000186898_100000697101 [0,2,0,0,0,0|2,0,0]=4 11225 B18R2.266 CN(Cc1ccccc1)Cc2ccc(cn2)Cl 270004a_100000186898_100011361569 [0,2,0,0,0,0|2,0,0]=4 11226 B18R2.266 CN(Cc1ccccc1)Cc2ccc(cn2)F 2230a_100000186898_100000703193 [0,2,0,0,0,0|2,0,0]=4 11227 B18R2.266 CN(Cc1ccccc1)Cc2ccc(cn2)F 269982a_100000186898_100000703193 [0,2,0,0,0,0|2,0,0]=4 11228 B18R2.266 CN(Cc1ccccc1)Cc2ccc(cn2)F 270004a_100000186898_100011934744 [0,2,0,0,0,0|2,0,0]=4 11229 B18R2.266 CN(Cc1ccccc1)Cc2ccc(nc2)Br 2230a_100000186898_100009831999 [0,2,0,0,0,0|2,0,0]=4 11230 B18R2.266 CN(Cc1ccccc1)Cc2ccc(nc2)Br 269982a_100000186898_100009831999 [0,2,0,0,0,0|2,0,0]=4 11231 B18R2.266 CN(Cc1ccccc1)Cc2ccc(nc2)Cl 2230a_100000026953_100015291786 [0,2,0,0,0,0|2,0,0]=4 11232 B18R2.266 CN(Cc1ccccc1)Cc2ccc(nc2)Cl 2230a_100000186898_100000735431 [0,2,0,0,0,0|2,0,0]=4 11233 B18R2.266 CN(Cc1ccccc1)Cc2ccc(nc2)Cl 269982a_100000026953_100000211182 [0,2,0,0,0,0|2,0,0]=4 11234 B18R2.266 CN(Cc1ccccc1)Cc2ccc(nc2)Cl 269982a_100000186898_100000735431 [0,2,0,0,0,0|2,0,0]=4 11235 B18R2.266 CN(Cc1ccccc1)Cc2ccc(nc2)Cl 270004a_100000026953_100015611070 [0,2,0,0,0,0|2,0,0]=4 11236 B18R2.266 CN(Cc1ccccc1)Cc2ccc(nc2)Cl 34a_100000026953_100015291786 [0,2,0,0,0,0|2,0,0]=4 11237 B18R2.266 CN(Cc1ccccc1)Cc2ccc(nc2)F 2230a_100000186898_100009820150 [0,2,0,0,0,0|2,0,0]=4 11238 B18R2.266 CN(Cc1ccccc1)Cc2ccc(nc2)F 269982a_100000186898_100009820150 [0,2,0,0,0,0|2,0,0]=4 11239 B18R2.266 CN(Cc1ccncc1)Cc2ccc(cc2)Br 2230a_100000180866_100015193705 [0,2,0,0,0,0|2,0,0]=4 11240 B18R2.266 CN(Cc1ccncc1)Cc2ccc(cc2)Br 2230a_100000187231_100011217064 [0,2,0,0,0,0|2,0,0]=4 11241 B18R2.266 CN(Cc1ccncc1)Cc2ccc(cc2)Br 269982a_100000180866_100015193705 [0,2,0,0,0,0|2,0,0]=4 11242 B18R2.266 CN(Cc1ccncc1)Cc2ccc(cc2)Br 269982a_100000187231_100011217064 [0,2,0,0,0,0|2,0,0]=4 11243 B18R2.266 CN(Cc1ccncc1)Cc2ccc(cc2)Br 26a_100000187231_100000185759 [0,2,0,0,0,0|2,0,0]=4 11244 B18R2.266 CN(Cc1ccncc1)Cc2ccc(cc2)Br 270004a_100000187231_100000186029 [0,2,0,0,0,0|2,0,0]=4 11245 B18R2.266 CN(Cc1ccncc1)Cc2ccc(cc2)Cl 2230a_100000184517_100015193705 [0,2,0,0,0,0|2,0,0]=4 11246 B18R2.266 CN(Cc1ccncc1)Cc2ccc(cc2)Cl 2230a_100000187231_100000694040 [0,2,0,0,0,0|2,0,0]=4 11247 B18R2.266 CN(Cc1ccncc1)Cc2ccc(cc2)Cl 269982a_100000184517_100015193705 [0,2,0,0,0,0|2,0,0]=4 11248 B18R2.266 CN(Cc1ccncc1)Cc2ccc(cc2)Cl 269982a_100000187231_100000187161 [0,2,0,0,0,0|2,0,0]=4 11249 B18R2.266 CN(Cc1ccncc1)Cc2ccc(cc2)Cl 270004a_100000187231_100000189385 [0,2,0,0,0,0|2,0,0]=4 11250 B18R2.266 CN(Cc1ccncc1)Cc2ccc(cc2)F 2230a_100000184576_100015193705 [0,2,0,0,0,0|2,0,0]=4 11251 B18R2.266 CN(Cc1ccncc1)Cc2ccc(cc2)F 2230a_100000187231_100000198546 [0,2,0,0,0,0|2,0,0]=4 11252 B18R2.266 CN(Cc1ccncc1)Cc2ccc(cc2)F 269982a_100000184576_100015193705 [0,2,0,0,0,0|2,0,0]=4 11253 B18R2.266 CN(Cc1ccncc1)Cc2ccc(cc2)F 269982a_100000187231_100000198546 [0,2,0,0,0,0|2,0,0]=4 11254 B18R2.266 CN(Cc1ccncc1)Cc2ccc(cc2)F 270004a_100000187231_100000210084 [0,2,0,0,0,0|2,0,0]=4 11255 B18R2.266 CN(Cc1ccncc1)Cc2ccc(cc2)I 2230a_100000187231_100000189116 [0,2,0,0,0,0|2,0,0]=4 11256 B18R2.266 CN(Cc1ccncc1)Cc2ccc(cc2)I 269982a_100000187231_100000189116 [0,2,0,0,0,0|2,0,0]=4 11257 B18R2.266 CN(Cc1ccncc1)Cc2ccc(cc2)O 2230a_100000207500_100015193705 [0,2,0,0,0,0|2,0,0]=4 11258 B18R2.266 CN(Cc1ccncc1)Cc2ccc(cc2)O 269982a_100000207500_100015193705 [0,2,0,0,0,0|2,0,0]=4 11259 B18R2.266 Cc1ccc(cc1)CC(=O)C[n+]2ccccc2 1458a_200000086051_100000210814 [0,2,0,0,0,0|2,0,0]=4 11260 B18R2.266 Cc1ccc(cc1)CC(=O)Cc2ccccc2 1458a_100000212244_100015291786 [0,2,0,0,0,0|1,0,0]=3 11261 B18R2.266 Cc1ccc(cc1)CC(=O)Cc2ccccn2 1458a_100000212244_100000721315 [0,2,0,0,0,0|2,0,0]=4 11262 B18R2.266 Cc1ccc(cc1)CC(=O)Cc2ccccn2 1458a_100000233486_100000210814 [0,2,0,0,0,0|2,0,0]=4 11263 B18R2.266 Cc1ccc(cc1)CC(=O)Cc2cccnc2 1458a_100000212244_100000733263 [0,2,0,0,0,0|2,0,0]=4 11264 B18R2.266 Cc1ccc(cc1)CC(=O)Cc2cccnc2 1458a_100000737805_100000210814 [0,2,0,0,0,0|2,0,0]=4 11265 B18R2.266 Cc1ccc(cc1)CC(=O)Cc2ccncc2 1458a_100000212244_100000705612 [0,2,0,0,0,0|2,0,0]=4 11266 B18R2.266 Cc1ccc(cc1)CC(=O)Nc2ccccc2 11a_100000106764_100000212244 [0,2,0,0,0,0|2,0,0]=4 11267 B18R2.266 Cc1ccc(cc1)CC(=O)Nc2ccccc2 22a_100000106764_100000212244 [0,2,0,0,0,0|2,0,0]=4 11268 B18R2.266 Cc1ccc(cc1)CC(=O)Nc2ccccc2 527a_100000106764_100000212244 [0,2,0,0,0,0|2,0,0]=4 11269 B18R2.266 Cc1ccc(cc1)CN(C)Cc2ccccc2 2230a_100000186898_100000210814 [0,2,0,0,0,0|1,0,0]=3 11270 B18R2.266 Cc1ccc(cc1)CN(C)Cc2ccccc2 2230a_100000744650_100015291786 [0,2,0,0,0,0|1,0,0]=3 11271 B18R2.266 Cc1ccc(cc1)CN(C)Cc2ccccc2 269982a_100000186898_100000210814 [0,2,0,0,0,0|1,0,0]=3 11272 B18R2.266 Cc1ccc(cc1)CN(C)Cc2ccccc2 269982a_100000744650_100000211182 [0,2,0,0,0,0|1,0,0]=3 11273 B18R2.266 Cc1ccc(cc1)CN(C)Cc2ccccc2 26a_100000186898_200020625495 [0,2,0,0,0,0|1,0,0]=3 11274 B18R2.266 Cc1ccc(cc1)CN(C)Cc2ccccc2 270004a_100000186898_100000211033 [0,2,0,0,0,0|1,0,0]=3 11275 B18R2.266 Cc1ccc(cc1)CN(C)Cc2ccccc2 270004a_100000744650_100015611070 [0,2,0,0,0,0|1,0,0]=3 11276 B18R2.266 Cc1ccc(cc1)CN(C)Cc2ccccc2 34a_100000744650_100015291786 [0,2,0,0,0,0|1,0,0]=3 11277 B18R2.266 Cc1ccc(cc1)CN(C)Cc2ccccn2 2230a_100000207498_100000210814 [0,2,0,0,0,0|2,0,0]=4 11278 B18R2.266 Cc1ccc(cc1)CN(C)Cc2ccccn2 2230a_100000744650_100000721315 [0,2,0,0,0,0|2,0,0]=4 11279 B18R2.266 Cc1ccc(cc1)CN(C)Cc2ccccn2 269982a_100000207498_100000210814 [0,2,0,0,0,0|2,0,0]=4 11280 B18R2.266 Cc1ccc(cc1)CN(C)Cc2ccccn2 269982a_100000744650_100000721315 [0,2,0,0,0,0|2,0,0]=4 11281 B18R2.266 Cc1ccc(cc1)CN(C)Cc2ccccn2 26a_100000207498_200020625495 [0,2,0,0,0,0|2,0,0]=4 11282 B18R2.266 Cc1ccc(cc1)CN(C)Cc2ccccn2 270004a_100000207498_100000211033 [0,2,0,0,0,0|2,0,0]=4 11283 B18R2.266 Cc1ccc(cc1)CN(C)Cc2ccccn2 270004a_100000744650_100000209966 [0,2,0,0,0,0|2,0,0]=4 11284 B18R2.266 Cc1ccc(cc1)CN(C)Cc2ccccn2 34a_100000744650_100000721315 [0,2,0,0,0,0|2,0,0]=4 11285 B18R2.266 Cc1ccc(cc1)CN(C)Cc2cccnc2 2230a_100000184577_100000210814 [0,2,0,0,0,0|2,0,0]=4 11286 B18R2.266 Cc1ccc(cc1)CN(C)Cc2cccnc2 2230a_100000744650_100000741622 [0,2,0,0,0,0|2,0,0]=4 11287 B18R2.266 Cc1ccc(cc1)CN(C)Cc2cccnc2 269982a_100000184577_100000210814 [0,2,0,0,0,0|2,0,0]=4 11288 B18R2.266 Cc1ccc(cc1)CN(C)Cc2cccnc2 269982a_100000744650_100000733263 [0,2,0,0,0,0|2,0,0]=4 11289 B18R2.266 Cc1ccc(cc1)CN(C)Cc2cccnc2 26a_100000184577_200020625495 [0,2,0,0,0,0|2,0,0]=4 11290 B18R2.266 Cc1ccc(cc1)CN(C)Cc2cccnc2 270004a_100000184577_100000211033 [0,2,0,0,0,0|2,0,0]=4 11291 B18R2.266 Cc1ccc(cc1)CN(C)Cc2cccnc2 270004a_100000744650_100000209961 [0,2,0,0,0,0|2,0,0]=4 11292 B18R2.266 Cc1ccc(cc1)CN(C)Cc2cccnc2 34a_100000744650_100000733263 [0,2,0,0,0,0|2,0,0]=4 11293 B18R2.266 Cc1ccc(cc1)CN(C)Cc2ccncc2 2230a_100000187231_100000210814 [0,2,0,0,0,0|2,0,0]=4 11294 B18R2.266 Cc1ccc(cc1)CN(C)Cc2ccncc2 2230a_100000744650_100015193705 [0,2,0,0,0,0|2,0,0]=4 11295 B18R2.266 Cc1ccc(cc1)CN(C)Cc2ccncc2 269982a_100000187231_100000210814 [0,2,0,0,0,0|2,0,0]=4 11296 B18R2.266 Cc1ccc(cc1)CN(C)Cc2ccncc2 269982a_100000744650_100015193705 [0,2,0,0,0,0|2,0,0]=4 11297 B18R2.266 Cc1ccc(cc1)CN(C)Cc2ccncc2 26a_100000187231_200020625495 [0,2,0,0,0,0|2,0,0]=4 11298 B18R2.266 Cc1ccc(cc1)CN(C)Cc2ccncc2 270004a_100000187231_100000211033 [0,2,0,0,0,0|2,0,0]=4 11299 B18R2.266 Cc1ccc(cc1)NC(C)Cc2ccccc2 34a_100000124888_200011218536 [0,2,0,0,0,0|2,0,0]=4 11300 B18R2.266 Cc1ccc(cc1)OC(C)Cc2ccccc2 34a_100000210336_200011218536 [0,2,0,0,0,0|2,0,0]=4 11301 B18R2.266 Cc1ccc(cc1)OC(C)Cc2ccccc2 7a_100000210336_200011218536 [0,2,0,0,0,0|2,0,0]=4 11302 B18R2.266 Cc1ccc(cc1)SC(C)Cc2ccccc2 62a_100000186775_200011218536 [0,2,0,0,0,0|2,0,0]=4 11303 B18R2.266 Cc1ccc(cc1)SC(C)Cc2ccccc2 62a_200011218536_100000186775 [0,2,0,0,0,0|2,0,0]=4 11304 B18R2.266 Cc1ccc(cn1)CC(=O)Cc2ccccc2 1458a_100000740413_100015291786 [0,2,0,0,0,0|2,0,0]=4 11305 B18R2.266 Cc1ccc(cn1)CN(C)Cc2ccccc2 2230a_100000186898_100016987292 [0,2,0,0,0,0|2,0,0]=4 11306 B18R2.266 Cc1ccc(cn1)CN(C)Cc2ccccc2 2230a_106623407658_100015291786 [0,2,0,0,0,0|2,0,0]=4 11307 B18R2.266 Cc1ccc(cn1)CN(C)Cc2ccccc2 269982a_100000186898_100016987292 [0,2,0,0,0,0|2,0,0]=4 11308 B18R2.266 Cc1ccc(cn1)CN(C)Cc2ccccc2 269982a_106623407658_100000211182 [0,2,0,0,0,0|2,0,0]=4 11309 B18R2.266 Cc1ccc(cn1)CN(C)Cc2ccccc2 270004a_100000186898_100000743784 [0,2,0,0,0,0|2,0,0]=4 11310 B18R2.266 Cc1ccc(cn1)CN(C)Cc2ccccc2 270004a_106623407658_100015611070 [0,2,0,0,0,0|2,0,0]=4 11311 B18R2.266 Cc1ccc(cn1)CN(C)Cc2ccccc2 34a_106623407658_100015291786 [0,2,0,0,0,0|2,0,0]=4 11312 B18R2.266 Cc1ccc(nc1)CC(=O)Cc2ccccc2 1458a_100025705728_100015291786 [0,2,0,0,0,0|2,0,0]=4 11313 B18R2.266 Cc1ccc(nc1)CN(C)Cc2ccccc2 2230a_100000186898_100000691093 [0,2,0,0,0,0|2,0,0]=4 11314 B18R2.266 Cc1ccc(nc1)CN(C)Cc2ccccc2 2230a_200000717808_100015291786 [0,2,0,0,0,0|2,0,0]=4 11315 B18R2.266 Cc1ccc(nc1)CN(C)Cc2ccccc2 269982a_100000186898_100000691093 [0,2,0,0,0,0|2,0,0]=4 11316 B18R2.266 Cc1ccc(nc1)CN(C)Cc2ccccc2 269982a_200000717808_100000211182 [0,2,0,0,0,0|2,0,0]=4 11317 B18R2.266 Cc1ccc(nc1)CN(C)Cc2ccccc2 270004a_100000186898_100000050478 [0,2,0,0,0,0|2,0,0]=4 11318 B18R2.266 Cc1ccc(nc1)CN(C)Cc2ccccc2 270004a_200000717808_100015611070 [0,2,0,0,0,0|2,0,0]=4 11319 B18R2.266 O=C(Cc1ccc(cc1)Br)C[n+]2ccccc2 1458a_200000086051_100000189115 [0,2,0,0,0,0|2,0,0]=4 11320 B18R2.266 O=C(Cc1ccc(cc1)Br)Cc2ccccn2 1458a_100000198978_100000721315 [0,2,0,0,0,0|2,0,0]=4 11321 B18R2.266 O=C(Cc1ccc(cc1)Br)Cc2ccccn2 1458a_100000233486_100000189115 [0,2,0,0,0,0|2,0,0]=4 11322 B18R2.266 O=C(Cc1ccc(cc1)Br)Cc2cccnc2 1458a_100000198978_100000733263 [0,2,0,0,0,0|2,0,0]=4 11323 B18R2.266 O=C(Cc1ccc(cc1)Br)Cc2cccnc2 1458a_100000737805_100000189115 [0,2,0,0,0,0|2,0,0]=4 11324 B18R2.266 O=C(Cc1ccc(cc1)Br)Nc2ccccc2 11a_100000106764_100000198978 [0,2,0,0,0,0|2,0,0]=4 11325 B18R2.266 O=C(Cc1ccc(cc1)Br)Nc2ccccc2 22a_100000106764_100000198978 [0,2,0,0,0,0|2,0,0]=4 11326 B18R2.266 O=C(Cc1ccc(cc1)Br)Nc2ccccc2 527a_100000106764_100000198978 [0,2,0,0,0,0|2,0,0]=4 11327 B18R2.266 O=C(Cc1ccc(cc1)Cl)C[n+]2ccccc2 1458a_200000086051_100000694040 [0,2,0,0,0,0|2,0,0]=4 11328 B18R2.266 O=C(Cc1ccc(cc1)Cl)Cc2ccccn2 1458a_100000211027_100000721315 [0,2,0,0,0,0|2,0,0]=4 11329 B18R2.266 O=C(Cc1ccc(cc1)Cl)Cc2ccccn2 1458a_100000233486_100000694040 [0,2,0,0,0,0|2,0,0]=4 11330 B18R2.266 O=C(Cc1ccc(cc1)Cl)Cc2cccnc2 1458a_100000211027_100000733263 [0,2,0,0,0,0|2,0,0]=4 11331 B18R2.266 O=C(Cc1ccc(cc1)Cl)Cc2cccnc2 1458a_100000737805_100000694040 [0,2,0,0,0,0|2,0,0]=4 11332 B18R2.266 O=C(Cc1ccc(cc1)Cl)Nc2ccccc2 11a_100000106764_100000211027 [0,2,0,0,0,0|2,0,0]=4 11333 B18R2.266 O=C(Cc1ccc(cc1)Cl)Nc2ccccc2 22a_100000106764_100000211027 [0,2,0,0,0,0|2,0,0]=4 11334 B18R2.266 O=C(Cc1ccc(cc1)Cl)Nc2ccccc2 527a_100000106764_100000211027 [0,2,0,0,0,0|2,0,0]=4 11335 B18R2.266 O=C(Cc1ccc(cc1)F)C[n+]2ccccc2 1458a_200000086051_100000198546 [0,2,0,0,0,0|2,0,0]=4 11336 B18R2.266 O=C(Cc1ccc(cc1)F)Cc2ccccn2 1458a_100000210951_100000721315 [0,2,0,0,0,0|2,0,0]=4 11337 B18R2.266 O=C(Cc1ccc(cc1)F)Cc2ccccn2 1458a_100000233486_100000198546 [0,2,0,0,0,0|2,0,0]=4 11338 B18R2.266 O=C(Cc1ccc(cc1)F)Cc2cccnc2 1458a_100000210951_100000733263 [0,2,0,0,0,0|2,0,0]=4 11339 B18R2.266 O=C(Cc1ccc(cc1)F)Cc2cccnc2 1458a_100000737805_100000198546 [0,2,0,0,0,0|2,0,0]=4 11340 B18R2.266 O=C(Cc1ccc(cc1)F)Nc2ccccc2 11a_100000106764_100000210951 [0,2,0,0,0,0|2,0,0]=4 11341 B18R2.266 O=C(Cc1ccc(cc1)F)Nc2ccccc2 1626a_100000106764_100000210951 [0,2,0,0,0,0|2,0,0]=4 11342 B18R2.266 O=C(Cc1ccc(cc1)F)Nc2ccccc2 22a_100000106764_100000210951 [0,2,0,0,0,0|2,0,0]=4 11343 B18R2.266 O=C(Cc1ccc(cc1)F)Nc2ccccc2 527a_100000106764_100000210951 [0,2,0,0,0,0|2,0,0]=4 11344 B18R2.266 O=C(Cc1ccc(cc1)I)C[n+]2ccccc2 1458a_200000086051_100000189116 [0,2,0,0,0,0|2,0,0]=4 11345 B18R2.266 O=C(Cc1ccc(cc1)I)Cc2ccccn2 1458a_100000233486_100000189116 [0,2,0,0,0,0|2,0,0]=4 11346 B18R2.266 O=C(Cc1ccc(cc1)I)Cc2ccccn2 1458a_100000688869_100000721315 [0,2,0,0,0,0|2,0,0]=4 11347 B18R2.266 O=C(Cc1ccc(cc1)I)Cc2cccnc2 1458a_100000688869_100000733263 [0,2,0,0,0,0|2,0,0]=4 11348 B18R2.266 O=C(Cc1ccc(cc1)I)Cc2cccnc2 1458a_100000737805_100000189116 [0,2,0,0,0,0|2,0,0]=4 11349 B18R2.266 O=C(Cc1ccc(cc1)I)Nc2ccccc2 11a_100000106764_100000688869 [0,2,0,0,0,0|2,0,0]=4 11350 B18R2.266 O=C(Cc1ccc(cc1)I)Nc2ccccc2 1626a_100000106764_100000688869 [0,2,0,0,0,0|2,0,0]=4 11351 B18R2.266 O=C(Cc1ccc(cc1)I)Nc2ccccc2 22a_100000106764_100000688869 [0,2,0,0,0,0|2,0,0]=4 11352 B18R2.266 O=C(Cc1ccc(cc1)I)Nc2ccccc2 527a_100000106764_100000688869 [0,2,0,0,0,0|2,0,0]=4 11353 B18R2.266 O=C(Cc1ccc(cc1)O)Cc2ccccn2 1458a_100000198540_100000721315 [0,2,0,0,0,0|2,0,0]=4 11354 B18R2.266 O=C(Cc1ccc(cc1)O)Cc2cccnc2 1458a_100000198540_100000733263 [0,2,0,0,0,0|2,0,0]=4 11355 B18R2.266 O=C(Cc1ccc(cc1)O)Nc2ccccc2 1626a_100000106764_100000198540 [0,2,0,0,0,0|2,0,0]=4 11356 B18R2.266 O=C(Cc1ccc(cc1)O)Nc2ccccc2 22a_100000106764_100000198540 [0,2,0,0,0,0|2,0,0]=4 11357 B18R2.266 O=C(Cc1ccc(cc1)O)Nc2ccccc2 527a_100000106764_100000198540 [0,2,0,0,0,0|2,0,0]=4 11358 B18R2.266 O=C(Cc1ccccc1)Cc2ccc(cc2)Br 1458a_100000198978_100015291786 [0,2,0,0,0,0|1,0,0]=3 11359 B18R2.266 O=C(Cc1ccccc1)Cc2ccc(cc2)Cl 1458a_100000211027_100015291786 [0,2,0,0,0,0|1,0,0]=3 11360 B18R2.266 O=C(Cc1ccccc1)Cc2ccc(cc2)F 1458a_100000210951_100015291786 [0,2,0,0,0,0|1,0,0]=3 11361 B18R2.266 O=C(Cc1ccccc1)Cc2ccc(cc2)I 1458a_100000688869_100015291786 [0,2,0,0,0,0|1,0,0]=3 11362 B18R2.266 O=C(Cc1ccccc1)Cc2ccc(cc2)O 1458a_100000198540_100015291786 [0,2,0,0,0,0|1,0,0]=3 11363 B18R2.266 O=C(Cc1ccccc1)Cc2ccc(cn2)Br 1458a_100020629044_100015291786 [0,2,0,0,0,0|2,0,0]=4 11364 B18R2.266 O=C(Cc1ccccc1)Cc2ccc(cn2)Cl 1458a_100000728320_100015291786 [0,2,0,0,0,0|2,0,0]=4 11365 B18R2.266 O=C(Cc1ccccc1)Cc2ccc(nc2)Br 1458a_100010067268_100015291786 [0,2,0,0,0,0|2,0,0]=4 11366 B18R2.266 O=C(Cc1ccccc1)Cc2ccc(nc2)Cl 1458a_100000061944_100015291786 [0,2,0,0,0,0|2,0,0]=4 11367 B18R2.266 O=C(Cc1ccccc1)Cn2ccc(=O)cc2 1458a_200000238563_100015291786 [0,2,0,0,0,0|2,0,0]=4 11368 B18R2.266 O=C(Cc1ccccc1)Nc2ccc(cc2)O 271570a_203496583355_200017124962 [0,2,0,0,0,0|2,0,0]=4 11369 B18R2.266 O=C(Cc1ccncc1)Cc2ccc(cc2)Br 1458a_100000198978_100000705612 [0,2,0,0,0,0|2,0,0]=4 11370 B18R2.266 O=C(Cc1ccncc1)Cc2ccc(cc2)Cl 1458a_100000211027_100000705612 [0,2,0,0,0,0|2,0,0]=4 11371 B18R2.266 O=C(Cc1ccncc1)Cc2ccc(cc2)F 1458a_100000210951_100000705612 [0,2,0,0,0,0|2,0,0]=4 11372 B18R2.266 O=C(Cc1ccncc1)Cc2ccc(cc2)I 1458a_100000688869_100000705612 [0,2,0,0,0,0|2,0,0]=4 11373 B18R2.266 O=C(Cc1ccncc1)Cc2ccc(cc2)O 1458a_100000198540_100000705612 [0,2,0,0,0,0|2,0,0]=4 11374 B18R2.266 [13CH3]N(Cc1ccc(cc1)F)Cc2cccnc2 2230a_200000262393_200025704644 [0,2,0,0,0,0|2,0,0]=4 11375 B18R2.266 [13CH3]N(Cc1ccc(cc1)F)Cc2cccnc2 269982a_200000262393_200025704644 [0,2,0,0,0,0|2,0,0]=4 11376 B18R2.266 [13CH3]N(Cc1ccc(cc1)F)Cc2cccnc2 34a_200000262393_200025704644 [0,2,0,0,0,0|2,0,0]=4 11377 B18R2.266 [13CH3]N(Cc1ccccc1)Cc2ccc(cc2)Br 2230a_100000195849_200025704644 [0,2,0,0,0,0|1,0,0]=3 11378 B18R2.266 [13CH3]N(Cc1ccccc1)Cc2ccc(cc2)Br 269982a_100000195849_200025704644 [0,2,0,0,0,0|1,0,0]=3 11379 B18R2.266 [13CH3]N(Cc1ccccc1)Cc2ccc(cc2)Br 34a_100000195849_200025704644 [0,2,0,0,0,0|1,0,0]=3 11380 B18R2.3983 CC(Cc1ccccc1)Nc2ccccc2Br 34a_100000210017_200011218536 [0,2,0,0,0,0|2,0,0]=4 11381 B18R2.3983 CC(Cc1ccccc1)Nc2ccccc2Cl 34a_100000185783_200011218536 [0,2,0,0,0,0|2,0,0]=4 11382 B18R2.3983 CC(Cc1ccccc1)Nc2ccccc2F 34a_100000210422_200011218536 [0,2,0,0,0,0|2,0,0]=4 11383 B18R2.3983 CC(Cc1ccccc1)Nc2ccccc2I 34a_100000210053_200011218536 [0,2,0,0,0,0|2,0,0]=4 11384 B18R2.3983 CC(Cc1ccccc1)Nc2ccccc2O 34a_100000185747_200011218536 [0,2,0,0,0,0|2,0,0]=4 11385 B18R2.3983 CC(Cc1ccccc1)Oc2ccccc2Br 34a_100000181306_200011218536 [0,2,0,0,0,0|2,0,0]=4 11386 B18R2.3983 CC(Cc1ccccc1)Oc2ccccc2Br 7a_100000181306_200011218536 [0,2,0,0,0,0|2,0,0]=4 11387 B18R2.3983 CC(Cc1ccccc1)Oc2ccccc2Cl 34a_100000210172_200011218536 [0,2,0,0,0,0|2,0,0]=4 11388 B18R2.3983 CC(Cc1ccccc1)Oc2ccccc2Cl 7a_100000210172_200011218536 [0,2,0,0,0,0|2,0,0]=4 11389 B18R2.3983 CC(Cc1ccccc1)Oc2ccccc2F 34a_100000210171_200011218536 [0,2,0,0,0,0|2,0,0]=4 11390 B18R2.3983 CC(Cc1ccccc1)Oc2ccccc2F 7a_100000210171_200011218536 [0,2,0,0,0,0|2,0,0]=4 11391 B18R2.3983 CC(Cc1ccccc1)Oc2ccccc2I 34a_100000739446_200011218536 [0,2,0,0,0,0|2,0,0]=4 11392 B18R2.3983 CC(Cc1ccccc1)Oc2ccccc2I 7a_100000739446_200011218536 [0,2,0,0,0,0|2,0,0]=4 11393 B18R2.3983 CC(Cc1ccccc1)Oc2ccccc2N 34a_100000185747_200011218536 [0,2,0,0,0,0|2,0,0]=4 11394 B18R2.3983 CC(Cc1ccccc1)Oc2ccccc2N 7a_100000185747_200011218536 [0,2,0,0,0,0|2,0,0]=4 11395 B18R2.3983 CC(Cc1ccccc1)Sc2ccccc2Br 62a_100000695589_200011218536 [0,2,0,0,0,0|2,0,0]=4 11396 B18R2.3983 CC(Cc1ccccc1)Sc2ccccc2Br 62a_200011218536_100000695589 [0,2,0,0,0,0|2,0,0]=4 11397 B18R2.3983 CC(Cc1ccccc1)Sc2ccccc2Cl 62a_100000764095_200011218536 [0,2,0,0,0,0|2,0,0]=4 11398 B18R2.3983 CC(Cc1ccccc1)Sc2ccccc2Cl 62a_200011218536_100000764095 [0,2,0,0,0,0|2,0,0]=4 11399 B18R2.3983 CC(Cc1ccccc1)Sc2ccccc2F 62a_100011215700_200011218536 [0,2,0,0,0,0|2,0,0]=4 11400 B18R2.3983 CC(Cc1ccccc1)Sc2ccccc2F 62a_200011218536_100011215700 [0,2,0,0,0,0|2,0,0]=4 11401 B18R2.3983 CC(Cc1ccccc1)Sc2ccccc2N 62a_100000210017_200011218536 [0,2,0,0,0,0|2,0,0]=4 11402 B18R2.3983 CC(Cc1ccccc1)Sc2ccccc2N 62a_200011218536_100000210017 [0,2,0,0,0,0|2,0,0]=4 11403 B18R2.3983 CC(Cc1ccccc1)Sc2ccccc2O 62a_100000739446_200011218536 [0,2,0,0,0,0|2,0,0]=4 11404 B18R2.3983 CC(Cc1ccccc1)Sc2ccccc2O 62a_200011218536_100000739446 [0,2,0,0,0,0|2,0,0]=4 11405 B18R2.3983 CN(Cc1ccccc1)Cc2ccccc2Br 2230a_100000184654_100015291786 [0,2,0,0,0,0|1,0,0]=3 11406 B18R2.3983 CN(Cc1ccccc1)Cc2ccccc2Br 2230a_100000186898_100000184730 [0,2,0,0,0,0|1,0,0]=3 11407 B18R2.3983 CN(Cc1ccccc1)Cc2ccccc2Br 2230a_200000195884_200000210301 [0,2,0,0,0,0|1,0,0]=3 11408 B18R2.3983 CN(Cc1ccccc1)Cc2ccccc2Br 269982a_100000184654_100000211182 [0,2,0,0,0,0|1,0,0]=3 11409 B18R2.3983 CN(Cc1ccccc1)Cc2ccccc2Br 269982a_100000186898_100000184730 [0,2,0,0,0,0|1,0,0]=3 11410 B18R2.3983 CN(Cc1ccccc1)Cc2ccccc2Br 269982a_200000195884_200000210301 [0,2,0,0,0,0|1,0,0]=3 11411 B18R2.3983 CN(Cc1ccccc1)Cc2ccccc2Br 26a_100000186898_100000181306 [0,2,0,0,0,0|1,0,0]=3 11412 B18R2.3983 CN(Cc1ccccc1)Cc2ccccc2Br 270004a_100000184654_100015611070 [0,2,0,0,0,0|1,0,0]=3 11413 B18R2.3983 CN(Cc1ccccc1)Cc2ccccc2Br 270004a_100000186898_100000211189 [0,2,0,0,0,0|1,0,0]=3 11414 B18R2.3983 CN(Cc1ccccc1)Cc2ccccc2Cl 2230a_100000184507_100015291786 [0,2,0,0,0,0|1,0,0]=3 11415 B18R2.3983 CN(Cc1ccccc1)Cc2ccccc2Cl 2230a_100000186898_100000187162 [0,2,0,0,0,0|1,0,0]=3 11416 B18R2.3983 CN(Cc1ccccc1)Cc2ccccc2Cl 269982a_100000184507_100000211182 [0,2,0,0,0,0|1,0,0]=3 11417 B18R2.3983 CN(Cc1ccccc1)Cc2ccccc2Cl 269982a_100000186898_100000187162 [0,2,0,0,0,0|1,0,0]=3 11418 B18R2.3983 CN(Cc1ccccc1)Cc2ccccc2Cl 26a_100000186898_100000210172 [0,2,0,0,0,0|1,0,0]=3 11419 B18R2.3983 CN(Cc1ccccc1)Cc2ccccc2Cl 270004a_100000184507_100015611070 [0,2,0,0,0,0|1,0,0]=3 11420 B18R2.3983 CN(Cc1ccccc1)Cc2ccccc2Cl 270004a_100000186898_100000210073 [0,2,0,0,0,0|1,0,0]=3 11421 B18R2.3983 CN(Cc1ccccc1)Cc2ccccc2F 2230a_100000186898_100000211605 [0,2,0,0,0,0|1,0,0]=3 11422 B18R2.3983 CN(Cc1ccccc1)Cc2ccccc2F 2230a_100000742528_100015291786 [0,2,0,0,0,0|1,0,0]=3 11423 B18R2.3983 CN(Cc1ccccc1)Cc2ccccc2F 269982a_100000186898_100000211605 [0,2,0,0,0,0|1,0,0]=3 11424 B18R2.3983 CN(Cc1ccccc1)Cc2ccccc2F 269982a_100000742528_100000211182 [0,2,0,0,0,0|1,0,0]=3 11425 B18R2.3983 CN(Cc1ccccc1)Cc2ccccc2F 270004a_100000186898_100000210811 [0,2,0,0,0,0|1,0,0]=3 11426 B18R2.3983 CN(Cc1ccccc1)Cc2ccccc2F 270004a_100000742528_100015611070 [0,2,0,0,0,0|1,0,0]=3 11427 B18R2.3983 CN(Cc1ccccc1)Cc2ccccc2F 34a_100000742528_100015291786 [0,2,0,0,0,0|1,0,0]=3 11428 B18R2.3983 CN(Cc1ccccc1)Cc2ccccc2I 2230a_100000186898_100011215278 [0,2,0,0,0,0|1,0,0]=3 11429 B18R2.3983 CN(Cc1ccccc1)Cc2ccccc2I 269982a_100000186898_100011215278 [0,2,0,0,0,0|1,0,0]=3 11430 B18R2.3983 CN(Cc1ccccc1)Cc2ccccc2I 270004a_100000186898_100000010305 [0,2,0,0,0,0|1,0,0]=3 11431 B18R2.3983 CN(Cc1ccccc1)Cc2ccccc2O 2230a_100011219060_200000210301 [0,2,0,0,0,0|1,0,0]=3 11432 B18R2.3983 CN(Cc1ccccc1)Cc2ccccc2O 2230a_100015189988_100015291786 [0,2,0,0,0,0|1,0,0]=3 11433 B18R2.3983 CN(Cc1ccccc1)Cc2ccccc2O 269982a_100011219060_200000210301 [0,2,0,0,0,0|1,0,0]=3 11434 B18R2.3983 CN(Cc1ccccc1)Cc2ccccc2O 269982a_100015189988_100000211182 [0,2,0,0,0,0|1,0,0]=3 11435 B18R2.3983 CN(Cc1ccccc1)Cc2ccccc2O 270004a_100015189988_100015611070 [0,2,0,0,0,0|1,0,0]=3 11436 B18R2.3983 CN(Cc1ccccc1)Cc2cccnc2Br 2230a_100000186898_100010140945 [0,2,0,0,0,0|2,0,0]=4 11437 B18R2.3983 CN(Cc1ccccc1)Cc2cccnc2Br 269982a_100000186898_100010140945 [0,2,0,0,0,0|2,0,0]=4 11438 B18R2.3983 CN(Cc1ccccc1)Cc2cccnc2Cl 2230a_100000186898_100000045678 [0,2,0,0,0,0|2,0,0]=4 11439 B18R2.3983 CN(Cc1ccccc1)Cc2cccnc2Cl 2230a_103496529121_100015291786 [0,2,0,0,0,0|2,0,0]=4 11440 B18R2.3983 CN(Cc1ccccc1)Cc2cccnc2Cl 269982a_100000186898_100000045678 [0,2,0,0,0,0|2,0,0]=4 11441 B18R2.3983 CN(Cc1ccccc1)Cc2cccnc2Cl 269982a_103496529121_100000211182 [0,2,0,0,0,0|2,0,0]=4 11442 B18R2.3983 CN(Cc1ccccc1)Cc2cccnc2Cl 270004a_103496529121_100015611070 [0,2,0,0,0,0|2,0,0]=4 11443 B18R2.3983 CN(Cc1ccccc1)Cc2cccnc2F 2230a_100000186898_100000099810 [0,2,0,0,0,0|2,0,0]=4 11444 B18R2.3983 CN(Cc1ccccc1)Cc2cccnc2F 269982a_100000186898_100000099810 [0,2,0,0,0,0|2,0,0]=4 11445 B18R2.3983 CN(Cc1ccccc1)Cc2cccnc2O 270004a_100000186898_100011998315 [0,2,0,0,0,0|2,0,0]=4 11446 B18R2.3983 CN(Cc1ccccc1)Cc2ccncc2Br 270004a_100000186898_100000755692 [0,2,0,0,0,0|2,0,0]=4 11447 B18R2.3983 CN(Cc1ccccc1)Cc2ccncc2Cl 2230a_100000186898_100000763264 [0,2,0,0,0,0|2,0,0]=4 11448 B18R2.3983 CN(Cc1ccccc1)Cc2ccncc2Cl 269982a_100000186898_100000763264 [0,2,0,0,0,0|2,0,0]=4 11449 B18R2.3983 CN(Cc1ccccc1)Cc2ccncc2Cl 270004a_100000186898_100011934409 [0,2,0,0,0,0|2,0,0]=4 11450 B18R2.3983 CN(Cc1ccccc1)Cc2cnccc2Br 270004a_100000186898_100009816821 [0,2,0,0,0,0|2,0,0]=4 11451 B18R2.3983 CN(Cc1ccccc1)Cc2cnccc2Cl 270004a_100000186898_100000050567 [0,2,0,0,0,0|2,0,0]=4 11452 B18R2.3983 CN(Cc1ccccc1)Cc2ncccc2Br 2230a_100000186898_100025702911 [0,2,0,0,0,0|2,0,0]=4 11453 B18R2.3983 CN(Cc1ccccc1)Cc2ncccc2Br 270004a_100000186898_100011934733 [0,2,0,0,0,0|2,0,0]=4 11454 B18R2.3983 CN(Cc1ccccc1)Cc2ncccc2Cl 2230a_100000186898_100000099807 [0,2,0,0,0,0|2,0,0]=4 11455 B18R2.3983 CN(Cc1ccccc1)Cc2ncccc2Cl 269982a_100000186898_100000099807 [0,2,0,0,0,0|2,0,0]=4 11456 B18R2.3983 CN(Cc1ccccc1)Cc2ncccc2Cl 270004a_100000186898_100012001307 [0,2,0,0,0,0|2,0,0]=4 11457 B18R2.3983 CN(Cc1ccccc1)Cc2ncccc2F 2230a_100000186898_100000104219 [0,2,0,0,0,0|2,0,0]=4 11458 B18R2.3983 CN(Cc1ccccc1)Cc2ncccc2F 269982a_100000186898_100000104219 [0,2,0,0,0,0|2,0,0]=4 11459 B18R2.3983 CN(Cc1ccccc1)Cc2ncccc2F 270004a_100000186898_100011934734 [0,2,0,0,0,0|2,0,0]=4 11460 B18R2.3983 CN(Cc1ccccn1)Cc2ccccc2Br 2230a_100000184654_100000721315 [0,2,0,0,0,0|2,0,0]=4 11461 B18R2.3983 CN(Cc1ccccn1)Cc2ccccc2Br 2230a_100000207498_100000184730 [0,2,0,0,0,0|2,0,0]=4 11462 B18R2.3983 CN(Cc1ccccn1)Cc2ccccc2Br 269982a_100000184654_100000721315 [0,2,0,0,0,0|2,0,0]=4 11463 B18R2.3983 CN(Cc1ccccn1)Cc2ccccc2Br 269982a_100000207498_100000184730 [0,2,0,0,0,0|2,0,0]=4 11464 B18R2.3983 CN(Cc1ccccn1)Cc2ccccc2Br 26a_100000207498_100000181306 [0,2,0,0,0,0|2,0,0]=4 11465 B18R2.3983 CN(Cc1ccccn1)Cc2ccccc2Br 270004a_100000184654_100000209966 [0,2,0,0,0,0|2,0,0]=4 11466 B18R2.3983 CN(Cc1ccccn1)Cc2ccccc2Br 270004a_100000207498_100000211189 [0,2,0,0,0,0|2,0,0]=4 11467 B18R2.3983 CN(Cc1ccccn1)Cc2ccccc2Cl 2230a_100000184507_100000721315 [0,2,0,0,0,0|2,0,0]=4 11468 B18R2.3983 CN(Cc1ccccn1)Cc2ccccc2Cl 2230a_100000207498_100000187162 [0,2,0,0,0,0|2,0,0]=4 11469 B18R2.3983 CN(Cc1ccccn1)Cc2ccccc2Cl 269982a_100000184507_100000721315 [0,2,0,0,0,0|2,0,0]=4 11470 B18R2.3983 CN(Cc1ccccn1)Cc2ccccc2Cl 269982a_100000207498_100000187162 [0,2,0,0,0,0|2,0,0]=4 11471 B18R2.3983 CN(Cc1ccccn1)Cc2ccccc2Cl 26a_100000207498_100000210172 [0,2,0,0,0,0|2,0,0]=4 11472 B18R2.3983 CN(Cc1ccccn1)Cc2ccccc2Cl 270004a_100000184507_100000209966 [0,2,0,0,0,0|2,0,0]=4 11473 B18R2.3983 CN(Cc1ccccn1)Cc2ccccc2Cl 270004a_100000207498_100000210073 [0,2,0,0,0,0|2,0,0]=4 11474 B18R2.3983 CN(Cc1ccccn1)Cc2ccccc2F 2230a_100000207498_100000211605 [0,2,0,0,0,0|2,0,0]=4 11475 B18R2.3983 CN(Cc1ccccn1)Cc2ccccc2F 2230a_100000742528_100000721315 [0,2,0,0,0,0|2,0,0]=4 11476 B18R2.3983 CN(Cc1ccccn1)Cc2ccccc2F 269982a_100000207498_100000211605 [0,2,0,0,0,0|2,0,0]=4 11477 B18R2.3983 CN(Cc1ccccn1)Cc2ccccc2F 269982a_100000742528_100000721315 [0,2,0,0,0,0|2,0,0]=4 11478 B18R2.3983 CN(Cc1ccccn1)Cc2ccccc2F 270004a_100000207498_100000210811 [0,2,0,0,0,0|2,0,0]=4 11479 B18R2.3983 CN(Cc1ccccn1)Cc2ccccc2F 270004a_100000742528_100000209966 [0,2,0,0,0,0|2,0,0]=4 11480 B18R2.3983 CN(Cc1ccccn1)Cc2ccccc2F 34a_100000742528_100000721315 [0,2,0,0,0,0|2,0,0]=4 11481 B18R2.3983 CN(Cc1ccccn1)Cc2ccccc2I 2230a_100000207498_100011215278 [0,2,0,0,0,0|2,0,0]=4 11482 B18R2.3983 CN(Cc1ccccn1)Cc2ccccc2I 269982a_100000207498_100011215278 [0,2,0,0,0,0|2,0,0]=4 11483 B18R2.3983 CN(Cc1ccccn1)Cc2ccccc2I 270004a_100000207498_100000010305 [0,2,0,0,0,0|2,0,0]=4 11484 B18R2.3983 CN(Cc1ccccn1)Cc2ccccc2O 2230a_100015189988_100000721315 [0,2,0,0,0,0|2,0,0]=4 11485 B18R2.3983 CN(Cc1ccccn1)Cc2ccccc2O 269982a_100015189988_100000721315 [0,2,0,0,0,0|2,0,0]=4 11486 B18R2.3983 CN(Cc1ccccn1)Cc2ccccc2O 270004a_100015189988_100000209966 [0,2,0,0,0,0|2,0,0]=4 11487 B18R2.3983 CN(Cc1cccnc1)Cc2ccccc2Br 2230a_100000184577_100000184730 [0,2,0,0,0,0|2,0,0]=4 11488 B18R2.3983 CN(Cc1cccnc1)Cc2ccccc2Br 2230a_100000184654_100000741622 [0,2,0,0,0,0|2,0,0]=4 11489 B18R2.3983 CN(Cc1cccnc1)Cc2ccccc2Br 269982a_100000184577_100000184730 [0,2,0,0,0,0|2,0,0]=4 11490 B18R2.3983 CN(Cc1cccnc1)Cc2ccccc2Br 269982a_100000184654_100000733263 [0,2,0,0,0,0|2,0,0]=4 11491 B18R2.3983 CN(Cc1cccnc1)Cc2ccccc2Br 26a_100000184577_100000181306 [0,2,0,0,0,0|2,0,0]=4 11492 B18R2.3983 CN(Cc1cccnc1)Cc2ccccc2Br 270004a_100000184577_100000211189 [0,2,0,0,0,0|2,0,0]=4 11493 B18R2.3983 CN(Cc1cccnc1)Cc2ccccc2Br 270004a_100000184654_100000209961 [0,2,0,0,0,0|2,0,0]=4 11494 B18R2.3983 CN(Cc1cccnc1)Cc2ccccc2Cl 2230a_100000184507_100000741622 [0,2,0,0,0,0|2,0,0]=4 11495 B18R2.3983 CN(Cc1cccnc1)Cc2ccccc2Cl 2230a_100000184577_100000187162 [0,2,0,0,0,0|2,0,0]=4 11496 B18R2.3983 CN(Cc1cccnc1)Cc2ccccc2Cl 269982a_100000184507_100000733263 [0,2,0,0,0,0|2,0,0]=4 11497 B18R2.3983 CN(Cc1cccnc1)Cc2ccccc2Cl 269982a_100000184577_100000187162 [0,2,0,0,0,0|2,0,0]=4 11498 B18R2.3983 CN(Cc1cccnc1)Cc2ccccc2Cl 26a_100000184577_100000210172 [0,2,0,0,0,0|2,0,0]=4 11499 B18R2.3983 CN(Cc1cccnc1)Cc2ccccc2Cl 270004a_100000184507_100000209961 [0,2,0,0,0,0|2,0,0]=4 11500 B18R2.3983 CN(Cc1cccnc1)Cc2ccccc2Cl 270004a_100000184577_100000210073 [0,2,0,0,0,0|2,0,0]=4 11501 B18R2.3983 CN(Cc1cccnc1)Cc2ccccc2F 2230a_100000184577_100000211605 [0,2,0,0,0,0|2,0,0]=4 11502 B18R2.3983 CN(Cc1cccnc1)Cc2ccccc2F 2230a_100000742528_100000741622 [0,2,0,0,0,0|2,0,0]=4 11503 B18R2.3983 CN(Cc1cccnc1)Cc2ccccc2F 269982a_100000184577_100000211605 [0,2,0,0,0,0|2,0,0]=4 11504 B18R2.3983 CN(Cc1cccnc1)Cc2ccccc2F 269982a_100000742528_100000733263 [0,2,0,0,0,0|2,0,0]=4 11505 B18R2.3983 CN(Cc1cccnc1)Cc2ccccc2F 270004a_100000184577_100000210811 [0,2,0,0,0,0|2,0,0]=4 11506 B18R2.3983 CN(Cc1cccnc1)Cc2ccccc2F 270004a_100000742528_100000209961 [0,2,0,0,0,0|2,0,0]=4 11507 B18R2.3983 CN(Cc1cccnc1)Cc2ccccc2F 34a_100000742528_100000733263 [0,2,0,0,0,0|2,0,0]=4 11508 B18R2.3983 CN(Cc1cccnc1)Cc2ccccc2I 2230a_100000184577_100011215278 [0,2,0,0,0,0|2,0,0]=4 11509 B18R2.3983 CN(Cc1cccnc1)Cc2ccccc2I 269982a_100000184577_100011215278 [0,2,0,0,0,0|2,0,0]=4 11510 B18R2.3983 CN(Cc1cccnc1)Cc2ccccc2I 270004a_100000184577_100000010305 [0,2,0,0,0,0|2,0,0]=4 11511 B18R2.3983 CN(Cc1cccnc1)Cc2ccccc2O 2230a_100015189988_100000741622 [0,2,0,0,0,0|2,0,0]=4 11512 B18R2.3983 CN(Cc1cccnc1)Cc2ccccc2O 269982a_100015189988_100000733263 [0,2,0,0,0,0|2,0,0]=4 11513 B18R2.3983 CN(Cc1cccnc1)Cc2ccccc2O 270004a_100015189988_100000209961 [0,2,0,0,0,0|2,0,0]=4 11514 B18R2.3983 CN(Cc1ccncc1)Cc2ccccc2Br 2230a_100000184654_100015193705 [0,2,0,0,0,0|2,0,0]=4 11515 B18R2.3983 CN(Cc1ccncc1)Cc2ccccc2Br 2230a_100000187231_100000184730 [0,2,0,0,0,0|2,0,0]=4 11516 B18R2.3983 CN(Cc1ccncc1)Cc2ccccc2Br 269982a_100000184654_100015193705 [0,2,0,0,0,0|2,0,0]=4 11517 B18R2.3983 CN(Cc1ccncc1)Cc2ccccc2Br 269982a_100000187231_100000184730 [0,2,0,0,0,0|2,0,0]=4 11518 B18R2.3983 CN(Cc1ccncc1)Cc2ccccc2Br 26a_100000187231_100000181306 [0,2,0,0,0,0|2,0,0]=4 11519 B18R2.3983 CN(Cc1ccncc1)Cc2ccccc2Br 270004a_100000187231_100000211189 [0,2,0,0,0,0|2,0,0]=4 11520 B18R2.3983 CN(Cc1ccncc1)Cc2ccccc2Cl 2230a_100000184507_100015193705 [0,2,0,0,0,0|2,0,0]=4 11521 B18R2.3983 CN(Cc1ccncc1)Cc2ccccc2Cl 2230a_100000187231_100000187162 [0,2,0,0,0,0|2,0,0]=4 11522 B18R2.3983 CN(Cc1ccncc1)Cc2ccccc2Cl 269982a_100000184507_100015193705 [0,2,0,0,0,0|2,0,0]=4 11523 B18R2.3983 CN(Cc1ccncc1)Cc2ccccc2Cl 269982a_100000187231_100000187162 [0,2,0,0,0,0|2,0,0]=4 11524 B18R2.3983 CN(Cc1ccncc1)Cc2ccccc2Cl 26a_100000187231_100000210172 [0,2,0,0,0,0|2,0,0]=4 11525 B18R2.3983 CN(Cc1ccncc1)Cc2ccccc2Cl 270004a_100000187231_100000210073 [0,2,0,0,0,0|2,0,0]=4 11526 B18R2.3983 CN(Cc1ccncc1)Cc2ccccc2F 2230a_100000187231_100000211605 [0,2,0,0,0,0|2,0,0]=4 11527 B18R2.3983 CN(Cc1ccncc1)Cc2ccccc2F 2230a_100000742528_100015193705 [0,2,0,0,0,0|2,0,0]=4 11528 B18R2.3983 CN(Cc1ccncc1)Cc2ccccc2F 269982a_100000187231_100000211605 [0,2,0,0,0,0|2,0,0]=4 11529 B18R2.3983 CN(Cc1ccncc1)Cc2ccccc2F 269982a_100000742528_100015193705 [0,2,0,0,0,0|2,0,0]=4 11530 B18R2.3983 CN(Cc1ccncc1)Cc2ccccc2F 270004a_100000187231_100000210811 [0,2,0,0,0,0|2,0,0]=4 11531 B18R2.3983 CN(Cc1ccncc1)Cc2ccccc2I 2230a_100000187231_100011215278 [0,2,0,0,0,0|2,0,0]=4 11532 B18R2.3983 CN(Cc1ccncc1)Cc2ccccc2I 269982a_100000187231_100011215278 [0,2,0,0,0,0|2,0,0]=4 11533 B18R2.3983 CN(Cc1ccncc1)Cc2ccccc2I 270004a_100000187231_100000010305 [0,2,0,0,0,0|2,0,0]=4 11534 B18R2.3983 CN(Cc1ccncc1)Cc2ccccc2O 2230a_100015189988_100015193705 [0,2,0,0,0,0|2,0,0]=4 11535 B18R2.3983 CN(Cc1ccncc1)Cc2ccccc2O 269982a_100015189988_100015193705 [0,2,0,0,0,0|2,0,0]=4 11536 B18R2.3983 Cc1ccccc1CC(=O)C[n+]2ccccc2 1458a_200000086051_100000211839 [0,2,0,0,0,0|2,0,0]=4 11537 B18R2.3983 Cc1ccccc1CC(=O)Cc2ccccc2 1458a_100000212180_100015291786 [0,2,0,0,0,0|1,0,0]=3 11538 B18R2.3983 Cc1ccccc1CC(=O)Cc2ccccn2 1458a_100000212180_100000721315 [0,2,0,0,0,0|2,0,0]=4 11539 B18R2.3983 Cc1ccccc1CC(=O)Cc2ccccn2 1458a_100000233486_100000211839 [0,2,0,0,0,0|2,0,0]=4 11540 B18R2.3983 Cc1ccccc1CC(=O)Cc2cccnc2 1458a_100000212180_100000733263 [0,2,0,0,0,0|2,0,0]=4 11541 B18R2.3983 Cc1ccccc1CC(=O)Cc2cccnc2 1458a_100000737805_100000211839 [0,2,0,0,0,0|2,0,0]=4 11542 B18R2.3983 Cc1ccccc1CC(=O)Cc2ccncc2 1458a_100000212180_100000705612 [0,2,0,0,0,0|2,0,0]=4 11543 B18R2.3983 Cc1ccccc1CC(=O)Nc2ccccc2 11a_100000106764_100000212180 [0,2,0,0,0,0|2,0,0]=4 11544 B18R2.3983 Cc1ccccc1CC(=O)Nc2ccccc2 1626a_100000106764_100000212180 [0,2,0,0,0,0|2,0,0]=4 11545 B18R2.3983 Cc1ccccc1CC(=O)Nc2ccccc2 22a_100000106764_100000212180 [0,2,0,0,0,0|2,0,0]=4 11546 B18R2.3983 Cc1ccccc1CC(=O)Nc2ccccc2 527a_100000106764_100000212180 [0,2,0,0,0,0|2,0,0]=4 11547 B18R2.3983 Cc1ccccc1CN(C)Cc2ccccc2 2230a_100000184421_100015291786 [0,2,0,0,0,0|1,0,0]=3 11548 B18R2.3983 Cc1ccccc1CN(C)Cc2ccccc2 2230a_100000186898_100000211839 [0,2,0,0,0,0|1,0,0]=3 11549 B18R2.3983 Cc1ccccc1CN(C)Cc2ccccc2 2230a_100000187337_200000210301 [0,2,0,0,0,0|1,0,0]=3 11550 B18R2.3983 Cc1ccccc1CN(C)Cc2ccccc2 269982a_100000184421_100000211182 [0,2,0,0,0,0|1,0,0]=3 11551 B18R2.3983 Cc1ccccc1CN(C)Cc2ccccc2 269982a_100000186898_100000211839 [0,2,0,0,0,0|1,0,0]=3 11552 B18R2.3983 Cc1ccccc1CN(C)Cc2ccccc2 269982a_100000187337_200000210301 [0,2,0,0,0,0|1,0,0]=3 11553 B18R2.3983 Cc1ccccc1CN(C)Cc2ccccc2 270004a_100000184421_100015611070 [0,2,0,0,0,0|1,0,0]=3 11554 B18R2.3983 Cc1ccccc1CN(C)Cc2ccccc2 270004a_100000186898_100000211143 [0,2,0,0,0,0|1,0,0]=3 11555 B18R2.3983 Cc1ccccc1CN(C)Cc2ccccc2 34a_100000187337_200000210301 [0,2,0,0,0,0|1,0,0]=3 11556 B18R2.3983 Cc1ccccc1CN(C)Cc2ccccn2 2230a_100000184421_100000721315 [0,2,0,0,0,0|2,0,0]=4 11557 B18R2.3983 Cc1ccccc1CN(C)Cc2ccccn2 2230a_100000207498_100000211839 [0,2,0,0,0,0|2,0,0]=4 11558 B18R2.3983 Cc1ccccc1CN(C)Cc2ccccn2 269982a_100000184421_100000721315 [0,2,0,0,0,0|2,0,0]=4 11559 B18R2.3983 Cc1ccccc1CN(C)Cc2ccccn2 269982a_100000207498_100000211839 [0,2,0,0,0,0|2,0,0]=4 11560 B18R2.3983 Cc1ccccc1CN(C)Cc2ccccn2 270004a_100000184421_100000209966 [0,2,0,0,0,0|2,0,0]=4 11561 B18R2.3983 Cc1ccccc1CN(C)Cc2ccccn2 270004a_100000207498_100000211143 [0,2,0,0,0,0|2,0,0]=4 11562 B18R2.3983 Cc1ccccc1CN(C)Cc2cccnc2 2230a_100000184421_100000741622 [0,2,0,0,0,0|2,0,0]=4 11563 B18R2.3983 Cc1ccccc1CN(C)Cc2cccnc2 2230a_100000184577_100000211839 [0,2,0,0,0,0|2,0,0]=4 11564 B18R2.3983 Cc1ccccc1CN(C)Cc2cccnc2 2230a_100000266129_200000210301 [0,2,0,0,0,0|2,0,0]=4 11565 B18R2.3983 Cc1ccccc1CN(C)Cc2cccnc2 269982a_100000184421_100000733263 [0,2,0,0,0,0|2,0,0]=4 11566 B18R2.3983 Cc1ccccc1CN(C)Cc2cccnc2 269982a_100000184577_100000211839 [0,2,0,0,0,0|2,0,0]=4 11567 B18R2.3983 Cc1ccccc1CN(C)Cc2cccnc2 269982a_100000266129_200000210301 [0,2,0,0,0,0|2,0,0]=4 11568 B18R2.3983 Cc1ccccc1CN(C)Cc2cccnc2 270004a_100000184421_100000209961 [0,2,0,0,0,0|2,0,0]=4 11569 B18R2.3983 Cc1ccccc1CN(C)Cc2cccnc2 270004a_100000184577_100000211143 [0,2,0,0,0,0|2,0,0]=4 11570 B18R2.3983 Cc1ccccc1CN(C)Cc2ccncc2 2230a_100000184421_100015193705 [0,2,0,0,0,0|2,0,0]=4 11571 B18R2.3983 Cc1ccccc1CN(C)Cc2ccncc2 2230a_100000187231_100000211839 [0,2,0,0,0,0|2,0,0]=4 11572 B18R2.3983 Cc1ccccc1CN(C)Cc2ccncc2 269982a_100000184421_100015193705 [0,2,0,0,0,0|2,0,0]=4 11573 B18R2.3983 Cc1ccccc1CN(C)Cc2ccncc2 269982a_100000187231_100000211839 [0,2,0,0,0,0|2,0,0]=4 11574 B18R2.3983 Cc1ccccc1CN(C)Cc2ccncc2 270004a_100000187231_100000211143 [0,2,0,0,0,0|2,0,0]=4 11575 B18R2.3983 Cc1ccccc1CN([13CH3])Cc2ccccc2 2230a_100000187337_200025704644 [0,2,0,0,0,0|1,0,0]=3 11576 B18R2.3983 Cc1ccccc1CN([13CH3])Cc2ccccc2 269982a_100000187337_200025704644 [0,2,0,0,0,0|1,0,0]=3 11577 B18R2.3983 Cc1ccccc1CN([13CH3])Cc2ccccc2 34a_100000187337_200025704644 [0,2,0,0,0,0|1,0,0]=3 11578 B18R2.3983 Cc1ccccc1CN([13CH3])Cc2cccnc2 2230a_100000266129_200025704644 [0,2,0,0,0,0|2,0,0]=4 11579 B18R2.3983 Cc1ccccc1CN([13CH3])Cc2cccnc2 269982a_100000266129_200025704644 [0,2,0,0,0,0|2,0,0]=4 11580 B18R2.3983 Cc1ccccc1NC(C)Cc2ccccc2 34a_100015192222_200011218536 [0,2,0,0,0,0|2,0,0]=4 11581 B18R2.3983 Cc1ccccc1OC(C)Cc2ccccc2 34a_100000210338_200011218536 [0,2,0,0,0,0|2,0,0]=4 11582 B18R2.3983 Cc1ccccc1OC(C)Cc2ccccc2 7a_100000210338_200011218536 [0,2,0,0,0,0|2,0,0]=4 11583 B18R2.3983 Cc1ccccc1SC(C)Cc2ccccc2 62a_100000210755_200011218536 [0,2,0,0,0,0|2,0,0]=4 11584 B18R2.3983 Cc1ccccc1SC(C)Cc2ccccc2 62a_200011218536_100000210755 [0,2,0,0,0,0|2,0,0]=4 11585 B18R2.3983 Cc1cccnc1CC(=O)Cc2ccccc2 1458a_200000722269_100015291786 [0,2,0,0,0,0|2,0,0]=4 11586 B18R2.3983 Cc1cccnc1CN(C)Cc2ccccc2 2230a_100000186898_100000696600 [0,2,0,0,0,0|2,0,0]=4 11587 B18R2.3983 Cc1cccnc1CN(C)Cc2ccccc2 2230a_100015184576_200000210301 [0,2,0,0,0,0|2,0,0]=4 11588 B18R2.3983 Cc1cccnc1CN(C)Cc2ccccc2 269982a_100000186898_100000696600 [0,2,0,0,0,0|2,0,0]=4 11589 B18R2.3983 Cc1cccnc1CN(C)Cc2ccccc2 269982a_100015184576_200000210301 [0,2,0,0,0,0|2,0,0]=4 11590 B18R2.3983 Cc1cccnc1CN(C)Cc2ccccc2 270004a_100000186898_100000698913 [0,2,0,0,0,0|2,0,0]=4 11591 B18R2.3983 Cc1cccnc1CN([13CH3])Cc2ccccc2 2230a_100015184576_200025704644 [0,2,0,0,0,0|2,0,0]=4 11592 B18R2.3983 Cc1cccnc1CN([13CH3])Cc2ccccc2 269982a_100015184576_200025704644 [0,2,0,0,0,0|2,0,0]=4 11593 B18R2.3983 Cc1ccncc1CN(C)Cc2ccccc2 2230a_100000186898_100000690890 [0,2,0,0,0,0|2,0,0]=4 11594 B18R2.3983 Cc1ccncc1CN(C)Cc2ccccc2 269982a_100000186898_100000690890 [0,2,0,0,0,0|2,0,0]=4 11595 B18R2.3983 Cc1ccncc1CN(C)Cc2ccccc2 270004a_100000186898_100000685662 [0,2,0,0,0,0|2,0,0]=4 11596 B18R2.3983 Cc1cnccc1CN(C)Cc2ccccc2 2230a_100000186898_100020672808 [0,2,0,0,0,0|2,0,0]=4 11597 B18R2.3983 Cc1cnccc1CN(C)Cc2ccccc2 2230a_100015187836_100015291786 [0,2,0,0,0,0|2,0,0]=4 11598 B18R2.3983 Cc1cnccc1CN(C)Cc2ccccc2 269982a_100000186898_100020672808 [0,2,0,0,0,0|2,0,0]=4 11599 B18R2.3983 Cc1cnccc1CN(C)Cc2ccccc2 269982a_100015187836_100000211182 [0,2,0,0,0,0|2,0,0]=4 11600 B18R2.3983 Cc1cnccc1CN(C)Cc2ccccc2 270004a_100015187836_100015611070 [0,2,0,0,0,0|2,0,0]=4 11601 B18R2.3983 Cc1ncccc1CN(C)Cc2ccccc2 2230a_100000186898_100000732876 [0,2,0,0,0,0|2,0,0]=4 11602 B18R2.3983 Cc1ncccc1CN(C)Cc2ccccc2 2230a_200011875998_100015291786 [0,2,0,0,0,0|2,0,0]=4 11603 B18R2.3983 Cc1ncccc1CN(C)Cc2ccccc2 269982a_100000186898_100000732876 [0,2,0,0,0,0|2,0,0]=4 11604 B18R2.3983 Cc1ncccc1CN(C)Cc2ccccc2 269982a_200011875998_100000211182 [0,2,0,0,0,0|2,0,0]=4 11605 B18R2.3983 Cc1ncccc1CN(C)Cc2ccccc2 270004a_100000186898_100000751968 [0,2,0,0,0,0|2,0,0]=4 11606 B18R2.3983 Cc1ncccc1CN(C)Cc2ccccc2 270004a_200011875998_100015611070 [0,2,0,0,0,0|2,0,0]=4 11607 B18R2.3983 O=C(Cc1ccccc1)Cc2ccccc2Br 1458a_100000751119_100015291786 [0,2,0,0,0,0|1,0,0]=3 11608 B18R2.3983 O=C(Cc1ccccc1)Cc2ccccc2Cl 1458a_100000183793_100015291786 [0,2,0,0,0,0|1,0,0]=3 11609 B18R2.3983 O=C(Cc1ccccc1)Cc2ccccc2F 1458a_100000212012_100015291786 [0,2,0,0,0,0|1,0,0]=3 11610 B18R2.3983 O=C(Cc1ccccc1)Cc2ccccc2I 1458a_100000036491_100015291786 [0,2,0,0,0,0|1,0,0]=3 11611 B18R2.3983 O=C(Cc1ccccc1)Cc2ccccc2O 1458a_100000743006_100015291786 [0,2,0,0,0,0|1,0,0]=3 11612 B18R2.3983 O=C(Cc1ccccc1)Cc2cccnc2Cl 1458a_100000093521_100015291786 [0,2,0,0,0,0|2,0,0]=4 11613 B18R2.3983 O=C(Cc1ccccc1)Cc2ncccc2Br 1458a_200012357574_100015291786 [0,2,0,0,0,0|2,0,0]=4 11614 B18R2.3983 O=C(Cc1ccccc1)Cc2ncccc2Cl 1458a_100011998755_100015291786 [0,2,0,0,0,0|2,0,0]=4 11615 B18R2.3983 O=C(Cc1ccccc1)Cn2ccccc2=O 1458a_100000189665_100015291786 [0,2,0,0,0,0|2,0,0]=4 11616 B18R2.3983 O=C(Cc1ccccc1Br)C[n+]2ccccc2 1458a_200000086051_100000184730 [0,2,0,0,0,0|2,0,0]=4 11617 B18R2.3983 O=C(Cc1ccccc1Br)Nc2ccccc2 11a_100000106764_100000751119 [0,2,0,0,0,0|2,0,0]=4 11618 B18R2.3983 O=C(Cc1ccccc1Br)Nc2ccccc2 22a_100000106764_100000751119 [0,2,0,0,0,0|2,0,0]=4 11619 B18R2.3983 O=C(Cc1ccccc1Br)Nc2ccccc2 527a_100000106764_100000751119 [0,2,0,0,0,0|2,0,0]=4 11620 B18R2.3983 O=C(Cc1ccccc1Cl)C[n+]2ccccc2 1458a_200000086051_100000187162 [0,2,0,0,0,0|2,0,0]=4 11621 B18R2.3983 O=C(Cc1ccccc1Cl)Nc2ccccc2 11a_100000106764_100000183793 [0,2,0,0,0,0|2,0,0]=4 11622 B18R2.3983 O=C(Cc1ccccc1Cl)Nc2ccccc2 1626a_100000106764_100000183793 [0,2,0,0,0,0|2,0,0]=4 11623 B18R2.3983 O=C(Cc1ccccc1Cl)Nc2ccccc2 22a_100000106764_100000183793 [0,2,0,0,0,0|2,0,0]=4 11624 B18R2.3983 O=C(Cc1ccccc1Cl)Nc2ccccc2 527a_100000106764_100000183793 [0,2,0,0,0,0|2,0,0]=4 11625 B18R2.3983 O=C(Cc1ccccc1F)C[n+]2ccccc2 1458a_200000086051_100000187165 [0,2,0,0,0,0|2,0,0]=4 11626 B18R2.3983 O=C(Cc1ccccc1F)Nc2ccccc2 11a_100000106764_100000212012 [0,2,0,0,0,0|2,0,0]=4 11627 B18R2.3983 O=C(Cc1ccccc1F)Nc2ccccc2 1626a_100000106764_100000212012 [0,2,0,0,0,0|2,0,0]=4 11628 B18R2.3983 O=C(Cc1ccccc1F)Nc2ccccc2 22a_100000106764_100000212012 [0,2,0,0,0,0|2,0,0]=4 11629 B18R2.3983 O=C(Cc1ccccc1F)Nc2ccccc2 527a_100000106764_100000212012 [0,2,0,0,0,0|2,0,0]=4 11630 B18R2.3983 O=C(Cc1ccccc1I)C[n+]2ccccc2 1458a_200000086051_100011216222 [0,2,0,0,0,0|2,0,0]=4 11631 B18R2.3983 O=C(Cc1ccccc1I)Nc2ccccc2 11a_100000106764_100000036491 [0,2,0,0,0,0|2,0,0]=4 11632 B18R2.3983 O=C(Cc1ccccc1I)Nc2ccccc2 1626a_100000106764_100000036491 [0,2,0,0,0,0|2,0,0]=4 11633 B18R2.3983 O=C(Cc1ccccc1I)Nc2ccccc2 22a_100000106764_100000036491 [0,2,0,0,0,0|2,0,0]=4 11634 B18R2.3983 O=C(Cc1ccccc1I)Nc2ccccc2 527a_100000106764_100000036491 [0,2,0,0,0,0|2,0,0]=4 11635 B18R2.3983 O=C(Cc1ccccc1O)Nc2ccccc2 22a_100000106764_100000743006 [0,2,0,0,0,0|2,0,0]=4 11636 B18R2.3983 O=C(Cc1ccccc1O)Nc2ccccc2 527a_100000106764_100000743006 [0,2,0,0,0,0|2,0,0]=4 11637 B18R2.3983 O=C(Cc1ccccn1)Cc2ccccc2Br 1458a_100000233486_100000184730 [0,2,0,0,0,0|2,0,0]=4 11638 B18R2.3983 O=C(Cc1ccccn1)Cc2ccccc2Br 1458a_100000751119_100000721315 [0,2,0,0,0,0|2,0,0]=4 11639 B18R2.3983 O=C(Cc1ccccn1)Cc2ccccc2Cl 1458a_100000183793_100000721315 [0,2,0,0,0,0|2,0,0]=4 11640 B18R2.3983 O=C(Cc1ccccn1)Cc2ccccc2Cl 1458a_100000233486_100000187162 [0,2,0,0,0,0|2,0,0]=4 11641 B18R2.3983 O=C(Cc1ccccn1)Cc2ccccc2F 1458a_100000212012_100000721315 [0,2,0,0,0,0|2,0,0]=4 11642 B18R2.3983 O=C(Cc1ccccn1)Cc2ccccc2F 1458a_100000233486_100000187165 [0,2,0,0,0,0|2,0,0]=4 11643 B18R2.3983 O=C(Cc1ccccn1)Cc2ccccc2I 1458a_100000036491_100000721315 [0,2,0,0,0,0|2,0,0]=4 11644 B18R2.3983 O=C(Cc1ccccn1)Cc2ccccc2I 1458a_100000233486_100011216222 [0,2,0,0,0,0|2,0,0]=4 11645 B18R2.3983 O=C(Cc1ccccn1)Cc2ccccc2O 1458a_100000743006_100000721315 [0,2,0,0,0,0|2,0,0]=4 11646 B18R2.3983 O=C(Cc1cccnc1)Cc2ccccc2Br 1458a_100000737805_100000184730 [0,2,0,0,0,0|2,0,0]=4 11647 B18R2.3983 O=C(Cc1cccnc1)Cc2ccccc2Br 1458a_100000751119_100000733263 [0,2,0,0,0,0|2,0,0]=4 11648 B18R2.3983 O=C(Cc1cccnc1)Cc2ccccc2Cl 1458a_100000183793_100000733263 [0,2,0,0,0,0|2,0,0]=4 11649 B18R2.3983 O=C(Cc1cccnc1)Cc2ccccc2Cl 1458a_100000737805_100000187162 [0,2,0,0,0,0|2,0,0]=4 11650 B18R2.3983 O=C(Cc1cccnc1)Cc2ccccc2F 1458a_100000212012_100000733263 [0,2,0,0,0,0|2,0,0]=4 11651 B18R2.3983 O=C(Cc1cccnc1)Cc2ccccc2F 1458a_100000737805_100000187165 [0,2,0,0,0,0|2,0,0]=4 11652 B18R2.3983 O=C(Cc1cccnc1)Cc2ccccc2I 1458a_100000036491_100000733263 [0,2,0,0,0,0|2,0,0]=4 11653 B18R2.3983 O=C(Cc1cccnc1)Cc2ccccc2I 1458a_100000737805_100011216222 [0,2,0,0,0,0|2,0,0]=4 11654 B18R2.3983 O=C(Cc1cccnc1)Cc2ccccc2O 1458a_100000743006_100000733263 [0,2,0,0,0,0|2,0,0]=4 11655 B18R2.3983 O=C(Cc1ccncc1)Cc2ccccc2Br 1458a_100000751119_100000705612 [0,2,0,0,0,0|2,0,0]=4 11656 B18R2.3983 O=C(Cc1ccncc1)Cc2ccccc2Cl 1458a_100000183793_100000705612 [0,2,0,0,0,0|2,0,0]=4 11657 B18R2.3983 O=C(Cc1ccncc1)Cc2ccccc2F 1458a_100000212012_100000705612 [0,2,0,0,0,0|2,0,0]=4 11658 B18R2.3983 O=C(Cc1ccncc1)Cc2ccccc2I 1458a_100000036491_100000705612 [0,2,0,0,0,0|2,0,0]=4 11659 B18R2.3983 O=C(Cc1ccncc1)Cc2ccccc2O 1458a_100000743006_100000705612 [0,2,0,0,0,0|2,0,0]=4 11660 B18R2.3983 [13CH3]N(Cc1ccccc1)Cc2ccccc2Br 2230a_200000195884_200025704644 [0,2,0,0,0,0|1,0,0]=3 11661 B18R2.3983 [13CH3]N(Cc1ccccc1)Cc2ccccc2Br 269982a_200000195884_200025704644 [0,2,0,0,0,0|1,0,0]=3 11662 B18R2.3983 [13CH3]N(Cc1ccccc1)Cc2ccccc2O 2230a_100011219060_200025704644 [0,2,0,0,0,0|1,0,0]=3 11663 B18R2.3983 [13CH3]N(Cc1ccccc1)Cc2ccccc2O 269982a_100011219060_200025704644 [0,2,0,0,0,0|1,0,0]=3 11664 B18R2.6478 CC(Cc1ccccc1)Nc2cccc(c2)Br 34a_100000210019_200011218536 [0,2,0,0,0,0|2,0,0]=4 11665 B18R2.6478 CC(Cc1ccccc1)Nc2cccc(c2)Cl 34a_100000185859_200011218536 [0,2,0,0,0,0|2,0,0]=4 11666 B18R2.6478 CC(Cc1ccccc1)Nc2cccc(c2)F 34a_100000210047_200011218536 [0,2,0,0,0,0|2,0,0]=4 11667 B18R2.6478 CC(Cc1ccccc1)Nc2cccc(c2)I 34a_100000211102_200011218536 [0,2,0,0,0,0|2,0,0]=4 11668 B18R2.6478 CC(Cc1ccccc1)Nc2cccc(c2)O 34a_100000210217_200011218536 [0,2,0,0,0,0|2,0,0]=4 11669 B18R2.6478 CC(Cc1ccccc1)Oc2cccc(c2)Br 34a_100000210342_200011218536 [0,2,0,0,0,0|2,0,0]=4 11670 B18R2.6478 CC(Cc1ccccc1)Oc2cccc(c2)Br 7a_100000210342_200011218536 [0,2,0,0,0,0|2,0,0]=4 11671 B18R2.6478 CC(Cc1ccccc1)Oc2cccc(c2)Cl 34a_100000210295_200011218536 [0,2,0,0,0,0|2,0,0]=4 11672 B18R2.6478 CC(Cc1ccccc1)Oc2cccc(c2)Cl 7a_100000210295_200011218536 [0,2,0,0,0,0|2,0,0]=4 11673 B18R2.6478 CC(Cc1ccccc1)Oc2cccc(c2)F 34a_100000210426_200011218536 [0,2,0,0,0,0|2,0,0]=4 11674 B18R2.6478 CC(Cc1ccccc1)Oc2cccc(c2)F 7a_100000210426_200011218536 [0,2,0,0,0,0|2,0,0]=4 11675 B18R2.6478 CC(Cc1ccccc1)Oc2cccc(c2)I 34a_100000211634_200011218536 [0,2,0,0,0,0|2,0,0]=4 11676 B18R2.6478 CC(Cc1ccccc1)Oc2cccc(c2)I 7a_100000211634_200011218536 [0,2,0,0,0,0|2,0,0]=4 11677 B18R2.6478 CC(Cc1ccccc1)Oc2cccc(c2)N 34a_100000210217_200011218536 [0,2,0,0,0,0|2,0,0]=4 11678 B18R2.6478 CC(Cc1ccccc1)Sc2cccc(c2)Br 62a_100000691529_200011218536 [0,2,0,0,0,0|2,0,0]=4 11679 B18R2.6478 CC(Cc1ccccc1)Sc2cccc(c2)Br 62a_200011218536_100000691529 [0,2,0,0,0,0|2,0,0]=4 11680 B18R2.6478 CC(Cc1ccccc1)Sc2cccc(c2)Cl 62a_100000699651_200011218536 [0,2,0,0,0,0|2,0,0]=4 11681 B18R2.6478 CC(Cc1ccccc1)Sc2cccc(c2)Cl 62a_200011218536_100000699651 [0,2,0,0,0,0|2,0,0]=4 11682 B18R2.6478 CC(Cc1ccccc1)Sc2cccc(c2)F 62a_100000685547_200011218536 [0,2,0,0,0,0|2,0,0]=4 11683 B18R2.6478 CC(Cc1ccccc1)Sc2cccc(c2)F 62a_200011218536_100000685547 [0,2,0,0,0,0|2,0,0]=4 11684 B18R2.6478 CC(Cc1ccccc1)Sc2cccc(c2)N 62a_100000210019_200011218536 [0,2,0,0,0,0|2,0,0]=4 11685 B18R2.6478 CC(Cc1ccccc1)Sc2cccc(c2)N 62a_200011218536_100000210019 [0,2,0,0,0,0|2,0,0]=4 11686 B18R2.6478 CC(Cc1ccccc1)Sc2cccc(c2)O 62a_200011218536_100000211634 [0,2,0,0,0,0|2,0,0]=4 11687 B18R2.6478 CC(Cc1ccccc1)Sc2cccc(c2)[S] 62a_114929384022_200011218536 [0,2,0,0,0,0|2,0,0]=4 11688 B18R2.6478 CC(Cc1ccccc1)Sc2cccc(c2)[S] 62a_200011218536_114929384022 [0,2,0,0,0,0|2,0,0]=4 11689 B18R2.6478 CN(Cc1cccc(c1)Br)Cc2ccccn2 2230a_100000187585_100000721315 [0,2,0,0,0,0|2,0,0]=4 11690 B18R2.6478 CN(Cc1cccc(c1)Br)Cc2ccccn2 2230a_100000207498_100000698116 [0,2,0,0,0,0|2,0,0]=4 11691 B18R2.6478 CN(Cc1cccc(c1)Br)Cc2ccccn2 269982a_100000187585_100000721315 [0,2,0,0,0,0|2,0,0]=4 11692 B18R2.6478 CN(Cc1cccc(c1)Br)Cc2ccccn2 269982a_100000207498_100000211773 [0,2,0,0,0,0|2,0,0]=4 11693 B18R2.6478 CN(Cc1cccc(c1)Br)Cc2ccccn2 26a_100000207498_100000210342 [0,2,0,0,0,0|2,0,0]=4 11694 B18R2.6478 CN(Cc1cccc(c1)Br)Cc2ccccn2 270004a_100000187585_100000209966 [0,2,0,0,0,0|2,0,0]=4 11695 B18R2.6478 CN(Cc1cccc(c1)Br)Cc2ccccn2 270004a_100000207498_100000210085 [0,2,0,0,0,0|2,0,0]=4 11696 B18R2.6478 CN(Cc1cccc(c1)Cl)Cc2ccccn2 2230a_100000207498_100000181238 [0,2,0,0,0,0|2,0,0]=4 11697 B18R2.6478 CN(Cc1cccc(c1)Cl)Cc2ccccn2 2230a_100020629429_100000721315 [0,2,0,0,0,0|2,0,0]=4 11698 B18R2.6478 CN(Cc1cccc(c1)Cl)Cc2ccccn2 269982a_100000207498_100000181238 [0,2,0,0,0,0|2,0,0]=4 11699 B18R2.6478 CN(Cc1cccc(c1)Cl)Cc2ccccn2 269982a_100020629429_100000721315 [0,2,0,0,0,0|2,0,0]=4 11700 B18R2.6478 CN(Cc1cccc(c1)Cl)Cc2ccccn2 270004a_100000207498_100000210801 [0,2,0,0,0,0|2,0,0]=4 11701 B18R2.6478 CN(Cc1cccc(c1)Cl)Cc2ccccn2 270004a_100020629429_100000209966 [0,2,0,0,0,0|2,0,0]=4 11702 B18R2.6478 CN(Cc1cccc(c1)F)Cc2ccccn2 2230a_100000184398_100000721315 [0,2,0,0,0,0|2,0,0]=4 11703 B18R2.6478 CN(Cc1cccc(c1)F)Cc2ccccn2 2230a_100000207498_100000230114 [0,2,0,0,0,0|2,0,0]=4 11704 B18R2.6478 CN(Cc1cccc(c1)F)Cc2ccccn2 269982a_100000184398_100000721315 [0,2,0,0,0,0|2,0,0]=4 11705 B18R2.6478 CN(Cc1cccc(c1)F)Cc2ccccn2 269982a_100000207498_100000230114 [0,2,0,0,0,0|2,0,0]=4 11706 B18R2.6478 CN(Cc1cccc(c1)F)Cc2ccccn2 270004a_100000184398_100000209966 [0,2,0,0,0,0|2,0,0]=4 11707 B18R2.6478 CN(Cc1cccc(c1)F)Cc2ccccn2 270004a_100000207498_100000210812 [0,2,0,0,0,0|2,0,0]=4 11708 B18R2.6478 CN(Cc1cccc(c1)F)Cc2ccccn2 34a_100000184398_100000721315 [0,2,0,0,0,0|2,0,0]=4 11709 B18R2.6478 CN(Cc1cccc(c1)I)Cc2ccccn2 2230a_100000207498_100011218688 [0,2,0,0,0,0|2,0,0]=4 11710 B18R2.6478 CN(Cc1cccc(c1)I)Cc2ccccn2 269982a_100000207498_100011218688 [0,2,0,0,0,0|2,0,0]=4 11711 B18R2.6478 CN(Cc1cccc(c1)I)Cc2ccccn2 270004a_100000207498_100000014684 [0,2,0,0,0,0|2,0,0]=4 11712 B18R2.6478 CN(Cc1cccc(c1)O)Cc2ccccn2 2230a_100000207498_100011660834 [0,2,0,0,0,0|2,0,0]=4 11713 B18R2.6478 CN(Cc1cccc(c1)O)Cc2ccccn2 2230a_100000207540_100000721315 [0,2,0,0,0,0|2,0,0]=4 11714 B18R2.6478 CN(Cc1cccc(c1)O)Cc2ccccn2 269982a_100000207498_100000084143 [0,2,0,0,0,0|2,0,0]=4 11715 B18R2.6478 CN(Cc1cccc(c1)O)Cc2ccccn2 269982a_100000207540_100000721315 [0,2,0,0,0,0|2,0,0]=4 11716 B18R2.6478 CN(Cc1cccc(c1)O)Cc2ccccn2 270004a_100000207498_100000188321 [0,2,0,0,0,0|2,0,0]=4 11717 B18R2.6478 CN(Cc1cccc(c1)O)Cc2ccccn2 270004a_100000207540_100000209966 [0,2,0,0,0,0|2,0,0]=4 11718 B18R2.6478 CN(Cc1ccccc1)Cc2cc(ccn2)Br 2230a_100000186898_100010173614 [0,2,0,0,0,0|2,0,0]=4 11719 B18R2.6478 CN(Cc1ccccc1)Cc2cc(ccn2)Br 269982a_100000186898_100010173614 [0,2,0,0,0,0|2,0,0]=4 11720 B18R2.6478 CN(Cc1ccccc1)Cc2cc(ccn2)Br 270004a_100000186898_100009818557 [0,2,0,0,0,0|2,0,0]=4 11721 B18R2.6478 CN(Cc1ccccc1)Cc2cc(ccn2)Cl 2230a_100000186898_100016988179 [0,2,0,0,0,0|2,0,0]=4 11722 B18R2.6478 CN(Cc1ccccc1)Cc2cc(ccn2)Cl 2230a_100102954512_100015291786 [0,2,0,0,0,0|2,0,0]=4 11723 B18R2.6478 CN(Cc1ccccc1)Cc2cc(ccn2)Cl 269982a_100000186898_100016988179 [0,2,0,0,0,0|2,0,0]=4 11724 B18R2.6478 CN(Cc1ccccc1)Cc2cc(ccn2)Cl 269982a_100102954512_100000211182 [0,2,0,0,0,0|2,0,0]=4 11725 B18R2.6478 CN(Cc1ccccc1)Cc2cc(ccn2)Cl 270004a_100000186898_100011998288 [0,2,0,0,0,0|2,0,0]=4 11726 B18R2.6478 CN(Cc1ccccc1)Cc2cc(ccn2)Cl 270004a_100102954512_100015611070 [0,2,0,0,0,0|2,0,0]=4 11727 B18R2.6478 CN(Cc1ccccc1)Cc2cccc(c2)Br 2230a_100000186898_100000698116 [0,2,0,0,0,0|1,0,0]=3 11728 B18R2.6478 CN(Cc1ccccc1)Cc2cccc(c2)Br 2230a_100000187585_100015291786 [0,2,0,0,0,0|1,0,0]=3 11729 B18R2.6478 CN(Cc1ccccc1)Cc2cccc(c2)Br 269982a_100000186898_100000211773 [0,2,0,0,0,0|1,0,0]=3 11730 B18R2.6478 CN(Cc1ccccc1)Cc2cccc(c2)Br 269982a_100000187585_100000211182 [0,2,0,0,0,0|1,0,0]=3 11731 B18R2.6478 CN(Cc1ccccc1)Cc2cccc(c2)Br 26a_100000186898_100000210342 [0,2,0,0,0,0|1,0,0]=3 11732 B18R2.6478 CN(Cc1ccccc1)Cc2cccc(c2)Br 270004a_100000186898_100000210085 [0,2,0,0,0,0|1,0,0]=3 11733 B18R2.6478 CN(Cc1ccccc1)Cc2cccc(c2)Br 270004a_100000187585_100015611070 [0,2,0,0,0,0|1,0,0]=3 11734 B18R2.6478 CN(Cc1ccccc1)Cc2cccc(c2)Cl 2230a_100000186898_100000181238 [0,2,0,0,0,0|1,0,0]=3 11735 B18R2.6478 CN(Cc1ccccc1)Cc2cccc(c2)Cl 2230a_100020629429_100015291786 [0,2,0,0,0,0|1,0,0]=3 11736 B18R2.6478 CN(Cc1ccccc1)Cc2cccc(c2)Cl 269982a_100000186898_100000181238 [0,2,0,0,0,0|1,0,0]=3 11737 B18R2.6478 CN(Cc1ccccc1)Cc2cccc(c2)Cl 269982a_100020629429_100000211182 [0,2,0,0,0,0|1,0,0]=3 11738 B18R2.6478 CN(Cc1ccccc1)Cc2cccc(c2)Cl 270004a_100000186898_100000210801 [0,2,0,0,0,0|1,0,0]=3 11739 B18R2.6478 CN(Cc1ccccc1)Cc2cccc(c2)Cl 270004a_100020629429_100015611070 [0,2,0,0,0,0|1,0,0]=3 11740 B18R2.6478 CN(Cc1ccccc1)Cc2cccc(c2)F 2230a_100000184398_100015291786 [0,2,0,0,0,0|1,0,0]=3 11741 B18R2.6478 CN(Cc1ccccc1)Cc2cccc(c2)F 2230a_100000186898_100000230114 [0,2,0,0,0,0|1,0,0]=3 11742 B18R2.6478 CN(Cc1ccccc1)Cc2cccc(c2)F 269982a_100000184398_100000211182 [0,2,0,0,0,0|1,0,0]=3 11743 B18R2.6478 CN(Cc1ccccc1)Cc2cccc(c2)F 269982a_100000186898_100000230114 [0,2,0,0,0,0|1,0,0]=3 11744 B18R2.6478 CN(Cc1ccccc1)Cc2cccc(c2)F 270004a_100000184398_100015611070 [0,2,0,0,0,0|1,0,0]=3 11745 B18R2.6478 CN(Cc1ccccc1)Cc2cccc(c2)F 270004a_100000186898_100000210812 [0,2,0,0,0,0|1,0,0]=3 11746 B18R2.6478 CN(Cc1ccccc1)Cc2cccc(c2)F 34a_100000184398_100015291786 [0,2,0,0,0,0|1,0,0]=3 11747 B18R2.6478 CN(Cc1ccccc1)Cc2cccc(c2)I 2230a_100000186898_100011218688 [0,2,0,0,0,0|1,0,0]=3 11748 B18R2.6478 CN(Cc1ccccc1)Cc2cccc(c2)I 269982a_100000186898_100011218688 [0,2,0,0,0,0|1,0,0]=3 11749 B18R2.6478 CN(Cc1ccccc1)Cc2cccc(c2)I 270004a_100000186898_100000014684 [0,2,0,0,0,0|1,0,0]=3 11750 B18R2.6478 CN(Cc1ccccc1)Cc2cccc(c2)O 2230a_100000186898_100011660834 [0,2,0,0,0,0|1,0,0]=3 11751 B18R2.6478 CN(Cc1ccccc1)Cc2cccc(c2)O 2230a_100000207540_100015291786 [0,2,0,0,0,0|1,0,0]=3 11752 B18R2.6478 CN(Cc1ccccc1)Cc2cccc(c2)O 269982a_100000186898_100000084143 [0,2,0,0,0,0|1,0,0]=3 11753 B18R2.6478 CN(Cc1ccccc1)Cc2cccc(c2)O 269982a_100000207540_100000211182 [0,2,0,0,0,0|1,0,0]=3 11754 B18R2.6478 CN(Cc1ccccc1)Cc2cccc(c2)O 270004a_100000186898_100000188321 [0,2,0,0,0,0|1,0,0]=3 11755 B18R2.6478 CN(Cc1ccccc1)Cc2cccc(c2)O 270004a_100000207540_100015611070 [0,2,0,0,0,0|1,0,0]=3 11756 B18R2.6478 CN(Cc1ccccc1)Cc2cccc(n2)Br 2230a_100000186898_100009889011 [0,2,0,0,0,0|2,0,0]=4 11757 B18R2.6478 CN(Cc1ccccc1)Cc2cccc(n2)Br 2230a_106354212997_100015291786 [0,2,0,0,0,0|2,0,0]=4 11758 B18R2.6478 CN(Cc1ccccc1)Cc2cccc(n2)Br 269982a_100000186898_100009889011 [0,2,0,0,0,0|2,0,0]=4 11759 B18R2.6478 CN(Cc1ccccc1)Cc2cccc(n2)Br 269982a_106354212997_100000211182 [0,2,0,0,0,0|2,0,0]=4 11760 B18R2.6478 CN(Cc1ccccc1)Cc2cccc(n2)Br 270004a_100000186898_100000688028 [0,2,0,0,0,0|2,0,0]=4 11761 B18R2.6478 CN(Cc1ccccc1)Cc2cccc(n2)Br 270004a_106354212997_100015611070 [0,2,0,0,0,0|2,0,0]=4 11762 B18R2.6478 CN(Cc1ccccc1)Cc2cccc(n2)Cl 2230a_100000186898_100000086093 [0,2,0,0,0,0|2,0,0]=4 11763 B18R2.6478 CN(Cc1ccccc1)Cc2cccc(n2)Cl 269982a_100000186898_100000086093 [0,2,0,0,0,0|2,0,0]=4 11764 B18R2.6478 CN(Cc1ccccc1)Cc2cccc(n2)Cl 270004a_100000186898_100011361687 [0,2,0,0,0,0|2,0,0]=4 11765 B18R2.6478 CN(Cc1ccccc1)Cc2cccc(n2)F 2230a_100000186898_100009819644 [0,2,0,0,0,0|2,0,0]=4 11766 B18R2.6478 CN(Cc1ccccc1)Cc2cccc(n2)F 269982a_100000186898_100009819644 [0,2,0,0,0,0|2,0,0]=4 11767 B18R2.6478 CN(Cc1ccccc1)Cc2cccc(n2)F 270004a_100000186898_100000050434 [0,2,0,0,0,0|2,0,0]=4 11768 B18R2.6478 CN(Cc1ccccc1)Cc2ccnc(c2)Br 2230a_100000186898_100010243470 [0,2,0,0,0,0|2,0,0]=4 11769 B18R2.6478 CN(Cc1ccccc1)Cc2ccnc(c2)Br 269982a_100000186898_100010254460 [0,2,0,0,0,0|2,0,0]=4 11770 B18R2.6478 CN(Cc1ccccc1)Cc2ccnc(c2)Br 270004a_100000186898_100009814634 [0,2,0,0,0,0|2,0,0]=4 11771 B18R2.6478 CN(Cc1ccccc1)Cc2ccnc(c2)Cl 2230a_100000186898_100000764220 [0,2,0,0,0,0|2,0,0]=4 11772 B18R2.6478 CN(Cc1ccccc1)Cc2ccnc(c2)Cl 269982a_100000186898_100000764220 [0,2,0,0,0,0|2,0,0]=4 11773 B18R2.6478 CN(Cc1ccccc1)Cc2ccnc(c2)Cl 270004a_100000186898_100011290808 [0,2,0,0,0,0|2,0,0]=4 11774 B18R2.6478 CN(Cc1ccccc1)Cc2ccnc(c2)F 270004a_100000186898_100000068331 [0,2,0,0,0,0|2,0,0]=4 11775 B18R2.6478 CN(Cc1ccccc1)Cc2cncc(c2)Br 2230a_100000186898_100000738771 [0,2,0,0,0,0|2,0,0]=4 11776 B18R2.6478 CN(Cc1ccccc1)Cc2cncc(c2)Br 2230a_103549770560_100015291786 [0,2,0,0,0,0|2,0,0]=4 11777 B18R2.6478 CN(Cc1ccccc1)Cc2cncc(c2)Br 269982a_100000186898_100000738771 [0,2,0,0,0,0|2,0,0]=4 11778 B18R2.6478 CN(Cc1ccccc1)Cc2cncc(c2)Br 269982a_103549770560_100000211182 [0,2,0,0,0,0|2,0,0]=4 11779 B18R2.6478 CN(Cc1ccccc1)Cc2cncc(c2)Br 270004a_100000186898_100000687066 [0,2,0,0,0,0|2,0,0]=4 11780 B18R2.6478 CN(Cc1ccccc1)Cc2cncc(c2)Br 270004a_103549770560_100015611070 [0,2,0,0,0,0|2,0,0]=4 11781 B18R2.6478 CN(Cc1ccccc1)Cc2cncc(c2)Cl 2230a_100000186898_100016992070 [0,2,0,0,0,0|2,0,0]=4 11782 B18R2.6478 CN(Cc1ccccc1)Cc2cncc(c2)Cl 269982a_100000186898_100016992070 [0,2,0,0,0,0|2,0,0]=4 11783 B18R2.6478 CN(Cc1ccccc1)Cc2cncc(c2)Cl 270004a_100000186898_100000088910 [0,2,0,0,0,0|2,0,0]=4 11784 B18R2.6478 CN(Cc1ccccc1)Cc2cncc(c2)F 2230a_100000186898_100000725299 [0,2,0,0,0,0|2,0,0]=4 11785 B18R2.6478 CN(Cc1ccccc1)Cc2cncc(c2)F 269982a_100000186898_100000725299 [0,2,0,0,0,0|2,0,0]=4 11786 B18R2.6478 CN(Cc1ccccc1)Cc2cncc(c2)F 270004a_100000186898_100011361476 [0,2,0,0,0,0|2,0,0]=4 11787 B18R2.6478 CN(Cc1ccccc1)Cc2cncc(c2)O 270004a_100000186898_100012187055 [0,2,0,0,0,0|2,0,0]=4 11788 B18R2.6478 CN(Cc1cccnc1)Cc2cccc(c2)Br 2230a_100000184577_100000698116 [0,2,0,0,0,0|2,0,0]=4 11789 B18R2.6478 CN(Cc1cccnc1)Cc2cccc(c2)Br 2230a_100000187585_100000741622 [0,2,0,0,0,0|2,0,0]=4 11790 B18R2.6478 CN(Cc1cccnc1)Cc2cccc(c2)Br 269982a_100000184577_100000211773 [0,2,0,0,0,0|2,0,0]=4 11791 B18R2.6478 CN(Cc1cccnc1)Cc2cccc(c2)Br 269982a_100000187585_100000733263 [0,2,0,0,0,0|2,0,0]=4 11792 B18R2.6478 CN(Cc1cccnc1)Cc2cccc(c2)Br 26a_100000184577_100000210342 [0,2,0,0,0,0|2,0,0]=4 11793 B18R2.6478 CN(Cc1cccnc1)Cc2cccc(c2)Br 270004a_100000184577_100000210085 [0,2,0,0,0,0|2,0,0]=4 11794 B18R2.6478 CN(Cc1cccnc1)Cc2cccc(c2)Br 270004a_100000187585_100000209961 [0,2,0,0,0,0|2,0,0]=4 11795 B18R2.6478 CN(Cc1cccnc1)Cc2cccc(c2)Cl 2230a_100000184577_100000181238 [0,2,0,0,0,0|2,0,0]=4 11796 B18R2.6478 CN(Cc1cccnc1)Cc2cccc(c2)Cl 2230a_100020629429_100000741622 [0,2,0,0,0,0|2,0,0]=4 11797 B18R2.6478 CN(Cc1cccnc1)Cc2cccc(c2)Cl 269982a_100000184577_100000181238 [0,2,0,0,0,0|2,0,0]=4 11798 B18R2.6478 CN(Cc1cccnc1)Cc2cccc(c2)Cl 269982a_100020629429_100000733263 [0,2,0,0,0,0|2,0,0]=4 11799 B18R2.6478 CN(Cc1cccnc1)Cc2cccc(c2)Cl 270004a_100000184577_100000210801 [0,2,0,0,0,0|2,0,0]=4 11800 B18R2.6478 CN(Cc1cccnc1)Cc2cccc(c2)Cl 270004a_100020629429_100000209961 [0,2,0,0,0,0|2,0,0]=4 11801 B18R2.6478 CN(Cc1cccnc1)Cc2cccc(c2)F 2230a_100000184398_100000741622 [0,2,0,0,0,0|2,0,0]=4 11802 B18R2.6478 CN(Cc1cccnc1)Cc2cccc(c2)F 2230a_100000184577_100000230114 [0,2,0,0,0,0|2,0,0]=4 11803 B18R2.6478 CN(Cc1cccnc1)Cc2cccc(c2)F 269982a_100000184398_100000733263 [0,2,0,0,0,0|2,0,0]=4 11804 B18R2.6478 CN(Cc1cccnc1)Cc2cccc(c2)F 269982a_100000184577_100000230114 [0,2,0,0,0,0|2,0,0]=4 11805 B18R2.6478 CN(Cc1cccnc1)Cc2cccc(c2)F 270004a_100000184398_100000209961 [0,2,0,0,0,0|2,0,0]=4 11806 B18R2.6478 CN(Cc1cccnc1)Cc2cccc(c2)F 270004a_100000184577_100000210812 [0,2,0,0,0,0|2,0,0]=4 11807 B18R2.6478 CN(Cc1cccnc1)Cc2cccc(c2)F 34a_100000184398_100000733263 [0,2,0,0,0,0|2,0,0]=4 11808 B18R2.6478 CN(Cc1cccnc1)Cc2cccc(c2)I 2230a_100000184577_100011218688 [0,2,0,0,0,0|2,0,0]=4 11809 B18R2.6478 CN(Cc1cccnc1)Cc2cccc(c2)I 269982a_100000184577_100011218688 [0,2,0,0,0,0|2,0,0]=4 11810 B18R2.6478 CN(Cc1cccnc1)Cc2cccc(c2)I 270004a_100000184577_100000014684 [0,2,0,0,0,0|2,0,0]=4 11811 B18R2.6478 CN(Cc1cccnc1)Cc2cccc(c2)O 2230a_100000184577_100011660834 [0,2,0,0,0,0|2,0,0]=4 11812 B18R2.6478 CN(Cc1cccnc1)Cc2cccc(c2)O 2230a_100000207540_100000741622 [0,2,0,0,0,0|2,0,0]=4 11813 B18R2.6478 CN(Cc1cccnc1)Cc2cccc(c2)O 269982a_100000184577_100000084143 [0,2,0,0,0,0|2,0,0]=4 11814 B18R2.6478 CN(Cc1cccnc1)Cc2cccc(c2)O 269982a_100000207540_100000733263 [0,2,0,0,0,0|2,0,0]=4 11815 B18R2.6478 CN(Cc1cccnc1)Cc2cccc(c2)O 270004a_100000184577_100000188321 [0,2,0,0,0,0|2,0,0]=4 11816 B18R2.6478 CN(Cc1cccnc1)Cc2cccc(c2)O 270004a_100000207540_100000209961 [0,2,0,0,0,0|2,0,0]=4 11817 B18R2.6478 CN(Cc1ccncc1)Cc2cccc(c2)Br 2230a_100000187231_100000698116 [0,2,0,0,0,0|2,0,0]=4 11818 B18R2.6478 CN(Cc1ccncc1)Cc2cccc(c2)Br 2230a_100000187585_100015193705 [0,2,0,0,0,0|2,0,0]=4 11819 B18R2.6478 CN(Cc1ccncc1)Cc2cccc(c2)Br 269982a_100000187231_100000211773 [0,2,0,0,0,0|2,0,0]=4 11820 B18R2.6478 CN(Cc1ccncc1)Cc2cccc(c2)Br 269982a_100000187585_100015193705 [0,2,0,0,0,0|2,0,0]=4 11821 B18R2.6478 CN(Cc1ccncc1)Cc2cccc(c2)Br 26a_100000187231_100000210342 [0,2,0,0,0,0|2,0,0]=4 11822 B18R2.6478 CN(Cc1ccncc1)Cc2cccc(c2)Br 270004a_100000187231_100000210085 [0,2,0,0,0,0|2,0,0]=4 11823 B18R2.6478 CN(Cc1ccncc1)Cc2cccc(c2)Cl 2230a_100000187231_100000181238 [0,2,0,0,0,0|2,0,0]=4 11824 B18R2.6478 CN(Cc1ccncc1)Cc2cccc(c2)Cl 2230a_100020629429_100015193705 [0,2,0,0,0,0|2,0,0]=4 11825 B18R2.6478 CN(Cc1ccncc1)Cc2cccc(c2)Cl 269982a_100000187231_100000181238 [0,2,0,0,0,0|2,0,0]=4 11826 B18R2.6478 CN(Cc1ccncc1)Cc2cccc(c2)Cl 269982a_100020629429_100015193705 [0,2,0,0,0,0|2,0,0]=4 11827 B18R2.6478 CN(Cc1ccncc1)Cc2cccc(c2)Cl 270004a_100000187231_100000210801 [0,2,0,0,0,0|2,0,0]=4 11828 B18R2.6478 CN(Cc1ccncc1)Cc2cccc(c2)F 2230a_100000184398_100015193705 [0,2,0,0,0,0|2,0,0]=4 11829 B18R2.6478 CN(Cc1ccncc1)Cc2cccc(c2)F 2230a_100000187231_100000230114 [0,2,0,0,0,0|2,0,0]=4 11830 B18R2.6478 CN(Cc1ccncc1)Cc2cccc(c2)F 269982a_100000184398_100015193705 [0,2,0,0,0,0|2,0,0]=4 11831 B18R2.6478 CN(Cc1ccncc1)Cc2cccc(c2)F 269982a_100000187231_100000230114 [0,2,0,0,0,0|2,0,0]=4 11832 B18R2.6478 CN(Cc1ccncc1)Cc2cccc(c2)F 270004a_100000187231_100000210812 [0,2,0,0,0,0|2,0,0]=4 11833 B18R2.6478 CN(Cc1ccncc1)Cc2cccc(c2)I 2230a_100000187231_100011218688 [0,2,0,0,0,0|2,0,0]=4 11834 B18R2.6478 CN(Cc1ccncc1)Cc2cccc(c2)I 269982a_100000187231_100011218688 [0,2,0,0,0,0|2,0,0]=4 11835 B18R2.6478 CN(Cc1ccncc1)Cc2cccc(c2)I 270004a_100000187231_100000014684 [0,2,0,0,0,0|2,0,0]=4 11836 B18R2.6478 CN(Cc1ccncc1)Cc2cccc(c2)O 2230a_100000187231_100011660834 [0,2,0,0,0,0|2,0,0]=4 11837 B18R2.6478 CN(Cc1ccncc1)Cc2cccc(c2)O 2230a_100000207540_100015193705 [0,2,0,0,0,0|2,0,0]=4 11838 B18R2.6478 CN(Cc1ccncc1)Cc2cccc(c2)O 269982a_100000187231_100000084143 [0,2,0,0,0,0|2,0,0]=4 11839 B18R2.6478 CN(Cc1ccncc1)Cc2cccc(c2)O 269982a_100000207540_100015193705 [0,2,0,0,0,0|2,0,0]=4 11840 B18R2.6478 CN(Cc1ccncc1)Cc2cccc(c2)O 270004a_100000187231_100000188321 [0,2,0,0,0,0|2,0,0]=4 11841 B18R2.6478 Cc1cc(ccn1)CN(C)Cc2ccccc2 2230a_100000186898_200020672517 [0,2,0,0,0,0|2,0,0]=4 11842 B18R2.6478 Cc1cc(ccn1)CN(C)Cc2ccccc2 269982a_100000186898_200020672517 [0,2,0,0,0,0|2,0,0]=4 11843 B18R2.6478 Cc1cc(ccn1)CN(C)Cc2ccccc2 270004a_100000186898_100011361630 [0,2,0,0,0,0|2,0,0]=4 11844 B18R2.6478 Cc1cccc(c1)CC(=O)C[n+]2ccccc2 1458a_200000086051_100000211840 [0,2,0,0,0,0|2,0,0]=4 11845 B18R2.6478 Cc1cccc(c1)CC(=O)Cc2ccccc2 1458a_100011206899_100015291786 [0,2,0,0,0,0|1,0,0]=3 11846 B18R2.6478 Cc1cccc(c1)CC(=O)Cc2ccccn2 1458a_100000233486_100000211840 [0,2,0,0,0,0|2,0,0]=4 11847 B18R2.6478 Cc1cccc(c1)CC(=O)Cc2ccccn2 1458a_100011206899_100000721315 [0,2,0,0,0,0|2,0,0]=4 11848 B18R2.6478 Cc1cccc(c1)CC(=O)Cc2cccnc2 1458a_100000737805_100000211840 [0,2,0,0,0,0|2,0,0]=4 11849 B18R2.6478 Cc1cccc(c1)CC(=O)Cc2cccnc2 1458a_100011206899_100000733263 [0,2,0,0,0,0|2,0,0]=4 11850 B18R2.6478 Cc1cccc(c1)CC(=O)Cc2ccncc2 1458a_100011206899_100000705612 [0,2,0,0,0,0|2,0,0]=4 11851 B18R2.6478 Cc1cccc(c1)CC(=O)Nc2ccccc2 11a_100000106764_100011206899 [0,2,0,0,0,0|2,0,0]=4 11852 B18R2.6478 Cc1cccc(c1)CC(=O)Nc2ccccc2 1626a_100000106764_100011206899 [0,2,0,0,0,0|2,0,0]=4 11853 B18R2.6478 Cc1cccc(c1)CC(=O)Nc2ccccc2 22a_100000106764_100011206899 [0,2,0,0,0,0|2,0,0]=4 11854 B18R2.6478 Cc1cccc(c1)CC(=O)Nc2ccccc2 527a_100000106764_100011206899 [0,2,0,0,0,0|2,0,0]=4 11855 B18R2.6478 Cc1cccc(c1)CN(C)Cc2ccccc2 2230a_100000186898_100000211840 [0,2,0,0,0,0|1,0,0]=3 11856 B18R2.6478 Cc1cccc(c1)CN(C)Cc2ccccc2 2230a_100015187561_200000210301 [0,2,0,0,0,0|1,0,0]=3 11857 B18R2.6478 Cc1cccc(c1)CN(C)Cc2ccccc2 2230a_102495364743_100015291786 [0,2,0,0,0,0|1,0,0]=3 11858 B18R2.6478 Cc1cccc(c1)CN(C)Cc2ccccc2 269982a_100000186898_100000211840 [0,2,0,0,0,0|1,0,0]=3 11859 B18R2.6478 Cc1cccc(c1)CN(C)Cc2ccccc2 269982a_100015187561_200000210301 [0,2,0,0,0,0|1,0,0]=3 11860 B18R2.6478 Cc1cccc(c1)CN(C)Cc2ccccc2 269982a_102495364743_100000211182 [0,2,0,0,0,0|1,0,0]=3 11861 B18R2.6478 Cc1cccc(c1)CN(C)Cc2ccccc2 270004a_100000186898_100000211157 [0,2,0,0,0,0|1,0,0]=3 11862 B18R2.6478 Cc1cccc(c1)CN(C)Cc2ccccc2 270004a_102495364743_100015611070 [0,2,0,0,0,0|1,0,0]=3 11863 B18R2.6478 Cc1cccc(c1)CN(C)Cc2ccccc2 34a_100015187561_200000210301 [0,2,0,0,0,0|1,0,0]=3 11864 B18R2.6478 Cc1cccc(c1)CN(C)Cc2ccccc2 34a_102495364743_100015291786 [0,2,0,0,0,0|1,0,0]=3 11865 B18R2.6478 Cc1cccc(c1)CN(C)Cc2ccccn2 2230a_100000207498_100000211840 [0,2,0,0,0,0|2,0,0]=4 11866 B18R2.6478 Cc1cccc(c1)CN(C)Cc2ccccn2 2230a_102495364743_100000721315 [0,2,0,0,0,0|2,0,0]=4 11867 B18R2.6478 Cc1cccc(c1)CN(C)Cc2ccccn2 269982a_100000207498_100000211840 [0,2,0,0,0,0|2,0,0]=4 11868 B18R2.6478 Cc1cccc(c1)CN(C)Cc2ccccn2 269982a_102495364743_100000721315 [0,2,0,0,0,0|2,0,0]=4 11869 B18R2.6478 Cc1cccc(c1)CN(C)Cc2ccccn2 270004a_100000207498_100000211157 [0,2,0,0,0,0|2,0,0]=4 11870 B18R2.6478 Cc1cccc(c1)CN(C)Cc2ccccn2 270004a_102495364743_100000209966 [0,2,0,0,0,0|2,0,0]=4 11871 B18R2.6478 Cc1cccc(c1)CN(C)Cc2ccccn2 34a_102495364743_100000721315 [0,2,0,0,0,0|2,0,0]=4 11872 B18R2.6478 Cc1cccc(c1)CN(C)Cc2cccnc2 2230a_100000184577_100000211840 [0,2,0,0,0,0|2,0,0]=4 11873 B18R2.6478 Cc1cccc(c1)CN(C)Cc2cccnc2 2230a_100000266133_200000210301 [0,2,0,0,0,0|2,0,0]=4 11874 B18R2.6478 Cc1cccc(c1)CN(C)Cc2cccnc2 2230a_102495364743_100000741622 [0,2,0,0,0,0|2,0,0]=4 11875 B18R2.6478 Cc1cccc(c1)CN(C)Cc2cccnc2 269982a_100000184577_100000211840 [0,2,0,0,0,0|2,0,0]=4 11876 B18R2.6478 Cc1cccc(c1)CN(C)Cc2cccnc2 269982a_100000266133_200000210301 [0,2,0,0,0,0|2,0,0]=4 11877 B18R2.6478 Cc1cccc(c1)CN(C)Cc2cccnc2 269982a_102495364743_100000733263 [0,2,0,0,0,0|2,0,0]=4 11878 B18R2.6478 Cc1cccc(c1)CN(C)Cc2cccnc2 270004a_100000184577_100000211157 [0,2,0,0,0,0|2,0,0]=4 11879 B18R2.6478 Cc1cccc(c1)CN(C)Cc2cccnc2 270004a_102495364743_100000209961 [0,2,0,0,0,0|2,0,0]=4 11880 B18R2.6478 Cc1cccc(c1)CN(C)Cc2cccnc2 34a_102495364743_100000733263 [0,2,0,0,0,0|2,0,0]=4 11881 B18R2.6478 Cc1cccc(c1)CN(C)Cc2ccncc2 2230a_100000187231_100000211840 [0,2,0,0,0,0|2,0,0]=4 11882 B18R2.6478 Cc1cccc(c1)CN(C)Cc2ccncc2 2230a_102495364743_100015193705 [0,2,0,0,0,0|2,0,0]=4 11883 B18R2.6478 Cc1cccc(c1)CN(C)Cc2ccncc2 269982a_100000187231_100000211840 [0,2,0,0,0,0|2,0,0]=4 11884 B18R2.6478 Cc1cccc(c1)CN(C)Cc2ccncc2 269982a_102495364743_100015193705 [0,2,0,0,0,0|2,0,0]=4 11885 B18R2.6478 Cc1cccc(c1)CN(C)Cc2ccncc2 270004a_100000187231_100000211157 [0,2,0,0,0,0|2,0,0]=4 11886 B18R2.6478 Cc1cccc(c1)CN([13CH3])Cc2ccccc2 2230a_100015187561_200025704644 [0,2,0,0,0,0|1,0,0]=3 11887 B18R2.6478 Cc1cccc(c1)CN([13CH3])Cc2ccccc2 269982a_100015187561_200025704644 [0,2,0,0,0,0|1,0,0]=3 11888 B18R2.6478 Cc1cccc(c1)CN([13CH3])Cc2ccccc2 34a_100015187561_200025704644 [0,2,0,0,0,0|1,0,0]=3 11889 B18R2.6478 Cc1cccc(c1)CN([13CH3])Cc2cccnc2 2230a_100000266133_200025704644 [0,2,0,0,0,0|2,0,0]=4 11890 B18R2.6478 Cc1cccc(c1)CN([13CH3])Cc2cccnc2 269982a_100000266133_200025704644 [0,2,0,0,0,0|2,0,0]=4 11891 B18R2.6478 Cc1cccc(c1)NC(C)Cc2ccccc2 34a_100000188690_200011218536 [0,2,0,0,0,0|2,0,0]=4 11892 B18R2.6478 Cc1cccc(c1)OC(C)Cc2ccccc2 34a_100000210337_200011218536 [0,2,0,0,0,0|2,0,0]=4 11893 B18R2.6478 Cc1cccc(c1)OC(C)Cc2ccccc2 7a_100000210337_200011218536 [0,2,0,0,0,0|2,0,0]=4 11894 B18R2.6478 Cc1cccc(c1)SC(C)Cc2ccccc2 62a_100011215228_200011218536 [0,2,0,0,0,0|2,0,0]=4 11895 B18R2.6478 Cc1cccc(c1)SC(C)Cc2ccccc2 62a_200011218536_100011215228 [0,2,0,0,0,0|2,0,0]=4 11896 B18R2.6478 Cc1cccc(n1)CC(=O)Cc2ccccc2 1458a_100012001110_100015291786 [0,2,0,0,0,0|2,0,0]=4 11897 B18R2.6478 Cc1cccc(n1)CN(C)Cc2ccccc2 2230a_100000186898_100000757606 [0,2,0,0,0,0|2,0,0]=4 11898 B18R2.6478 Cc1cccc(n1)CN(C)Cc2ccccc2 2230a_100000687132_100015291786 [0,2,0,0,0,0|2,0,0]=4 11899 B18R2.6478 Cc1cccc(n1)CN(C)Cc2ccccc2 2230a_100000687153_200000210301 [0,2,0,0,0,0|2,0,0]=4 11900 B18R2.6478 Cc1cccc(n1)CN(C)Cc2ccccc2 269982a_100000186898_100000757606 [0,2,0,0,0,0|2,0,0]=4 11901 B18R2.6478 Cc1cccc(n1)CN(C)Cc2ccccc2 269982a_100000687132_100000211182 [0,2,0,0,0,0|2,0,0]=4 11902 B18R2.6478 Cc1cccc(n1)CN(C)Cc2ccccc2 269982a_100000687153_200000210301 [0,2,0,0,0,0|2,0,0]=4 11903 B18R2.6478 Cc1cccc(n1)CN(C)Cc2ccccc2 270004a_100000186898_100011215050 [0,2,0,0,0,0|2,0,0]=4 11904 B18R2.6478 Cc1cccc(n1)CN(C)Cc2ccccc2 270004a_100000687132_100015611070 [0,2,0,0,0,0|2,0,0]=4 11905 B18R2.6478 Cc1cccc(n1)CN([13CH3])Cc2ccccc2 2230a_100000687153_200025704644 [0,2,0,0,0,0|2,0,0]=4 11906 B18R2.6478 Cc1cccc(n1)CN([13CH3])Cc2ccccc2 269982a_100000687153_200025704644 [0,2,0,0,0,0|2,0,0]=4 11907 B18R2.6478 Cc1ccnc(c1)CN(C)Cc2ccccc2 2230a_100000186898_100000718516 [0,2,0,0,0,0|2,0,0]=4 11908 B18R2.6478 Cc1ccnc(c1)CN(C)Cc2ccccc2 2230a_106354213154_100015291786 [0,2,0,0,0,0|2,0,0]=4 11909 B18R2.6478 Cc1ccnc(c1)CN(C)Cc2ccccc2 269982a_100000186898_100000718516 [0,2,0,0,0,0|2,0,0]=4 11910 B18R2.6478 Cc1ccnc(c1)CN(C)Cc2ccccc2 269982a_106354213154_100000211182 [0,2,0,0,0,0|2,0,0]=4 11911 B18R2.6478 Cc1ccnc(c1)CN(C)Cc2ccccc2 270004a_100000186898_100011361488 [0,2,0,0,0,0|2,0,0]=4 11912 B18R2.6478 Cc1ccnc(c1)CN(C)Cc2ccccc2 270004a_106354213154_100015611070 [0,2,0,0,0,0|2,0,0]=4 11913 B18R2.6478 Cc1cncc(c1)CN(C)Cc2ccccc2 2230a_100000186898_100000716715 [0,2,0,0,0,0|2,0,0]=4 11914 B18R2.6478 Cc1cncc(c1)CN(C)Cc2ccccc2 269982a_100000186898_100000716715 [0,2,0,0,0,0|2,0,0]=4 11915 B18R2.6478 Cc1cncc(c1)CN(C)Cc2ccccc2 270004a_100000186898_100011998712 [0,2,0,0,0,0|2,0,0]=4 11916 B18R2.6478 O=C(Cc1cccc(c1)Br)C[n+]2ccccc2 1458a_200000086051_100000211773 [0,2,0,0,0,0|2,0,0]=4 11917 B18R2.6478 O=C(Cc1cccc(c1)Br)Cc2ccccn2 1458a_100000233486_100000211773 [0,2,0,0,0,0|2,0,0]=4 11918 B18R2.6478 O=C(Cc1cccc(c1)Br)Cc2ccccn2 1458a_100000747190_100000721315 [0,2,0,0,0,0|2,0,0]=4 11919 B18R2.6478 O=C(Cc1cccc(c1)Br)Nc2ccccc2 11a_100000106764_100000747190 [0,2,0,0,0,0|2,0,0]=4 11920 B18R2.6478 O=C(Cc1cccc(c1)Br)Nc2ccccc2 22a_100000106764_100000747190 [0,2,0,0,0,0|2,0,0]=4 11921 B18R2.6478 O=C(Cc1cccc(c1)Br)Nc2ccccc2 527a_100000106764_100000747190 [0,2,0,0,0,0|2,0,0]=4 11922 B18R2.6478 O=C(Cc1cccc(c1)Cl)C[n+]2ccccc2 1458a_200000086051_100000181238 [0,2,0,0,0,0|2,0,0]=4 11923 B18R2.6478 O=C(Cc1cccc(c1)Cl)Cc2ccccn2 1458a_100000233486_100000181238 [0,2,0,0,0,0|2,0,0]=4 11924 B18R2.6478 O=C(Cc1cccc(c1)Cl)Cc2ccccn2 1458a_100000749307_100000721315 [0,2,0,0,0,0|2,0,0]=4 11925 B18R2.6478 O=C(Cc1cccc(c1)Cl)Nc2ccccc2 11a_100000106764_100000749307 [0,2,0,0,0,0|2,0,0]=4 11926 B18R2.6478 O=C(Cc1cccc(c1)Cl)Nc2ccccc2 1626a_100000106764_100000749307 [0,2,0,0,0,0|2,0,0]=4 11927 B18R2.6478 O=C(Cc1cccc(c1)Cl)Nc2ccccc2 22a_100000106764_100000749307 [0,2,0,0,0,0|2,0,0]=4 11928 B18R2.6478 O=C(Cc1cccc(c1)Cl)Nc2ccccc2 527a_100000106764_100000749307 [0,2,0,0,0,0|2,0,0]=4 11929 B18R2.6478 O=C(Cc1cccc(c1)F)C[n+]2ccccc2 1458a_200000086051_100000230114 [0,2,0,0,0,0|2,0,0]=4 11930 B18R2.6478 O=C(Cc1cccc(c1)F)Cc2ccccn2 1458a_100000211661_100000721315 [0,2,0,0,0,0|2,0,0]=4 11931 B18R2.6478 O=C(Cc1cccc(c1)F)Cc2ccccn2 1458a_100000233486_100000230114 [0,2,0,0,0,0|2,0,0]=4 11932 B18R2.6478 O=C(Cc1cccc(c1)F)Nc2ccccc2 11a_100000106764_100000211661 [0,2,0,0,0,0|2,0,0]=4 11933 B18R2.6478 O=C(Cc1cccc(c1)F)Nc2ccccc2 1626a_100000106764_100000211661 [0,2,0,0,0,0|2,0,0]=4 11934 B18R2.6478 O=C(Cc1cccc(c1)F)Nc2ccccc2 22a_100000106764_100000211661 [0,2,0,0,0,0|2,0,0]=4 11935 B18R2.6478 O=C(Cc1cccc(c1)F)Nc2ccccc2 527a_100000106764_100000211661 [0,2,0,0,0,0|2,0,0]=4 11936 B18R2.6478 O=C(Cc1cccc(c1)I)C[n+]2ccccc2 1458a_200000086051_100011218688 [0,2,0,0,0,0|2,0,0]=4 11937 B18R2.6478 O=C(Cc1cccc(c1)I)Cc2ccccn2 1458a_100000233486_100011218688 [0,2,0,0,0,0|2,0,0]=4 11938 B18R2.6478 O=C(Cc1cccc(c1)I)Cc2ccccn2 1458a_100000238430_100000721315 [0,2,0,0,0,0|2,0,0]=4 11939 B18R2.6478 O=C(Cc1cccc(c1)I)Nc2ccccc2 11a_100000106764_100000238430 [0,2,0,0,0,0|2,0,0]=4 11940 B18R2.6478 O=C(Cc1cccc(c1)I)Nc2ccccc2 1626a_100000106764_100000238430 [0,2,0,0,0,0|2,0,0]=4 11941 B18R2.6478 O=C(Cc1cccc(c1)I)Nc2ccccc2 22a_100000106764_100000238430 [0,2,0,0,0,0|2,0,0]=4 11942 B18R2.6478 O=C(Cc1cccc(c1)I)Nc2ccccc2 527a_100000106764_100000238430 [0,2,0,0,0,0|2,0,0]=4 11943 B18R2.6478 O=C(Cc1cccc(c1)O)C[n+]2ccccc2 1458a_200000086051_100011660834 [0,2,0,0,0,0|2,0,0]=4 11944 B18R2.6478 O=C(Cc1cccc(c1)O)Cc2ccccn2 1458a_100000233486_100011660834 [0,2,0,0,0,0|2,0,0]=4 11945 B18R2.6478 O=C(Cc1cccc(c1)O)Cc2ccccn2 1458a_100000745134_100000721315 [0,2,0,0,0,0|2,0,0]=4 11946 B18R2.6478 O=C(Cc1cccc(c1)O)Nc2ccccc2 22a_100000106764_100000745134 [0,2,0,0,0,0|2,0,0]=4 11947 B18R2.6478 O=C(Cc1cccc(c1)O)Nc2ccccc2 527a_100000106764_100000745134 [0,2,0,0,0,0|2,0,0]=4 11948 B18R2.6478 O=C(Cc1ccccc1)Cc2cccc(c2)Br 1458a_100000747190_100015291786 [0,2,0,0,0,0|1,0,0]=3 11949 B18R2.6478 O=C(Cc1ccccc1)Cc2cccc(c2)Cl 1458a_100000749307_100015291786 [0,2,0,0,0,0|1,0,0]=3 11950 B18R2.6478 O=C(Cc1ccccc1)Cc2cccc(c2)F 1458a_100000211661_100015291786 [0,2,0,0,0,0|1,0,0]=3 11951 B18R2.6478 O=C(Cc1ccccc1)Cc2cccc(c2)I 1458a_100000238430_100015291786 [0,2,0,0,0,0|1,0,0]=3 11952 B18R2.6478 O=C(Cc1ccccc1)Cc2cccc(c2)O 1458a_100000745134_100015291786 [0,2,0,0,0,0|1,0,0]=3 11953 B18R2.6478 O=C(Cc1ccccc1)Cc2cccc(n2)Br 1458a_100010201708_100015291786 [0,2,0,0,0,0|2,0,0]=4 11954 B18R2.6478 O=C(Cc1ccccc1)Cc2cccc(n2)Cl 1458a_100000090259_100015291786 [0,2,0,0,0,0|2,0,0]=4 11955 B18R2.6478 O=C(Cc1ccccc1)Cc2cccc(n2)F 1458a_100000096803_100015291786 [0,2,0,0,0,0|2,0,0]=4 11956 B18R2.6478 O=C(Cc1ccccc1)Cc2ccnc(c2)Br 1458a_100010126891_100015291786 [0,2,0,0,0,0|2,0,0]=4 11957 B18R2.6478 O=C(Cc1ccccc1)Cc2cncc(c2)Br 1458a_100000239331_100015291786 [0,2,0,0,0,0|2,0,0]=4 11958 B18R2.6478 O=C(Cc1ccccc1)Cc2cncc(c2)F 1458a_100011667516_100015291786 [0,2,0,0,0,0|2,0,0]=4 11959 B18R2.6478 O=C(Cc1cccnc1)Cc2cccc(c2)Br 1458a_100000737805_100000211773 [0,2,0,0,0,0|2,0,0]=4 11960 B18R2.6478 O=C(Cc1cccnc1)Cc2cccc(c2)Br 1458a_100000747190_100000733263 [0,2,0,0,0,0|2,0,0]=4 11961 B18R2.6478 O=C(Cc1cccnc1)Cc2cccc(c2)Cl 1458a_100000737805_100000181238 [0,2,0,0,0,0|2,0,0]=4 11962 B18R2.6478 O=C(Cc1cccnc1)Cc2cccc(c2)Cl 1458a_100000749307_100000733263 [0,2,0,0,0,0|2,0,0]=4 11963 B18R2.6478 O=C(Cc1cccnc1)Cc2cccc(c2)F 1458a_100000211661_100000733263 [0,2,0,0,0,0|2,0,0]=4 11964 B18R2.6478 O=C(Cc1cccnc1)Cc2cccc(c2)F 1458a_100000737805_100000230114 [0,2,0,0,0,0|2,0,0]=4 11965 B18R2.6478 O=C(Cc1cccnc1)Cc2cccc(c2)I 1458a_100000238430_100000733263 [0,2,0,0,0,0|2,0,0]=4 11966 B18R2.6478 O=C(Cc1cccnc1)Cc2cccc(c2)I 1458a_100000737805_100011218688 [0,2,0,0,0,0|2,0,0]=4 11967 B18R2.6478 O=C(Cc1cccnc1)Cc2cccc(c2)O 1458a_100000737805_100011660834 [0,2,0,0,0,0|2,0,0]=4 11968 B18R2.6478 O=C(Cc1cccnc1)Cc2cccc(c2)O 1458a_100000745134_100000733263 [0,2,0,0,0,0|2,0,0]=4 11969 B18R2.6478 O=C(Cc1ccncc1)Cc2cccc(c2)Br 1458a_100000747190_100000705612 [0,2,0,0,0,0|2,0,0]=4 11970 B18R2.6478 O=C(Cc1ccncc1)Cc2cccc(c2)Cl 1458a_100000749307_100000705612 [0,2,0,0,0,0|2,0,0]=4 11971 B18R2.6478 O=C(Cc1ccncc1)Cc2cccc(c2)F 1458a_100000211661_100000705612 [0,2,0,0,0,0|2,0,0]=4 11972 B18R2.6478 O=C(Cc1ccncc1)Cc2cccc(c2)I 1458a_100000238430_100000705612 [0,2,0,0,0,0|2,0,0]=4 11973 B18R2.6478 O=C(Cc1ccncc1)Cc2cccc(c2)O 1458a_100000745134_100000705612 [0,2,0,0,0,0|2,0,0]=4 11974 B18R2.7204 C=C(C(=O)Cc1ccccc1)c2ccccc2 1458a_100000065200_100015291786 [0,2,0,0,0,0|1,0,1]=4 11975 B18R2.7204 CC(C(=O)C[n+]1ccccc1)c2ccccc2 1458a_200000086051_100000230085 [0,2,0,0,0,0|2,0,0]=4 11976 B18R2.7204 CC(C(=O)Cc1ccccc1)c2ccccn2 1458a_100000722050_100015291786 [0,2,0,0,0,0|2,0,0]=4 11977 B18R2.7204 CC(C(=O)Cc1ccccn1)c2ccccc2 1458a_100000233486_100000230085 [0,2,0,0,0,0|2,0,0]=4 11978 B18R2.7204 CC(C(=O)Cc1cccnc1)c2ccccc2 1458a_100000737805_100000230085 [0,2,0,0,0,0|2,0,0]=4 11979 B18R2.7204 CC(Cc1ccccc1)C(=O)c2ccccc2 1458a_100000185807_200011218536 [0,2,0,0,0,0|1,0,1]=4 11980 B18R2.7204 CC(Cc1ccccc1)N(C)c2ccccc2 269982a_100000210012_200011218536 [0,2,0,0,0,0|2,0,0]=4 11981 B18R2.7204 CC(Cc1ccccc1)N(C)c2ccccc2 34a_100000210012_200011218536 [0,2,0,0,0,0|2,0,0]=4 11982 B18R2.7204 CC(c1ccccc1)N(C)Cc2ccccc2 2230a_100000186898_100000230085 [0,2,0,0,0,0|1,0,0]=3 11983 B18R2.7204 CC(c1ccccc1)N(C)Cc2ccccc2 2230a_100000195388_100015291786 [0,2,0,0,0,0|1,0,0]=3 11984 B18R2.7204 CC(c1ccccc1)N(C)Cc2ccccc2 269982a_100000186898_100000230085 [0,2,0,0,0,0|1,0,0]=3 11985 B18R2.7204 CC(c1ccccc1)N(C)Cc2ccccc2 269982a_100000195388_100000211182 [0,2,0,0,0,0|1,0,0]=3 11986 B18R2.7204 CC(c1ccccc1)N(C)Cc2ccccc2 270004a_100000195388_100015611070 [0,2,0,0,0,0|1,0,0]=3 11987 B18R2.7204 CC(c1ccccc1)N(C)Cc2ccccn2 2230a_100000195388_100000721315 [0,2,0,0,0,0|2,0,0]=4 11988 B18R2.7204 CC(c1ccccc1)N(C)Cc2ccccn2 2230a_100000207498_100000230085 [0,2,0,0,0,0|2,0,0]=4 11989 B18R2.7204 CC(c1ccccc1)N(C)Cc2ccccn2 269982a_100000195388_100000721315 [0,2,0,0,0,0|2,0,0]=4 11990 B18R2.7204 CC(c1ccccc1)N(C)Cc2ccccn2 269982a_100000207498_100000230085 [0,2,0,0,0,0|2,0,0]=4 11991 B18R2.7204 CC(c1ccccc1)N(C)Cc2ccccn2 270004a_100000195388_100000209966 [0,2,0,0,0,0|2,0,0]=4 11992 B18R2.7204 CC(c1ccccc1)N(C)Cc2cccnc2 2230a_100000184577_100000230085 [0,2,0,0,0,0|2,0,0]=4 11993 B18R2.7204 CC(c1ccccc1)N(C)Cc2cccnc2 2230a_100000195388_100000741622 [0,2,0,0,0,0|2,0,0]=4 11994 B18R2.7204 CC(c1ccccc1)N(C)Cc2cccnc2 2230a_200000261734_200000210301 [0,2,0,0,0,0|2,0,0]=4 11995 B18R2.7204 CC(c1ccccc1)N(C)Cc2cccnc2 269982a_100000184577_100000230085 [0,2,0,0,0,0|2,0,0]=4 11996 B18R2.7204 CC(c1ccccc1)N(C)Cc2cccnc2 269982a_100000195388_100000733263 [0,2,0,0,0,0|2,0,0]=4 11997 B18R2.7204 CC(c1ccccc1)N(C)Cc2cccnc2 269982a_200000261734_200000210301 [0,2,0,0,0,0|2,0,0]=4 11998 B18R2.7204 CC(c1ccccc1)N(C)Cc2cccnc2 270004a_100000195388_100000209961 [0,2,0,0,0,0|2,0,0]=4 11999 B18R2.7204 CC(c1ccccc1)N(C)Cc2ccncc2 2230a_100000187231_100000230085 [0,2,0,0,0,0|2,0,0]=4 12000 B18R2.7204 CC(c1ccccc1)N(C)Cc2ccncc2 2230a_100000195388_100015193705 [0,2,0,0,0,0|2,0,0]=4 12001 B18R2.7204 CC(c1ccccc1)N(C)Cc2ccncc2 269982a_100000187231_100000230085 [0,2,0,0,0,0|2,0,0]=4 12002 B18R2.7204 CC(c1ccccc1)N(C)Cc2ccncc2 269982a_100000195388_100015193705 [0,2,0,0,0,0|2,0,0]=4 12003 B18R2.7204 CC(c1ccccc1)N(C)Cc2ccncc2 269982a_100000261733_200000210301 [0,2,0,0,0,0|2,0,0]=4 12004 B18R2.7204 CC(c1ccccc1)N([13CH3])Cc2cccnc2 2230a_200000261734_200025704644 [0,2,0,0,0,0|2,0,0]=4 12005 B18R2.7204 CC(c1ccccc1)N([13CH3])Cc2cccnc2 269982a_200000261734_200025704644 [0,2,0,0,0,0|2,0,0]=4 12006 B18R2.7204 CC(c1ccccc1)N([13CH3])Cc2ccncc2 269982a_100000261733_200025704644 [0,2,0,0,0,0|2,0,0]=4 12007 B18R2.7204 CC(c1ccccn1)N(C)Cc2ccccc2 2230a_100000197025_200000210301 [0,2,0,0,0,0|2,0,0]=4 12008 B18R2.7204 CC(c1ccccn1)N(C)Cc2ccccc2 2230a_100000231138_100015291786 [0,2,0,0,0,0|2,0,0]=4 12009 B18R2.7204 CC(c1ccccn1)N(C)Cc2ccccc2 269982a_100000197025_200000210301 [0,2,0,0,0,0|2,0,0]=4 12010 B18R2.7204 CC(c1ccccn1)N(C)Cc2ccccc2 269982a_100000231138_100000211182 [0,2,0,0,0,0|2,0,0]=4 12011 B18R2.7204 CC(c1ccccn1)N(C)Cc2ccccc2 270004a_100000231138_100015611070 [0,2,0,0,0,0|2,0,0]=4 12012 B18R2.7204 CC(c1ccccn1)N([13CH3])Cc2ccccc2 2230a_100000197025_200025704644 [0,2,0,0,0,0|2,0,0]=4 12013 B18R2.7204 CC(c1ccccn1)N([13CH3])Cc2ccccc2 269982a_100000197025_200025704644 [0,2,0,0,0,0|2,0,0]=4 12014 B18R2.7204 CC(c1cccnc1)N(C)Cc2ccccc2 2230a_100000232774_100015291786 [0,2,0,0,0,0|2,0,0]=4 12015 B18R2.7204 CC(c1cccnc1)N(C)Cc2ccccc2 269982a_100000232774_100000211182 [0,2,0,0,0,0|2,0,0]=4 12016 B18R2.7204 CC(c1cccnc1)N(C)Cc2ccccc2 270004a_100000232774_100015611070 [0,2,0,0,0,0|2,0,0]=4 12017 B18R2.7204 CC(c1ccncc1)N(C)Cc2ccccc2 2230a_100000231139_100015291786 [0,2,0,0,0,0|2,0,0]=4 12018 B18R2.7204 CC(c1ccncc1)N(C)Cc2ccccc2 269982a_100000231139_100000211182 [0,2,0,0,0,0|2,0,0]=4 12019 B18R2.7204 CC(c1ccncc1)N(C)Cc2ccccc2 270004a_100000231139_100015611070 [0,2,0,0,0,0|2,0,0]=4 12020 B18R2.7204 CN(Cc1ccccc1)C(=O)c2ccccc2 11a_100000186898_100000185807 [0,2,0,0,0,0|1,0,1]=4 12021 B18R2.7204 CN(Cc1ccccc1)C(=O)c2ccccc2 1626a_100000186898_100000185807 [0,2,0,0,0,0|1,0,1]=4 12022 B18R2.7204 CN(Cc1ccccc1)C(=O)c2ccccc2 240690a_100000186898_100000185807 [0,2,0,0,0,0|1,0,1]=4 12023 B18R2.7204 CN(Cc1ccccc1)C(=O)c2ccccc2 527a_100000186898_100000185807 [0,2,0,0,0,0|1,0,1]=4 12024 B18R2.7204 C[C@H](C(=O)Cc1ccccc1)c2ccccc2 1458a_100000751047_100015291786 [0,2,0,0,0,0|1,0,0]=3 12025 B18R2.7204 C[C@H](C(=O)Cc1ccccn1)c2ccccc2 1458a_100000751047_100000721315 [0,2,0,0,0,0|2,0,0]=4 12026 B18R2.7204 C[C@H](C(=O)Cc1cccnc1)c2ccccc2 1458a_100000751047_100000733263 [0,2,0,0,0,0|2,0,0]=4 12027 B18R2.7204 C[C@H](C(=O)Cc1ccncc1)c2ccccc2 1458a_100000751047_100000705612 [0,2,0,0,0,0|2,0,0]=4 12028 B18R2.7204 C[C@H](C(=O)Nc1ccccc1)c2ccccc2 11a_100000106764_100000751047 [0,2,0,0,0,0|2,0,0]=4 12029 B18R2.7204 C[C@H](C(=O)Nc1ccccc1)c2ccccc2 1626a_100000106764_100000751047 [0,2,0,0,0,0|2,0,0]=4 12030 B18R2.7204 C[C@H](C(=O)Nc1ccccc1)c2ccccc2 22a_100000106764_100000751047 [0,2,0,0,0,0|2,0,0]=4 12031 B18R2.7204 C[C@H](C(=O)Nc1ccccc1)c2ccccc2 527a_100000106764_100000751047 [0,2,0,0,0,0|2,0,0]=4 12032 B18R2.7204 C[C@H](c1ccccc1)N(C)Cc2ccccc2 2230a_100011827659_200000210301 [0,2,0,0,0,0|1,0,0]=3 12033 B18R2.7204 C[C@H](c1ccccc1)N(C)Cc2ccccc2 269982a_100011827659_200000210301 [0,2,0,0,0,0|1,0,0]=3 12034 B18R2.7204 C[C@H](c1ccccc1)N([13CH3])Cc2ccccc2 2230a_100011827659_200025704644 [0,2,0,0,0,0|1,0,0]=3 12035 B18R2.7204 C[C@H](c1ccccc1)N([13CH3])Cc2ccccc2 269982a_100011827659_200025704644 [0,2,0,0,0,0|1,0,0]=3 12036 B18R2.7204 O=C(Cc1ccccc1)C(F)c2ccccc2 1458a_100000698975_100015291786 [0,2,0,0,0,0|1,0,0]=3 12037 B18R2.7204 O=C(Cc1ccccc1)[C@H](O)c2ccccc2 1458a_100000684486_100015291786 [0,2,0,0,0,0|1,0,0]=3 12038 B18R2.7204 O=C(Cc1ccccn1)C(F)c2ccccc2 1458a_100000698975_100000721315 [0,2,0,0,0,0|2,0,0]=4 12039 B18R2.7204 O=C(Cc1ccccn1)[C@H](O)c2ccccc2 1458a_100000684486_100000721315 [0,2,0,0,0,0|2,0,0]=4 12040 B18R2.7204 O=C(Cc1cccnc1)C(F)c2ccccc2 1458a_100000698975_100000733263 [0,2,0,0,0,0|2,0,0]=4 12041 B18R2.7204 O=C(Cc1cccnc1)[C@H](O)c2ccccc2 1458a_100000684486_100000733263 [0,2,0,0,0,0|2,0,0]=4 12042 B18R2.7204 O=C(Cc1ccncc1)C(F)c2ccccc2 1458a_100000698975_100000705612 [0,2,0,0,0,0|2,0,0]=4 12043 B18R2.7204 O=C(Cc1ccncc1)[C@H](O)c2ccccc2 1458a_100000684486_100000705612 [0,2,0,0,0,0|2,0,0]=4 12044 B18R2.7204 O=C(Nc1ccccc1)C(F)c2ccccc2 11a_100000106764_100000698975 [0,2,0,0,0,0|2,0,0]=4 12045 B18R2.7204 O=C(Nc1ccccc1)C(F)c2ccccc2 1626a_100000106764_100000698975 [0,2,0,0,0,0|2,0,0]=4 12046 B18R2.7204 O=C(Nc1ccccc1)C(F)c2ccccc2 22a_100000106764_100000698975 [0,2,0,0,0,0|2,0,0]=4 12047 B18R2.7204 O=C(Nc1ccccc1)C(F)c2ccccc2 527a_100000106764_100000698975 [0,2,0,0,0,0|2,0,0]=4 12048 B18R2.7204 O=C(Nc1ccccc1)[C@H](O)c2ccccc2 22a_100000106764_100000684486 [0,2,0,0,0,0|2,0,0]=4 12049 B18R2.32233 O=S(=O)(Cc1ccccc1)Nc2ccccc2 232682a_100000106764_100000211737 [0,2,0,0,0,0|1,1,0]=4 12050 B18R2.61 BrCc1ccc(cc1)COCc2ccccc2 34a_100012353999_100015291786 [0,2,0,0,0,0|0,0,0]=2 12051 B18R2.61 BrCc1ccc(cc1)COCc2ccccc2 7a_100012353999_100000211182 [0,2,0,0,0,0|0,0,0]=2 12052 B18R2.61 BrCc1ccc(cc1)COCc2ccccn2 34a_100012353999_100000721315 [0,2,0,0,0,0|1,0,0]=3 12053 B18R2.61 BrCc1ccc(cc1)COCc2ccccn2 7a_100012353999_100000721315 [0,2,0,0,0,0|1,0,0]=3 12054 B18R2.61 BrCc1ccc(cc1)COCc2cccnc2 34a_100012353999_100000733263 [0,2,0,0,0,0|1,0,0]=3 12055 B18R2.61 BrCc1ccc(cc1)COCc2cccnc2 7a_100012353999_100000741622 [0,2,0,0,0,0|1,0,0]=3 12056 B18R2.61 BrCc1ccc(cc1)COCc2cccnn2 34a_100012353999_100016990269 [0,2,0,0,0,0|2,0,0]=4 12057 B18R2.61 BrCc1ccc(cc1)COCc2cccnn2 7a_100012353999_100016990269 [0,2,0,0,0,0|2,0,0]=4 12058 B18R2.61 BrCc1ccc(cc1)COCc2ccncc2 7a_100012353999_100015193705 [0,2,0,0,0,0|1,0,0]=3 12059 B18R2.61 BrCc1ccc(cc1)COCc2cnccn2 34a_100012353999_100016995436 [0,2,0,0,0,0|2,0,0]=4 12060 B18R2.61 BrCc1ccc(cc1)COCc2cnccn2 7a_100012353999_100016995436 [0,2,0,0,0,0|2,0,0]=4 12061 B18R2.61 BrCc1ccc(cc1)COCc2cncnc2 34a_100012353999_100015196519 [0,2,0,0,0,0|2,0,0]=4 12062 B18R2.61 BrCc1ccc(cc1)COCc2cncnc2 7a_100012353999_100015196519 [0,2,0,0,0,0|2,0,0]=4 12063 B18R2.61 BrCc1ccc(cc1)COCc2ncccn2 34a_100012353999_100000703007 [0,2,0,0,0,0|2,0,0]=4 12064 B18R2.61 BrCc1ccc(cc1)COCc2ncccn2 7a_100012353999_100000703007 [0,2,0,0,0,0|2,0,0]=4 12065 B18R2.61 C#Cc1ccc(cc1)CNCc2ccccc2 207a_100015199678_100015611070 [0,2,0,0,0,0|1,0,0]=3 12066 B18R2.61 C#Cc1ccc(cc1)CNCc2ccccc2 207a_100015324214_100011361452 [0,2,0,0,0,0|1,0,0]=3 12067 B18R2.61 C#Cc1ccc(cc1)CNCc2ccccc2 2230a_100015199678_100015291786 [0,2,0,0,0,0|1,0,0]=3 12068 B18R2.61 C#Cc1ccc(cc1)CNCc2ccccc2 2230a_100015324214_100000140223 [0,2,0,0,0,0|1,0,0]=3 12069 B18R2.61 C#Cc1ccc(cc1)CNCc2ccccc2 270004a_100015199678_100015611070 [0,2,0,0,0,0|1,0,0]=3 12070 B18R2.61 C#Cc1ccc(cc1)CNCc2ccccc2 270004a_100015324214_100011361452 [0,2,0,0,0,0|1,0,0]=3 12071 B18R2.61 C#Cc1ccc(cc1)CNCc2ccccc2 34a_100015199678_100015291786 [0,2,0,0,0,0|1,0,0]=3 12072 B18R2.61 C#Cc1ccc(cc1)CNCc2ccccc2 34a_100015324214_100000140223 [0,2,0,0,0,0|1,0,0]=3 12073 B18R2.61 C#Cc1ccc(cc1)CNCc2ccccn2 207a_100015199678_100000209966 [0,2,0,0,0,0|2,0,0]=4 12074 B18R2.61 C#Cc1ccc(cc1)CNCc2ccccn2 2230a_100015199678_100000721315 [0,2,0,0,0,0|2,0,0]=4 12075 B18R2.61 C#Cc1ccc(cc1)CNCc2ccccn2 270004a_100000210449_100011361452 [0,2,0,0,0,0|2,0,0]=4 12076 B18R2.61 C#Cc1ccc(cc1)CNCc2ccccn2 270004a_100015199678_100000209966 [0,2,0,0,0,0|2,0,0]=4 12077 B18R2.61 C#Cc1ccc(cc1)CNCc2ccccn2 34a_100015199678_100000721315 [0,2,0,0,0,0|2,0,0]=4 12078 B18R2.61 C#Cc1ccc(cc1)CNCc2cccnc2 207a_100000210453_100011361452 [0,2,0,0,0,0|2,0,0]=4 12079 B18R2.61 C#Cc1ccc(cc1)CNCc2cccnc2 207a_100015199678_100000209961 [0,2,0,0,0,0|2,0,0]=4 12080 B18R2.61 C#Cc1ccc(cc1)CNCc2cccnc2 2230a_100015199678_100000741622 [0,2,0,0,0,0|2,0,0]=4 12081 B18R2.61 C#Cc1ccc(cc1)CNCc2cccnc2 270004a_100000210453_100011361452 [0,2,0,0,0,0|2,0,0]=4 12082 B18R2.61 C#Cc1ccc(cc1)CNCc2cccnc2 270004a_100015199678_100000209961 [0,2,0,0,0,0|2,0,0]=4 12083 B18R2.61 C#Cc1ccc(cc1)CNCc2cccnc2 34a_100015199678_100000733263 [0,2,0,0,0,0|2,0,0]=4 12084 B18R2.61 C#Cc1ccc(cc1)CNCc2ccncc2 207a_100015199678_100000186114 [0,2,0,0,0,0|2,0,0]=4 12085 B18R2.61 C#Cc1ccc(cc1)CNCc2ccncc2 2230a_100015199678_100015193705 [0,2,0,0,0,0|2,0,0]=4 12086 B18R2.61 C#Cc1ccc(cc1)COCc2ccccc2 34a_100000054647_100015291786 [0,2,0,0,0,0|0,0,0]=2 12087 B18R2.61 C#Cc1ccc(cc1)COCc2ccccc2 34a_100000210790_100000140223 [0,2,0,0,0,0|0,0,0]=2 12088 B18R2.61 C#Cc1ccc(cc1)COCc2ccccc2 7a_100000054647_100000211182 [0,2,0,0,0,0|0,0,0]=2 12089 B18R2.61 C#Cc1ccc(cc1)COCc2ccccc2 7a_100000210790_100000140223 [0,2,0,0,0,0|0,0,0]=2 12090 B18R2.61 C#Cc1ccc(cc1)COCc2ccccn2 34a_100000054647_100000721315 [0,2,0,0,0,0|1,0,0]=3 12091 B18R2.61 C#Cc1ccc(cc1)COCc2ccccn2 7a_100000054647_100000721315 [0,2,0,0,0,0|1,0,0]=3 12092 B18R2.61 C#Cc1ccc(cc1)COCc2cccnc2 34a_100000054647_100000733263 [0,2,0,0,0,0|1,0,0]=3 12093 B18R2.61 C#Cc1ccc(cc1)COCc2cccnc2 7a_100000054647_100000741622 [0,2,0,0,0,0|1,0,0]=3 12094 B18R2.61 C#Cc1ccc(cc1)COCc2cccnn2 34a_100000054647_100016990269 [0,2,0,0,0,0|2,0,0]=4 12095 B18R2.61 C#Cc1ccc(cc1)COCc2cccnn2 7a_100000054647_100016990269 [0,2,0,0,0,0|2,0,0]=4 12096 B18R2.61 C#Cc1ccc(cc1)COCc2ccncc2 7a_100000054647_100015193705 [0,2,0,0,0,0|1,0,0]=3 12097 B18R2.61 C#Cc1ccc(cc1)COCc2cnccn2 34a_100000054647_100016995436 [0,2,0,0,0,0|2,0,0]=4 12098 B18R2.61 C#Cc1ccc(cc1)COCc2cnccn2 7a_100000054647_100016995436 [0,2,0,0,0,0|2,0,0]=4 12099 B18R2.61 C#Cc1ccc(cc1)COCc2cncnc2 34a_100000054647_100015196519 [0,2,0,0,0,0|2,0,0]=4 12100 B18R2.61 C#Cc1ccc(cc1)COCc2cncnc2 7a_100000054647_100015196519 [0,2,0,0,0,0|2,0,0]=4 12101 B18R2.61 C#Cc1ccc(cc1)COCc2ncccn2 34a_100000054647_100000703007 [0,2,0,0,0,0|2,0,0]=4 12102 B18R2.61 C#Cc1ccc(cc1)COCc2ncccn2 7a_100000054647_100000703007 [0,2,0,0,0,0|2,0,0]=4 12103 B18R2.61 C#Cc1ccc(cc1)CSCc2ccccc2 62a_100000211182_100000140223 [0,2,0,0,0,0|0,1,0]=3 12104 B18R2.61 C#Cc1ccc(cc1)CSCc2ccccn2 62a_100000721315_100000140223 [0,2,0,0,0,0|1,1,0]=4 12105 B18R2.61 C#Cc1ccc(cc1)CSCc2cccnc2 62a_100000741622_100000140223 [0,2,0,0,0,0|1,1,0]=4 12106 B18R2.61 C#Cc1ccc(cc1)CSCc2ccncc2 62a_100015193705_100000140223 [0,2,0,0,0,0|1,1,0]=4 12107 B18R2.61 C#Cc1ccc(cc1)NCCc2ccccc2 34a_100011215031_100000765856 [0,2,0,0,0,0|2,0,0]=4 12108 B18R2.61 C=Cc1ccc(cc1)CCNc2ccccc2 34a_100000106764_100000142037 [0,2,0,0,0,0|2,0,0]=4 12109 B18R2.61 C=Cc1ccc(cc1)CCOc2ccccc2 34a_100000210340_100000142037 [0,2,0,0,0,0|2,0,0]=4 12110 B18R2.61 C=Cc1ccc(cc1)CCOc2ccccc2 7a_100000210340_100000142037 [0,2,0,0,0,0|2,0,0]=4 12111 B18R2.61 C=Cc1ccc(cc1)CCSc2ccccc2 62a_100000142037_100000041952 [0,2,0,0,0,0|2,0,0]=4 12112 B18R2.61 C=Cc1ccc(cc1)CCSc2ccccc2 62a_100000719477_100000142037 [0,2,0,0,0,0|2,0,0]=4 12113 B18R2.61 C=Cc1ccc(cc1)CNCc2ccccc2 207a_200011934891_100015611070 [0,2,0,0,0,0|1,0,0]=3 12114 B18R2.61 C=Cc1ccc(cc1)CNCc2ccccc2 2230a_100015324214_100000034074 [0,2,0,0,0,0|1,0,0]=3 12115 B18R2.61 C=Cc1ccc(cc1)CNCc2ccccc2 270004a_100015324214_100011361436 [0,2,0,0,0,0|1,0,0]=3 12116 B18R2.61 C=Cc1ccc(cc1)CNCc2ccccc2 270004a_200011934891_100015611070 [0,2,0,0,0,0|1,0,0]=3 12117 B18R2.61 C=Cc1ccc(cc1)CNCc2ccccc2 271570a_100011290941_100000195849 [0,2,0,0,0,0|1,0,0]=3 12118 B18R2.61 C=Cc1ccc(cc1)CNCc2ccccc2 34a_100015324214_100000034074 [0,2,0,0,0,0|1,0,0]=3 12119 B18R2.61 C=Cc1ccc(cc1)CNCc2ccccc2 34a_200011934891_100015291786 [0,2,0,0,0,0|1,0,0]=3 12120 B18R2.61 C=Cc1ccc(cc1)CNCc2ccccn2 207a_200011934891_100000209966 [0,2,0,0,0,0|2,0,0]=4 12121 B18R2.61 C=Cc1ccc(cc1)CNCc2ccccn2 270004a_100000210449_100011361436 [0,2,0,0,0,0|2,0,0]=4 12122 B18R2.61 C=Cc1ccc(cc1)CNCc2ccccn2 270004a_200011934891_100000209966 [0,2,0,0,0,0|2,0,0]=4 12123 B18R2.61 C=Cc1ccc(cc1)CNCc2ccccn2 34a_200011934891_100000721315 [0,2,0,0,0,0|2,0,0]=4 12124 B18R2.61 C=Cc1ccc(cc1)CNCc2cccnc2 207a_200011934891_100000209961 [0,2,0,0,0,0|2,0,0]=4 12125 B18R2.61 C=Cc1ccc(cc1)CNCc2cccnc2 270004a_100000210453_100011361436 [0,2,0,0,0,0|2,0,0]=4 12126 B18R2.61 C=Cc1ccc(cc1)CNCc2cccnc2 270004a_200011934891_100000209961 [0,2,0,0,0,0|2,0,0]=4 12127 B18R2.61 C=Cc1ccc(cc1)CNCc2cccnc2 34a_200011934891_100000733263 [0,2,0,0,0,0|2,0,0]=4 12128 B18R2.61 C=Cc1ccc(cc1)CNCc2ccncc2 207a_200011934891_100000186114 [0,2,0,0,0,0|2,0,0]=4 12129 B18R2.61 C=Cc1ccc(cc1)COCc2ccccc2 34a_100000073583_100015291786 [0,2,0,0,0,0|0,0,0]=2 12130 B18R2.61 C=Cc1ccc(cc1)COCc2ccccc2 34a_100000210790_100000034074 [0,2,0,0,0,0|0,0,0]=2 12131 B18R2.61 C=Cc1ccc(cc1)COCc2ccccc2 7a_100000073583_100000211182 [0,2,0,0,0,0|0,0,0]=2 12132 B18R2.61 C=Cc1ccc(cc1)COCc2ccccc2 7a_100000210790_100000034074 [0,2,0,0,0,0|0,0,0]=2 12133 B18R2.61 C=Cc1ccc(cc1)COCc2ccccn2 34a_100000073583_100000721315 [0,2,0,0,0,0|1,0,0]=3 12134 B18R2.61 C=Cc1ccc(cc1)COCc2ccccn2 7a_100000073583_100000721315 [0,2,0,0,0,0|1,0,0]=3 12135 B18R2.61 C=Cc1ccc(cc1)COCc2cccnc2 34a_100000073583_100000733263 [0,2,0,0,0,0|1,0,0]=3 12136 B18R2.61 C=Cc1ccc(cc1)COCc2cccnc2 7a_100000073583_100000741622 [0,2,0,0,0,0|1,0,0]=3 12137 B18R2.61 C=Cc1ccc(cc1)COCc2cccnn2 34a_100000073583_100016990269 [0,2,0,0,0,0|2,0,0]=4 12138 B18R2.61 C=Cc1ccc(cc1)COCc2cccnn2 7a_100000073583_100016990269 [0,2,0,0,0,0|2,0,0]=4 12139 B18R2.61 C=Cc1ccc(cc1)COCc2ccncc2 7a_100000073583_100015193705 [0,2,0,0,0,0|1,0,0]=3 12140 B18R2.61 C=Cc1ccc(cc1)COCc2cnccn2 34a_100000073583_100016995436 [0,2,0,0,0,0|2,0,0]=4 12141 B18R2.61 C=Cc1ccc(cc1)COCc2cnccn2 7a_100000073583_100016995436 [0,2,0,0,0,0|2,0,0]=4 12142 B18R2.61 C=Cc1ccc(cc1)COCc2cncnc2 34a_100000073583_100015196519 [0,2,0,0,0,0|2,0,0]=4 12143 B18R2.61 C=Cc1ccc(cc1)COCc2cncnc2 7a_100000073583_100015196519 [0,2,0,0,0,0|2,0,0]=4 12144 B18R2.61 C=Cc1ccc(cc1)COCc2ncccn2 34a_100000073583_100000703007 [0,2,0,0,0,0|2,0,0]=4 12145 B18R2.61 C=Cc1ccc(cc1)COCc2ncccn2 7a_100000073583_100000703007 [0,2,0,0,0,0|2,0,0]=4 12146 B18R2.61 C=Cc1ccc(cc1)CSCc2ccccc2 62a_100000034074_100015291786 [0,2,0,0,0,0|0,1,0]=3 12147 B18R2.61 C=Cc1ccc(cc1)CSCc2ccccc2 62a_100000211182_100000034074 [0,2,0,0,0,0|0,1,0]=3 12148 B18R2.61 C=Cc1ccc(cc1)CSCc2ccccn2 62a_100000034074_100000721315 [0,2,0,0,0,0|1,1,0]=4 12149 B18R2.61 C=Cc1ccc(cc1)CSCc2ccccn2 62a_100000721315_100000034074 [0,2,0,0,0,0|1,1,0]=4 12150 B18R2.61 C=Cc1ccc(cc1)CSCc2cccnc2 62a_100000034074_100000741622 [0,2,0,0,0,0|1,1,0]=4 12151 B18R2.61 C=Cc1ccc(cc1)CSCc2cccnc2 62a_100000741622_100000034074 [0,2,0,0,0,0|1,1,0]=4 12152 B18R2.61 C=Cc1ccc(cc1)CSCc2ccncc2 62a_100000034074_100015193705 [0,2,0,0,0,0|1,1,0]=4 12153 B18R2.61 C=Cc1ccc(cc1)CSCc2ccncc2 62a_100015193705_100000034074 [0,2,0,0,0,0|1,1,0]=4 12154 B18R2.61 C=Cc1ccc(cc1)NCCc2ccccc2 34a_100011218248_100000765856 [0,2,0,0,0,0|2,0,0]=4 12155 B18R2.61 C=Cc1ccc(cc1)OCCc2ccccc2 34a_100000189437_100000765856 [0,2,0,0,0,0|2,0,0]=4 12156 B18R2.61 C=Cc1ccc(cc1)OCCc2ccccc2 7a_100000189437_100000765856 [0,2,0,0,0,0|2,0,0]=4 12157 B18R2.61 C=Cc1ccc(cc1)SCCc2ccccc2 62a_100000748128_100011218657 [0,2,0,0,0,0|2,0,0]=4 12158 B18R2.61 C=Cc1ccc(cc1)SCCc2ccccc2 62a_100000765856_100000748128 [0,2,0,0,0,0|2,0,0]=4 12159 B18R2.61 CCc1ccc(cc1)C=CCc2ccccc2 271570a_200016263579_100011215824 [0,2,0,0,0,0|1,0,1]=4 12160 B18R2.61 CCc1ccc(cc1)CNCc2ccccc2 207a_100000721222_100015611070 [0,2,0,0,0,0|1,0,0]=3 12161 B18R2.61 CCc1ccc(cc1)CNCc2ccccc2 207a_100015324214_100000211036 [0,2,0,0,0,0|1,0,0]=3 12162 B18R2.61 CCc1ccc(cc1)CNCc2ccccc2 2230a_100000721222_100015291786 [0,2,0,0,0,0|1,0,0]=3 12163 B18R2.61 CCc1ccc(cc1)CNCc2ccccc2 2230a_100015324214_100000747183 [0,2,0,0,0,0|1,0,0]=3 12164 B18R2.61 CCc1ccc(cc1)CNCc2ccccc2 270004a_100000721222_100015611070 [0,2,0,0,0,0|1,0,0]=3 12165 B18R2.61 CCc1ccc(cc1)CNCc2ccccc2 270004a_100015324214_100000211036 [0,2,0,0,0,0|1,0,0]=3 12166 B18R2.61 CCc1ccc(cc1)CNCc2ccccc2 34a_100000721222_100015291786 [0,2,0,0,0,0|1,0,0]=3 12167 B18R2.61 CCc1ccc(cc1)CNCc2ccccc2 34a_100015324214_100000747183 [0,2,0,0,0,0|1,0,0]=3 12168 B18R2.61 CCc1ccc(cc1)CNCc2ccccn2 207a_100000721222_100000209966 [0,2,0,0,0,0|2,0,0]=4 12169 B18R2.61 CCc1ccc(cc1)CNCc2ccccn2 2230a_100000721222_100000721315 [0,2,0,0,0,0|2,0,0]=4 12170 B18R2.61 CCc1ccc(cc1)CNCc2ccccn2 270004a_100000210449_100000211036 [0,2,0,0,0,0|2,0,0]=4 12171 B18R2.61 CCc1ccc(cc1)CNCc2ccccn2 270004a_100000721222_100000209966 [0,2,0,0,0,0|2,0,0]=4 12172 B18R2.61 CCc1ccc(cc1)CNCc2ccccn2 34a_100000721222_100000721315 [0,2,0,0,0,0|2,0,0]=4 12173 B18R2.61 CCc1ccc(cc1)CNCc2cccnc2 207a_100000210453_100000211036 [0,2,0,0,0,0|2,0,0]=4 12174 B18R2.61 CCc1ccc(cc1)CNCc2cccnc2 207a_100000721222_100000209961 [0,2,0,0,0,0|2,0,0]=4 12175 B18R2.61 CCc1ccc(cc1)CNCc2cccnc2 2230a_100000721222_100000741622 [0,2,0,0,0,0|2,0,0]=4 12176 B18R2.61 CCc1ccc(cc1)CNCc2cccnc2 270004a_100000210453_100000211036 [0,2,0,0,0,0|2,0,0]=4 12177 B18R2.61 CCc1ccc(cc1)CNCc2cccnc2 270004a_100000721222_100000209961 [0,2,0,0,0,0|2,0,0]=4 12178 B18R2.61 CCc1ccc(cc1)CNCc2cccnc2 34a_100000721222_100000733263 [0,2,0,0,0,0|2,0,0]=4 12179 B18R2.61 CCc1ccc(cc1)CNCc2ccncc2 207a_100000721222_100000186114 [0,2,0,0,0,0|2,0,0]=4 12180 B18R2.61 CCc1ccc(cc1)CNCc2ccncc2 2230a_100000721222_100015193705 [0,2,0,0,0,0|2,0,0]=4 12181 B18R2.61 CCc1ccc(cc1)COCc2ccccc2 34a_100000210790_100000747183 [0,2,0,0,0,0|0,0,0]=2 12182 B18R2.61 CCc1ccc(cc1)COCc2ccccc2 34a_100000702245_100015291786 [0,2,0,0,0,0|0,0,0]=2 12183 B18R2.61 CCc1ccc(cc1)COCc2ccccc2 7a_100000210790_100000747183 [0,2,0,0,0,0|0,0,0]=2 12184 B18R2.61 CCc1ccc(cc1)COCc2ccccc2 7a_100000702245_100000211182 [0,2,0,0,0,0|0,0,0]=2 12185 B18R2.61 CCc1ccc(cc1)COCc2ccccn2 34a_100000702245_100000721315 [0,2,0,0,0,0|1,0,0]=3 12186 B18R2.61 CCc1ccc(cc1)COCc2ccccn2 7a_100000702245_100000721315 [0,2,0,0,0,0|1,0,0]=3 12187 B18R2.61 CCc1ccc(cc1)COCc2cccnc2 34a_100000702245_100000733263 [0,2,0,0,0,0|1,0,0]=3 12188 B18R2.61 CCc1ccc(cc1)COCc2cccnc2 7a_100000702245_100000741622 [0,2,0,0,0,0|1,0,0]=3 12189 B18R2.61 CCc1ccc(cc1)COCc2cccnn2 34a_100000702245_100016990269 [0,2,0,0,0,0|2,0,0]=4 12190 B18R2.61 CCc1ccc(cc1)COCc2cccnn2 7a_100000702245_100016990269 [0,2,0,0,0,0|2,0,0]=4 12191 B18R2.61 CCc1ccc(cc1)COCc2ccncc2 7a_100000702245_100015193705 [0,2,0,0,0,0|1,0,0]=3 12192 B18R2.61 CCc1ccc(cc1)COCc2cnccn2 34a_100000702245_100016995436 [0,2,0,0,0,0|2,0,0]=4 12193 B18R2.61 CCc1ccc(cc1)COCc2cnccn2 7a_100000702245_100016995436 [0,2,0,0,0,0|2,0,0]=4 12194 B18R2.61 CCc1ccc(cc1)COCc2cncnc2 34a_100000702245_100015196519 [0,2,0,0,0,0|2,0,0]=4 12195 B18R2.61 CCc1ccc(cc1)COCc2cncnc2 7a_100000702245_100015196519 [0,2,0,0,0,0|2,0,0]=4 12196 B18R2.61 CCc1ccc(cc1)COCc2ncccn2 34a_100000702245_100000703007 [0,2,0,0,0,0|2,0,0]=4 12197 B18R2.61 CCc1ccc(cc1)COCc2ncccn2 7a_100000702245_100000703007 [0,2,0,0,0,0|2,0,0]=4 12198 B18R2.61 CCc1ccc(cc1)CSCc2ccccc2 62a_100000211182_100000747183 [0,2,0,0,0,0|0,1,0]=3 12199 B18R2.61 CCc1ccc(cc1)CSCc2ccccc2 62a_100000757233_100015291786 [0,2,0,0,0,0|0,1,0]=3 12200 B18R2.61 CCc1ccc(cc1)CSCc2ccccn2 62a_100000721315_100000747183 [0,2,0,0,0,0|1,1,0]=4 12201 B18R2.61 CCc1ccc(cc1)CSCc2ccccn2 62a_100000757233_100000721315 [0,2,0,0,0,0|1,1,0]=4 12202 B18R2.61 CCc1ccc(cc1)CSCc2cccnc2 62a_100000741622_100000747183 [0,2,0,0,0,0|1,1,0]=4 12203 B18R2.61 CCc1ccc(cc1)CSCc2cccnc2 62a_100000757233_100000741622 [0,2,0,0,0,0|1,1,0]=4 12204 B18R2.61 CCc1ccc(cc1)CSCc2ccncc2 62a_100000757233_100015193705 [0,2,0,0,0,0|1,1,0]=4 12205 B18R2.61 CCc1ccc(cc1)CSCc2ccncc2 62a_100015193705_100000747183 [0,2,0,0,0,0|1,1,0]=4 12206 B18R2.61 CCc1ccc(cc1)NCCc2ccccc2 2230a_100000211069_100000765856 [0,2,0,0,0,0|2,0,0]=4 12207 B18R2.61 CCc1ccc(cc1)NCCc2ccccc2 34a_100000211069_100000765856 [0,2,0,0,0,0|2,0,0]=4 12208 B18R2.61 CCc1ccc(cc1)OCCc2ccccc2 34a_100000211359_100000765856 [0,2,0,0,0,0|2,0,0]=4 12209 B18R2.61 CCc1ccc(cc1)OCCc2ccccc2 7a_100000211359_100000765856 [0,2,0,0,0,0|2,0,0]=4 12210 B18R2.61 CCc1ccc(cc1)SCCc2ccccc2 62a_100000765856_100011215824 [0,2,0,0,0,0|2,0,0]=4 12211 B18R2.61 CCc1ccc(cc1)SCCc2ccccc2 62a_100011215824_100011218657 [0,2,0,0,0,0|2,0,0]=4 12212 B18R2.61 CCc1ccc(nc1)CNCc2ccccc2 207a_100015324214_100000069529 [0,2,0,0,0,0|2,0,0]=4 12213 B18R2.61 CCc1ccc(nc1)CNCc2ccccc2 2230a_100000069493_100015291786 [0,2,0,0,0,0|2,0,0]=4 12214 B18R2.61 CCc1ccc(nc1)CNCc2ccccc2 270004a_100015324214_100000069529 [0,2,0,0,0,0|2,0,0]=4 12215 B18R2.61 CCc1ccc(nc1)CNCc2ccccc2 34a_100000069493_100015291786 [0,2,0,0,0,0|2,0,0]=4 12216 B18R2.61 CCc1ccc(nc1)COCc2ccccc2 34a_100000068455_100015291786 [0,2,0,0,0,0|1,0,0]=3 12217 B18R2.61 CCc1ccc(nc1)COCc2ccccn2 34a_100000068455_100000721315 [0,2,0,0,0,0|2,0,0]=4 12218 B18R2.61 CCc1ccc(nc1)COCc2cccnc2 34a_100000068455_100000733263 [0,2,0,0,0,0|2,0,0]=4 12219 B18R2.61 CNc1ccc(cc1)C=CCc2ccccc2 271570a_200016263579_100000219623 [0,2,0,0,0,0|1,0,1]=4 12220 B18R2.61 CNc1ccc(cc1)OCCc2ccccc2 34a_100000182112_100000765856 [0,2,0,0,0,0|2,0,0]=4 12221 B18R2.61 CNc1ccc(cc1)SCCc2ccccc2 62a_100000743151_100011218657 [0,2,0,0,0,0|2,0,0]=4 12222 B18R2.61 CNc1ccc(cc1)SCCc2ccccc2 62a_100000765856_100000743151 [0,2,0,0,0,0|2,0,0]=4 12223 B18R2.61 COc1ccc(cc1)C/C=C/c2ccccc2 34a_200031373784_200000210301 [0,2,0,0,0,0|1,0,1]=4 12224 B18R2.61 COc1ccc(cc1)C/C=C/c2ccccc2 7a_200031373784_200000210301 [0,2,0,0,0,0|1,0,1]=4 12225 B18R2.61 COc1ccc(cc1)C=CCc2ccccc2 271570a_200016263579_100000171711 [0,2,0,0,0,0|1,0,1]=4 12226 B18R2.61 COc1ccc(cc1)CCNc2ccccc2 34a_100000106764_100000184700 [0,2,0,0,0,0|2,0,0]=4 12227 B18R2.61 COc1ccc(cc1)CCOc2ccccc2 34a_100000210340_100000184700 [0,2,0,0,0,0|2,0,0]=4 12228 B18R2.61 COc1ccc(cc1)CCOc2ccccc2 7a_100000210340_100000184700 [0,2,0,0,0,0|2,0,0]=4 12229 B18R2.61 COc1ccc(cc1)CCSc2ccccc2 62a_100000719477_100011713689 [0,2,0,0,0,0|2,0,0]=4 12230 B18R2.61 COc1ccc(cc1)CCSc2ccccc2 62a_100011713689_100000041952 [0,2,0,0,0,0|2,0,0]=4 12231 B18R2.61 COc1ccc(cc1)CNCc2ccccc2 207a_100000185587_100015611070 [0,2,0,0,0,0|1,0,0]=3 12232 B18R2.61 COc1ccc(cc1)CNCc2ccccc2 207a_100015324214_100000169835 [0,2,0,0,0,0|1,0,0]=3 12233 B18R2.61 COc1ccc(cc1)CNCc2ccccc2 2230a_100015324214_100000742318 [0,2,0,0,0,0|1,0,0]=3 12234 B18R2.61 COc1ccc(cc1)CNCc2ccccc2 270004a_100000185587_100015611070 [0,2,0,0,0,0|1,0,0]=3 12235 B18R2.61 COc1ccc(cc1)CNCc2ccccc2 270004a_100015324214_100000169835 [0,2,0,0,0,0|1,0,0]=3 12236 B18R2.61 COc1ccc(cc1)CNCc2ccccc2 34a_100000185587_100015291786 [0,2,0,0,0,0|1,0,0]=3 12237 B18R2.61 COc1ccc(cc1)CNCc2ccccc2 34a_100015324214_100000742318 [0,2,0,0,0,0|1,0,0]=3 12238 B18R2.61 COc1ccc(cc1)CNCc2ccccn2 207a_100000185587_100000209966 [0,2,0,0,0,0|2,0,0]=4 12239 B18R2.61 COc1ccc(cc1)CNCc2ccccn2 270004a_100000185587_100000209966 [0,2,0,0,0,0|2,0,0]=4 12240 B18R2.61 COc1ccc(cc1)CNCc2ccccn2 270004a_100000210449_100000169835 [0,2,0,0,0,0|2,0,0]=4 12241 B18R2.61 COc1ccc(cc1)CNCc2ccccn2 34a_100000185587_100000721315 [0,2,0,0,0,0|2,0,0]=4 12242 B18R2.61 COc1ccc(cc1)CNCc2cccnc2 207a_100000185587_100000209961 [0,2,0,0,0,0|2,0,0]=4 12243 B18R2.61 COc1ccc(cc1)CNCc2cccnc2 207a_100000210453_100000169835 [0,2,0,0,0,0|2,0,0]=4 12244 B18R2.61 COc1ccc(cc1)CNCc2cccnc2 270004a_100000185587_100000209961 [0,2,0,0,0,0|2,0,0]=4 12245 B18R2.61 COc1ccc(cc1)CNCc2cccnc2 270004a_100000210453_100000169835 [0,2,0,0,0,0|2,0,0]=4 12246 B18R2.61 COc1ccc(cc1)CNCc2cccnc2 34a_100000185587_100000733263 [0,2,0,0,0,0|2,0,0]=4 12247 B18R2.61 COc1ccc(cc1)CNCc2ccncc2 207a_100000185587_100000186114 [0,2,0,0,0,0|2,0,0]=4 12248 B18R2.61 COc1ccc(cc1)COCc2ccccc2 34a_100000173359_100015291786 [0,2,0,0,0,0|0,0,0]=2 12249 B18R2.61 COc1ccc(cc1)COCc2ccccc2 34a_100000210790_100000742318 [0,2,0,0,0,0|0,0,0]=2 12250 B18R2.61 COc1ccc(cc1)COCc2ccccc2 7a_100000210790_100000742318 [0,2,0,0,0,0|0,0,0]=2 12251 B18R2.61 COc1ccc(cc1)COCc2ccccn2 34a_100000173359_100000721315 [0,2,0,0,0,0|1,0,0]=3 12252 B18R2.61 COc1ccc(cc1)COCc2cccnc2 34a_100000173359_100000733263 [0,2,0,0,0,0|1,0,0]=3 12253 B18R2.61 COc1ccc(cc1)COCc2cccnn2 34a_100000173359_100016990269 [0,2,0,0,0,0|2,0,0]=4 12254 B18R2.61 COc1ccc(cc1)COCc2cnccn2 34a_100000173359_100016995436 [0,2,0,0,0,0|2,0,0]=4 12255 B18R2.61 COc1ccc(cc1)COCc2cncnc2 34a_100000173359_100015196519 [0,2,0,0,0,0|2,0,0]=4 12256 B18R2.61 COc1ccc(cc1)COCc2ncccn2 34a_100000173359_100000703007 [0,2,0,0,0,0|2,0,0]=4 12257 B18R2.61 COc1ccc(cc1)CSCc2ccccc2 62a_100000211182_100000742318 [0,2,0,0,0,0|0,1,0]=3 12258 B18R2.61 COc1ccc(cc1)CSCc2ccccn2 62a_100000721315_100000742318 [0,2,0,0,0,0|1,1,0]=4 12259 B18R2.61 COc1ccc(cc1)CSCc2cccnc2 62a_100000741622_100000742318 [0,2,0,0,0,0|1,1,0]=4 12260 B18R2.61 COc1ccc(cc1)CSCc2ccncc2 62a_100015193705_100000742318 [0,2,0,0,0,0|1,1,0]=4 12261 B18R2.61 COc1ccc(cc1)NCCc2ccccc2 34a_100000184247_100000765856 [0,2,0,0,0,0|2,0,0]=4 12262 B18R2.61 COc1ccc(cc1)OCCc2ccccc2 34a_100000210503_100000765856 [0,2,0,0,0,0|2,0,0]=4 12263 B18R2.61 COc1ccc(cc1)SCCc2ccccc2 62a_100000765856_100000171711 [0,2,0,0,0,0|2,0,0]=4 12264 B18R2.61 COc1ccc(cn1)CNCc2ccccc2 207a_100000241975_100015611070 [0,2,0,0,0,0|2,0,0]=4 12265 B18R2.61 COc1ccc(cn1)CNCc2ccccc2 207a_100015324214_100000761633 [0,2,0,0,0,0|2,0,0]=4 12266 B18R2.61 COc1ccc(cn1)CNCc2ccccc2 2230a_100000241975_100015291786 [0,2,0,0,0,0|2,0,0]=4 12267 B18R2.61 COc1ccc(cn1)CNCc2ccccc2 2230a_100015324214_100020631284 [0,2,0,0,0,0|2,0,0]=4 12268 B18R2.61 COc1ccc(cn1)CNCc2ccccc2 270004a_100000241975_100015611070 [0,2,0,0,0,0|2,0,0]=4 12269 B18R2.61 COc1ccc(cn1)CNCc2ccccc2 270004a_100015324214_100000761633 [0,2,0,0,0,0|2,0,0]=4 12270 B18R2.61 COc1ccc(cn1)CNCc2ccccc2 34a_100015324214_100020631284 [0,2,0,0,0,0|2,0,0]=4 12271 B18R2.61 COc1ccc(cn1)COCc2ccccc2 34a_100000210790_100020631284 [0,2,0,0,0,0|1,0,0]=3 12272 B18R2.61 COc1ccc(cn1)COCc2ccccc2 34a_100000763316_100015291786 [0,2,0,0,0,0|1,0,0]=3 12273 B18R2.61 COc1ccc(cn1)COCc2ccccc2 7a_100000210790_100020631284 [0,2,0,0,0,0|1,0,0]=3 12274 B18R2.61 COc1ccc(cn1)COCc2ccccn2 34a_100000763316_100000721315 [0,2,0,0,0,0|2,0,0]=4 12275 B18R2.61 COc1ccc(cn1)COCc2cccnc2 34a_100000763316_100000733263 [0,2,0,0,0,0|2,0,0]=4 12276 B18R2.61 COc1ccc(cn1)CSCc2ccccc2 62a_100000211182_100020631284 [0,2,0,0,0,0|1,1,0]=4 12277 B18R2.61 COc1ccc(cn1)CSCc2ccccc2 62a_100020631284_100015291786 [0,2,0,0,0,0|1,1,0]=4 12278 B18R2.61 COc1ccc(nc1)CNCc2ccccc2 207a_100015324214_100000701244 [0,2,0,0,0,0|2,0,0]=4 12279 B18R2.61 COc1ccc(nc1)CNCc2ccccc2 2230a_100015324214_200000757186 [0,2,0,0,0,0|2,0,0]=4 12280 B18R2.61 COc1ccc(nc1)CNCc2ccccc2 270004a_100015324214_100000701244 [0,2,0,0,0,0|2,0,0]=4 12281 B18R2.61 COc1ccc(nc1)CNCc2ccccc2 34a_100000703904_100015291786 [0,2,0,0,0,0|2,0,0]=4 12282 B18R2.61 COc1ccc(nc1)CNCc2ccccc2 34a_100015324214_200000757186 [0,2,0,0,0,0|2,0,0]=4 12283 B18R2.61 COc1ccc(nc1)COCc2ccccc2 34a_100000210790_200000757186 [0,2,0,0,0,0|1,0,0]=3 12284 B18R2.61 COc1ccc(nc1)COCc2ccccc2 34a_100011998694_100015291786 [0,2,0,0,0,0|1,0,0]=3 12285 B18R2.61 COc1ccc(nc1)COCc2ccccc2 7a_100000210790_200000757186 [0,2,0,0,0,0|1,0,0]=3 12286 B18R2.61 COc1ccc(nc1)COCc2ccccn2 34a_100011998694_100000721315 [0,2,0,0,0,0|2,0,0]=4 12287 B18R2.61 COc1ccc(nc1)COCc2cccnc2 34a_100011998694_100000733263 [0,2,0,0,0,0|2,0,0]=4 12288 B18R2.61 COc1ccc(nc1)CSCc2ccccc2 62a_100000211182_200000757186 [0,2,0,0,0,0|1,1,0]=4 12289 B18R2.61 COc1ccc(nc1)CSCc2ccccc2 62a_200000757186_100015291786 [0,2,0,0,0,0|1,1,0]=4 12290 B18R2.61 CSc1ccc(cc1)C=CCc2ccccc2 271570a_200016263579_100011263217 [0,2,0,0,0,0|1,0,1]=4 12291 B18R2.61 CSc1ccc(cc1)CNCc2ccccc2 207a_100000174980_100015611070 [0,2,0,0,0,0|1,0,0]=3 12292 B18R2.61 CSc1ccc(cc1)CNCc2ccccc2 207a_100015324214_100000211154 [0,2,0,0,0,0|1,0,0]=3 12293 B18R2.61 CSc1ccc(cc1)CNCc2ccccc2 2230a_100000174980_100015291786 [0,2,0,0,0,0|1,0,0]=3 12294 B18R2.61 CSc1ccc(cc1)CNCc2ccccc2 2230a_100015324214_100000181263 [0,2,0,0,0,0|1,0,0]=3 12295 B18R2.61 CSc1ccc(cc1)CNCc2ccccc2 270004a_100000174980_100015611070 [0,2,0,0,0,0|1,0,0]=3 12296 B18R2.61 CSc1ccc(cc1)CNCc2ccccc2 270004a_100015324214_100000211154 [0,2,0,0,0,0|1,0,0]=3 12297 B18R2.61 CSc1ccc(cc1)CNCc2ccccc2 34a_100000174980_100015291786 [0,2,0,0,0,0|1,0,0]=3 12298 B18R2.61 CSc1ccc(cc1)CNCc2ccccc2 34a_100015324214_100000181263 [0,2,0,0,0,0|1,0,0]=3 12299 B18R2.61 CSc1ccc(cc1)CNCc2ccccc2 62a_100000195849_200000210301 [0,2,0,0,0,0|1,0,0]=3 12300 B18R2.61 CSc1ccc(cc1)CNCc2ccccc2 62a_200000210301_100000195849 [0,2,0,0,0,0|1,0,0]=3 12301 B18R2.61 CSc1ccc(cc1)CNCc2ccccn2 207a_100000174980_100000209966 [0,2,0,0,0,0|2,0,0]=4 12302 B18R2.61 CSc1ccc(cc1)CNCc2ccccn2 2230a_100000174980_100000721315 [0,2,0,0,0,0|2,0,0]=4 12303 B18R2.61 CSc1ccc(cc1)CNCc2ccccn2 270004a_100000174980_100000209966 [0,2,0,0,0,0|2,0,0]=4 12304 B18R2.61 CSc1ccc(cc1)CNCc2ccccn2 270004a_100000210449_100000211154 [0,2,0,0,0,0|2,0,0]=4 12305 B18R2.61 CSc1ccc(cc1)CNCc2ccccn2 34a_100000174980_100000721315 [0,2,0,0,0,0|2,0,0]=4 12306 B18R2.61 CSc1ccc(cc1)CNCc2cccnc2 207a_100000174980_100000209961 [0,2,0,0,0,0|2,0,0]=4 12307 B18R2.61 CSc1ccc(cc1)CNCc2cccnc2 207a_100000210453_100000211154 [0,2,0,0,0,0|2,0,0]=4 12308 B18R2.61 CSc1ccc(cc1)CNCc2cccnc2 2230a_100000174980_100000741622 [0,2,0,0,0,0|2,0,0]=4 12309 B18R2.61 CSc1ccc(cc1)CNCc2cccnc2 270004a_100000174980_100000209961 [0,2,0,0,0,0|2,0,0]=4 12310 B18R2.61 CSc1ccc(cc1)CNCc2cccnc2 270004a_100000210453_100000211154 [0,2,0,0,0,0|2,0,0]=4 12311 B18R2.61 CSc1ccc(cc1)CNCc2cccnc2 34a_100000174980_100000733263 [0,2,0,0,0,0|2,0,0]=4 12312 B18R2.61 CSc1ccc(cc1)CNCc2ccncc2 207a_100000174980_100000186114 [0,2,0,0,0,0|2,0,0]=4 12313 B18R2.61 CSc1ccc(cc1)CNCc2ccncc2 2230a_100000174980_100015193705 [0,2,0,0,0,0|2,0,0]=4 12314 B18R2.61 CSc1ccc(cc1)COCc2ccccc2 34a_100000210790_100000181263 [0,2,0,0,0,0|0,0,0]=2 12315 B18R2.61 CSc1ccc(cc1)COCc2ccccc2 34a_100011215404_100015291786 [0,2,0,0,0,0|0,0,0]=2 12316 B18R2.61 CSc1ccc(cc1)COCc2ccccc2 7a_100000210790_100000181263 [0,2,0,0,0,0|0,0,0]=2 12317 B18R2.61 CSc1ccc(cc1)COCc2ccccc2 7a_100011215404_100000211182 [0,2,0,0,0,0|0,0,0]=2 12318 B18R2.61 CSc1ccc(cc1)COCc2ccccn2 34a_100011215404_100000721315 [0,2,0,0,0,0|1,0,0]=3 12319 B18R2.61 CSc1ccc(cc1)COCc2ccccn2 7a_100011215404_100000721315 [0,2,0,0,0,0|1,0,0]=3 12320 B18R2.61 CSc1ccc(cc1)COCc2cccnc2 34a_100011215404_100000733263 [0,2,0,0,0,0|1,0,0]=3 12321 B18R2.61 CSc1ccc(cc1)COCc2cccnc2 7a_100011215404_100000741622 [0,2,0,0,0,0|1,0,0]=3 12322 B18R2.61 CSc1ccc(cc1)COCc2cccnn2 34a_100011215404_100016990269 [0,2,0,0,0,0|2,0,0]=4 12323 B18R2.61 CSc1ccc(cc1)COCc2cccnn2 7a_100011215404_100016990269 [0,2,0,0,0,0|2,0,0]=4 12324 B18R2.61 CSc1ccc(cc1)COCc2ccncc2 7a_100011215404_100015193705 [0,2,0,0,0,0|1,0,0]=3 12325 B18R2.61 CSc1ccc(cc1)COCc2cnccn2 34a_100011215404_100016995436 [0,2,0,0,0,0|2,0,0]=4 12326 B18R2.61 CSc1ccc(cc1)COCc2cnccn2 7a_100011215404_100016995436 [0,2,0,0,0,0|2,0,0]=4 12327 B18R2.61 CSc1ccc(cc1)COCc2cncnc2 34a_100011215404_100015196519 [0,2,0,0,0,0|2,0,0]=4 12328 B18R2.61 CSc1ccc(cc1)COCc2cncnc2 7a_100011215404_100015196519 [0,2,0,0,0,0|2,0,0]=4 12329 B18R2.61 CSc1ccc(cc1)COCc2ncccn2 34a_100011215404_100000703007 [0,2,0,0,0,0|2,0,0]=4 12330 B18R2.61 CSc1ccc(cc1)COCc2ncccn2 7a_100011215404_100000703007 [0,2,0,0,0,0|2,0,0]=4 12331 B18R2.61 CSc1ccc(cc1)CSCc2ccccc2 62a_100000181263_100015291786 [0,2,0,0,0,0|0,1,0]=3 12332 B18R2.61 CSc1ccc(cc1)CSCc2ccccc2 62a_100000211182_100000181263 [0,2,0,0,0,0|0,1,0]=3 12333 B18R2.61 CSc1ccc(cc1)CSCc2ccccn2 62a_100000181263_100000721315 [0,2,0,0,0,0|1,1,0]=4 12334 B18R2.61 CSc1ccc(cc1)CSCc2ccccn2 62a_100000721315_100000181263 [0,2,0,0,0,0|1,1,0]=4 12335 B18R2.61 CSc1ccc(cc1)CSCc2cccnc2 62a_100000181263_100000741622 [0,2,0,0,0,0|1,1,0]=4 12336 B18R2.61 CSc1ccc(cc1)CSCc2cccnc2 62a_100000741622_100000181263 [0,2,0,0,0,0|1,1,0]=4 12337 B18R2.61 CSc1ccc(cc1)CSCc2ccncc2 62a_100000181263_100015193705 [0,2,0,0,0,0|1,1,0]=4 12338 B18R2.61 CSc1ccc(cc1)CSCc2ccncc2 62a_100015193705_100000181263 [0,2,0,0,0,0|1,1,0]=4 12339 B18R2.61 CSc1ccc(cc1)NCCc2ccccc2 34a_100000212337_100000765856 [0,2,0,0,0,0|2,0,0]=4 12340 B18R2.61 CSc1ccc(cc1)OCCc2ccccc2 34a_100000211864_100000765856 [0,2,0,0,0,0|2,0,0]=4 12341 B18R2.61 CSc1ccc(cc1)SCCc2ccccc2 62a_100000765856_100011263217 [0,2,0,0,0,0|2,0,0]=4 12342 B18R2.61 CSc1ccc(cc1)SCCc2ccccc2 62a_100011263217_100011218657 [0,2,0,0,0,0|2,0,0]=4 12343 B18R2.61 CSc1ncc(cn1)COCc2ccccc2 7a_100012002198_100000211182 [0,2,0,0,0,0|2,0,0]=4 12344 B18R2.61 ClCc1ccc(cc1)COCc2ccccc2 34a_100000067286_100015291786 [0,2,0,0,0,0|0,0,0]=2 12345 B18R2.61 ClCc1ccc(cc1)COCc2ccccc2 7a_100000067286_100000211182 [0,2,0,0,0,0|0,0,0]=2 12346 B18R2.61 ClCc1ccc(cc1)COCc2ccccn2 34a_100000067286_100000721315 [0,2,0,0,0,0|1,0,0]=3 12347 B18R2.61 ClCc1ccc(cc1)COCc2ccccn2 7a_100000067286_100000721315 [0,2,0,0,0,0|1,0,0]=3 12348 B18R2.61 ClCc1ccc(cc1)COCc2cccnc2 34a_100000067286_100000733263 [0,2,0,0,0,0|1,0,0]=3 12349 B18R2.61 ClCc1ccc(cc1)COCc2cccnc2 7a_100000067286_100000741622 [0,2,0,0,0,0|1,0,0]=3 12350 B18R2.61 ClCc1ccc(cc1)COCc2cccnn2 34a_100000067286_100016990269 [0,2,0,0,0,0|2,0,0]=4 12351 B18R2.61 ClCc1ccc(cc1)COCc2cccnn2 7a_100000067286_100016990269 [0,2,0,0,0,0|2,0,0]=4 12352 B18R2.61 ClCc1ccc(cc1)COCc2ccncc2 7a_100000067286_100015193705 [0,2,0,0,0,0|1,0,0]=3 12353 B18R2.61 ClCc1ccc(cc1)COCc2cnccn2 34a_100000067286_100016995436 [0,2,0,0,0,0|2,0,0]=4 12354 B18R2.61 ClCc1ccc(cc1)COCc2cnccn2 7a_100000067286_100016995436 [0,2,0,0,0,0|2,0,0]=4 12355 B18R2.61 ClCc1ccc(cc1)COCc2cncnc2 34a_100000067286_100015196519 [0,2,0,0,0,0|2,0,0]=4 12356 B18R2.61 ClCc1ccc(cc1)COCc2cncnc2 7a_100000067286_100015196519 [0,2,0,0,0,0|2,0,0]=4 12357 B18R2.61 ClCc1ccc(cc1)COCc2ncccn2 34a_100000067286_100000703007 [0,2,0,0,0,0|2,0,0]=4 12358 B18R2.61 ClCc1ccc(cc1)COCc2ncccn2 7a_100000067286_100000703007 [0,2,0,0,0,0|2,0,0]=4 12359 B18R2.61 ClN=C1C=CC(=NNCc2ccccc2)C=C1 4a_100000007032_100000088476 [0,2,0,0,0,0|2,0,0]=4 12360 B18R2.61 FCc1ccc(cc1)C=CCc2ccccc2 271570a_200016263579_100010268989 [0,2,0,0,0,0|1,0,1]=4 12361 B18R2.61 FCc1ccc(cc1)SCCc2ccccc2 62a_100000765856_100010268989 [0,2,0,0,0,0|2,0,0]=4 12362 B18R2.61 FCc1ccc(cc1)SCCc2ccccc2 62a_100010268989_100011218657 [0,2,0,0,0,0|2,0,0]=4 12363 B18R2.61 N#Cc1ccc(cc1)C=CCc2ccccc2 271570a_200016263579_100000179745 [0,2,0,0,0,0|1,0,1]=4 12364 B18R2.61 N#Cc1ccc(cc1)CCNc2ccccc2 34a_100000106764_100012161189 [0,2,0,0,0,0|2,0,0]=4 12365 B18R2.61 N#Cc1ccc(cc1)CCOc2ccccc2 34a_100000210340_100012161189 [0,2,0,0,0,0|2,0,0]=4 12366 B18R2.61 N#Cc1ccc(cc1)CCOc2ccccc2 7a_100000210340_100012161189 [0,2,0,0,0,0|2,0,0]=4 12367 B18R2.61 N#Cc1ccc(cc1)CCSc2ccccc2 62a_100000719477_100012161189 [0,2,0,0,0,0|2,0,0]=4 12368 B18R2.61 N#Cc1ccc(cc1)CNCc2ccccc2 207a_100015207190_100015611070 [0,2,0,0,0,0|1,0,0]=3 12369 B18R2.61 N#Cc1ccc(cc1)CNCc2ccccc2 207a_100015324214_100000211122 [0,2,0,0,0,0|1,0,0]=3 12370 B18R2.61 N#Cc1ccc(cc1)CNCc2ccccc2 2230a_100015324214_100000184898 [0,2,0,0,0,0|1,0,0]=3 12371 B18R2.61 N#Cc1ccc(cc1)CNCc2ccccc2 270004a_100015207190_100015611070 [0,2,0,0,0,0|1,0,0]=3 12372 B18R2.61 N#Cc1ccc(cc1)CNCc2ccccc2 270004a_100015324214_100000211122 [0,2,0,0,0,0|1,0,0]=3 12373 B18R2.61 N#Cc1ccc(cc1)CNCc2ccccc2 34a_100015207190_100015291786 [0,2,0,0,0,0|1,0,0]=3 12374 B18R2.61 N#Cc1ccc(cc1)CNCc2ccccc2 34a_100015324214_100000184898 [0,2,0,0,0,0|1,0,0]=3 12375 B18R2.61 N#Cc1ccc(cc1)CNCc2ccccn2 207a_100015207190_100000209966 [0,2,0,0,0,0|2,0,0]=4 12376 B18R2.61 N#Cc1ccc(cc1)CNCc2ccccn2 270004a_100000210449_100000211122 [0,2,0,0,0,0|2,0,0]=4 12377 B18R2.61 N#Cc1ccc(cc1)CNCc2ccccn2 270004a_100015207190_100000209966 [0,2,0,0,0,0|2,0,0]=4 12378 B18R2.61 N#Cc1ccc(cc1)CNCc2ccccn2 34a_100015207190_100000721315 [0,2,0,0,0,0|2,0,0]=4 12379 B18R2.61 N#Cc1ccc(cc1)CNCc2cccnc2 207a_100000210453_100000211122 [0,2,0,0,0,0|2,0,0]=4 12380 B18R2.61 N#Cc1ccc(cc1)CNCc2cccnc2 207a_100015207190_100000209961 [0,2,0,0,0,0|2,0,0]=4 12381 B18R2.61 N#Cc1ccc(cc1)CNCc2cccnc2 270004a_100000210453_100000211122 [0,2,0,0,0,0|2,0,0]=4 12382 B18R2.61 N#Cc1ccc(cc1)CNCc2cccnc2 270004a_100015207190_100000209961 [0,2,0,0,0,0|2,0,0]=4 12383 B18R2.61 N#Cc1ccc(cc1)CNCc2cccnc2 34a_100015207190_100000733263 [0,2,0,0,0,0|2,0,0]=4 12384 B18R2.61 N#Cc1ccc(cc1)CNCc2ccncc2 207a_100015207190_100000186114 [0,2,0,0,0,0|2,0,0]=4 12385 B18R2.61 N#Cc1ccc(cc1)COCc2ccccc2 34a_100000210790_100000184898 [0,2,0,0,0,0|0,0,0]=2 12386 B18R2.61 N#Cc1ccc(cc1)COCc2ccccc2 34a_100000238739_100015291786 [0,2,0,0,0,0|0,0,0]=2 12387 B18R2.61 N#Cc1ccc(cc1)COCc2ccccc2 7a_100000210790_100000184898 [0,2,0,0,0,0|0,0,0]=2 12388 B18R2.61 N#Cc1ccc(cc1)COCc2ccccc2 7a_100000238739_100000211182 [0,2,0,0,0,0|0,0,0]=2 12389 B18R2.61 N#Cc1ccc(cc1)COCc2ccccn2 34a_100000238739_100000721315 [0,2,0,0,0,0|1,0,0]=3 12390 B18R2.61 N#Cc1ccc(cc1)COCc2ccccn2 7a_100000238739_100000721315 [0,2,0,0,0,0|1,0,0]=3 12391 B18R2.61 N#Cc1ccc(cc1)COCc2cccnc2 34a_100000238739_100000733263 [0,2,0,0,0,0|1,0,0]=3 12392 B18R2.61 N#Cc1ccc(cc1)COCc2cccnc2 7a_100000238739_100000741622 [0,2,0,0,0,0|1,0,0]=3 12393 B18R2.61 N#Cc1ccc(cc1)COCc2cccnn2 34a_100000238739_100016990269 [0,2,0,0,0,0|2,0,0]=4 12394 B18R2.61 N#Cc1ccc(cc1)COCc2cccnn2 7a_100000238739_100016990269 [0,2,0,0,0,0|2,0,0]=4 12395 B18R2.61 N#Cc1ccc(cc1)COCc2ccncc2 7a_100000238739_100015193705 [0,2,0,0,0,0|1,0,0]=3 12396 B18R2.61 N#Cc1ccc(cc1)COCc2cnccn2 34a_100000238739_100016995436 [0,2,0,0,0,0|2,0,0]=4 12397 B18R2.61 N#Cc1ccc(cc1)COCc2cnccn2 7a_100000238739_100016995436 [0,2,0,0,0,0|2,0,0]=4 12398 B18R2.61 N#Cc1ccc(cc1)COCc2cncnc2 34a_100000238739_100015196519 [0,2,0,0,0,0|2,0,0]=4 12399 B18R2.61 N#Cc1ccc(cc1)COCc2cncnc2 7a_100000238739_100015196519 [0,2,0,0,0,0|2,0,0]=4 12400 B18R2.61 N#Cc1ccc(cc1)COCc2ncccn2 34a_100000238739_100000703007 [0,2,0,0,0,0|2,0,0]=4 12401 B18R2.61 N#Cc1ccc(cc1)COCc2ncccn2 7a_100000238739_100000703007 [0,2,0,0,0,0|2,0,0]=4 12402 B18R2.61 N#Cc1ccc(cc1)CSCc2ccccc2 62a_100000211182_100000184898 [0,2,0,0,0,0|0,1,0]=3 12403 B18R2.61 N#Cc1ccc(cc1)CSCc2ccccn2 62a_100000721315_100000184898 [0,2,0,0,0,0|1,1,0]=4 12404 B18R2.61 N#Cc1ccc(cc1)CSCc2cccnc2 62a_100000741622_100000184898 [0,2,0,0,0,0|1,1,0]=4 12405 B18R2.61 N#Cc1ccc(cc1)CSCc2ccncc2 62a_100015193705_100000184898 [0,2,0,0,0,0|1,1,0]=4 12406 B18R2.61 N#Cc1ccc(cc1)NCCc2ccccc2 34a_100000185469_100000765856 [0,2,0,0,0,0|2,0,0]=4 12407 B18R2.61 N#Cc1ccc(cc1)OCCc2ccccc2 34a_100000210344_100000765856 [0,2,0,0,0,0|2,0,0]=4 12408 B18R2.61 N#Cc1ccc(cc1)OCCc2ccccc2 7a_100000210344_100000765856 [0,2,0,0,0,0|2,0,0]=4 12409 B18R2.61 N#Cc1ccc(cc1)SCCc2ccccc2 62a_100000765856_100000184291 [0,2,0,0,0,0|2,0,0]=4 12410 B18R2.61 N#Cc1ccc(cn1)CNCc2ccccc2 2230a_100015324214_100009816919 [0,2,0,0,0,0|2,0,0]=4 12411 B18R2.61 N#Cc1ccc(cn1)CNCc2ccccc2 270004a_100015324214_100000064383 [0,2,0,0,0,0|2,0,0]=4 12412 B18R2.61 N#Cc1ccc(cn1)CNCc2ccccc2 34a_100015324214_100009816919 [0,2,0,0,0,0|2,0,0]=4 12413 B18R2.61 N#Cc1ccc(cn1)COCc2ccccc2 34a_100000090650_100015291786 [0,2,0,0,0,0|1,0,0]=3 12414 B18R2.61 N#Cc1ccc(cn1)COCc2ccccc2 34a_100000210790_100009816919 [0,2,0,0,0,0|1,0,0]=3 12415 B18R2.61 N#Cc1ccc(cn1)COCc2ccccc2 7a_100000090650_100000211182 [0,2,0,0,0,0|1,0,0]=3 12416 B18R2.61 N#Cc1ccc(cn1)COCc2ccccc2 7a_100000210790_100009816919 [0,2,0,0,0,0|1,0,0]=3 12417 B18R2.61 N#Cc1ccc(cn1)COCc2ccccn2 34a_100000090650_100000721315 [0,2,0,0,0,0|2,0,0]=4 12418 B18R2.61 N#Cc1ccc(cn1)COCc2ccccn2 7a_100000090650_100000721315 [0,2,0,0,0,0|2,0,0]=4 12419 B18R2.61 N#Cc1ccc(cn1)COCc2cccnc2 34a_100000090650_100000733263 [0,2,0,0,0,0|2,0,0]=4 12420 B18R2.61 N#Cc1ccc(cn1)COCc2cccnc2 7a_100000090650_100000741622 [0,2,0,0,0,0|2,0,0]=4 12421 B18R2.61 N#Cc1ccc(cn1)COCc2ccncc2 7a_100000090650_100015193705 [0,2,0,0,0,0|2,0,0]=4 12422 B18R2.61 N#Cc1ccc(cn1)CSCc2ccccc2 62a_100000211182_100009816919 [0,2,0,0,0,0|1,1,0]=4 12423 B18R2.61 N#Cc1ccc(nc1)CNCc2ccccc2 2230a_100015324214_100000693164 [0,2,0,0,0,0|2,0,0]=4 12424 B18R2.61 N#Cc1ccc(nc1)CNCc2ccccc2 270004a_100015324214_100009884217 [0,2,0,0,0,0|2,0,0]=4 12425 B18R2.61 N#Cc1ccc(nc1)CNCc2ccccc2 34a_100015324214_100000693164 [0,2,0,0,0,0|2,0,0]=4 12426 B18R2.61 N#Cc1ccc(nc1)COCc2ccccc2 34a_100000101912_100015291786 [0,2,0,0,0,0|1,0,0]=3 12427 B18R2.61 N#Cc1ccc(nc1)COCc2ccccc2 34a_100000210790_100000693164 [0,2,0,0,0,0|1,0,0]=3 12428 B18R2.61 N#Cc1ccc(nc1)COCc2ccccc2 7a_100000210790_100000693164 [0,2,0,0,0,0|1,0,0]=3 12429 B18R2.61 N#Cc1ccc(nc1)COCc2ccccn2 34a_100000101912_100000721315 [0,2,0,0,0,0|2,0,0]=4 12430 B18R2.61 N#Cc1ccc(nc1)COCc2cccnc2 34a_100000101912_100000733263 [0,2,0,0,0,0|2,0,0]=4 12431 B18R2.61 N#Cc1ccc(nc1)CSCc2ccccc2 62a_100000211182_100000693164 [0,2,0,0,0,0|1,1,0]=4 12432 B18R2.61 NCc1ccc(cc1)C=CCc2ccccc2 271570a_200016263579_100016989417 [0,2,0,0,0,0|1,0,1]=4 12433 B18R2.61 NCc1ccc(cc1)COCc2ccccc2 34a_100015189231_100015291786 [0,2,0,0,0,0|0,0,0]=2 12434 B18R2.61 NCc1ccc(cc1)COCc2ccccn2 34a_100015189231_100000721315 [0,2,0,0,0,0|1,0,0]=3 12435 B18R2.61 NCc1ccc(cc1)COCc2cccnc2 34a_100015189231_100000733263 [0,2,0,0,0,0|1,0,0]=3 12436 B18R2.61 NCc1ccc(cc1)COCc2cccnn2 34a_100015189231_100016990269 [0,2,0,0,0,0|2,0,0]=4 12437 B18R2.61 NCc1ccc(cc1)COCc2cnccn2 34a_100015189231_100016995436 [0,2,0,0,0,0|2,0,0]=4 12438 B18R2.61 NCc1ccc(cc1)COCc2cncnc2 34a_100015189231_100015196519 [0,2,0,0,0,0|2,0,0]=4 12439 B18R2.61 NCc1ccc(cc1)COCc2ncccn2 34a_100015189231_100000703007 [0,2,0,0,0,0|2,0,0]=4 12440 B18R2.61 NCc1ccc(cc1)OCCc2ccccc2 34a_100000185549_100000765856 [0,2,0,0,0,0|2,0,0]=4 12441 B18R2.61 NCc1ccc(cc1)SCCc2ccccc2 62a_100000765856_100016989417 [0,2,0,0,0,0|2,0,0]=4 12442 B18R2.61 NCc1ccc(cc1)SCCc2ccccc2 62a_100016989417_100011218657 [0,2,0,0,0,0|2,0,0]=4 12443 B18R2.61 NNc1ccc(cc1)C=CCc2ccccc2 271570a_200016263579_100016988836 [0,2,0,0,0,0|1,0,1]=4 12444 B18R2.61 NNc1ccc(cc1)SCCc2ccccc2 62a_100000765856_100016988836 [0,2,0,0,0,0|2,0,0]=4 12445 B18R2.61 NNc1ccc(cc1)SCCc2ccccc2 62a_100016988836_100011218657 [0,2,0,0,0,0|2,0,0]=4 12446 B18R2.61 O=Cc1ccc(cc1)C=CCc2ccccc2 271570a_200016263579_100000186029 [0,2,0,0,0,0|1,0,1]=4 12447 B18R2.61 O=Cc1ccc(cc1)CNCc2ccccc2 2230a_100015324214_100009816848 [0,2,0,0,0,0|1,0,0]=3 12448 B18R2.61 O=Cc1ccc(cc1)CNCc2ccccc2 34a_100015324214_100009816848 [0,2,0,0,0,0|1,0,0]=3 12449 B18R2.61 O=Cc1ccc(cc1)COCc2ccccc2 34a_100000210790_100009816848 [0,2,0,0,0,0|0,0,0]=2 12450 B18R2.61 O=Cc1ccc(cc1)COCc2ccccc2 7a_100000210790_100009816848 [0,2,0,0,0,0|0,0,0]=2 12451 B18R2.61 O=Cc1ccc(cc1)CSCc2ccccc2 62a_100000211182_100009816848 [0,2,0,0,0,0|0,1,0]=3 12452 B18R2.61 O=Cc1ccc(cc1)CSCc2ccccc2 62a_100009816848_100015291786 [0,2,0,0,0,0|0,1,0]=3 12453 B18R2.61 O=Cc1ccc(cc1)CSCc2ccccn2 62a_100000721315_100009816848 [0,2,0,0,0,0|1,1,0]=4 12454 B18R2.61 O=Cc1ccc(cc1)CSCc2ccccn2 62a_100009816848_100000721315 [0,2,0,0,0,0|1,1,0]=4 12455 B18R2.61 O=Cc1ccc(cc1)CSCc2cccnc2 62a_100000741622_100009816848 [0,2,0,0,0,0|1,1,0]=4 12456 B18R2.61 O=Cc1ccc(cc1)CSCc2cccnc2 62a_100009816848_100000741622 [0,2,0,0,0,0|1,1,0]=4 12457 B18R2.61 O=Cc1ccc(cc1)CSCc2ccncc2 62a_100009816848_100015193705 [0,2,0,0,0,0|1,1,0]=4 12458 B18R2.61 O=Cc1ccc(cc1)CSCc2ccncc2 62a_100015193705_100009816848 [0,2,0,0,0,0|1,1,0]=4 12459 B18R2.61 O=Cc1ccc(cc1)SCCc2ccccc2 62a_100000188517_100011218657 [0,2,0,0,0,0|2,0,0]=4 12460 B18R2.61 O=Cc1ccc(cc1)SCCc2ccccc2 62a_100000765856_100000188517 [0,2,0,0,0,0|2,0,0]=4 12461 B18R2.61 OCc1ccc(cc1)C=CCc2ccccc2 271570a_200016263579_100000690907 [0,2,0,0,0,0|1,0,1]=4 12462 B18R2.61 OCc1ccc(cc1)CNCc2ccccc2 207a_100015189231_100015611070 [0,2,0,0,0,0|1,0,0]=3 12463 B18R2.61 OCc1ccc(cc1)CNCc2ccccc2 207a_100015324214_100009832023 [0,2,0,0,0,0|1,0,0]=3 12464 B18R2.61 OCc1ccc(cc1)CNCc2ccccc2 2230a_100015189231_100015291786 [0,2,0,0,0,0|1,0,0]=3 12465 B18R2.61 OCc1ccc(cc1)CNCc2ccccc2 2230a_100015324214_100000067286 [0,2,0,0,0,0|1,0,0]=3 12466 B18R2.61 OCc1ccc(cc1)CNCc2ccccc2 270004a_100015189231_100015611070 [0,2,0,0,0,0|1,0,0]=3 12467 B18R2.61 OCc1ccc(cc1)CNCc2ccccc2 270004a_100015324214_100009832023 [0,2,0,0,0,0|1,0,0]=3 12468 B18R2.61 OCc1ccc(cc1)CNCc2ccccc2 34a_100015189231_100015291786 [0,2,0,0,0,0|1,0,0]=3 12469 B18R2.61 OCc1ccc(cc1)CNCc2ccccc2 34a_100015324214_100000067286 [0,2,0,0,0,0|1,0,0]=3 12470 B18R2.61 OCc1ccc(cc1)CNCc2ccccn2 207a_100015189231_100000209966 [0,2,0,0,0,0|2,0,0]=4 12471 B18R2.61 OCc1ccc(cc1)CNCc2ccccn2 2230a_100015189231_100000721315 [0,2,0,0,0,0|2,0,0]=4 12472 B18R2.61 OCc1ccc(cc1)CNCc2ccccn2 270004a_100000210449_100009832023 [0,2,0,0,0,0|2,0,0]=4 12473 B18R2.61 OCc1ccc(cc1)CNCc2ccccn2 270004a_100015189231_100000209966 [0,2,0,0,0,0|2,0,0]=4 12474 B18R2.61 OCc1ccc(cc1)CNCc2ccccn2 34a_100015189231_100000721315 [0,2,0,0,0,0|2,0,0]=4 12475 B18R2.61 OCc1ccc(cc1)CNCc2cccnc2 207a_100000210453_100009832023 [0,2,0,0,0,0|2,0,0]=4 12476 B18R2.61 OCc1ccc(cc1)CNCc2cccnc2 207a_100015189231_100000209961 [0,2,0,0,0,0|2,0,0]=4 12477 B18R2.61 OCc1ccc(cc1)CNCc2cccnc2 2230a_100015189231_100000741622 [0,2,0,0,0,0|2,0,0]=4 12478 B18R2.61 OCc1ccc(cc1)CNCc2cccnc2 270004a_100000210453_100009832023 [0,2,0,0,0,0|2,0,0]=4 12479 B18R2.61 OCc1ccc(cc1)CNCc2cccnc2 270004a_100015189231_100000209961 [0,2,0,0,0,0|2,0,0]=4 12480 B18R2.61 OCc1ccc(cc1)CNCc2cccnc2 34a_100015189231_100000733263 [0,2,0,0,0,0|2,0,0]=4 12481 B18R2.61 OCc1ccc(cc1)CNCc2ccncc2 207a_100015189231_100000186114 [0,2,0,0,0,0|2,0,0]=4 12482 B18R2.61 OCc1ccc(cc1)CNCc2ccncc2 2230a_100015189231_100015193705 [0,2,0,0,0,0|2,0,0]=4 12483 B18R2.61 OCc1ccc(cc1)COCc2ccccc2 34a_100000210790_100000067286 [0,2,0,0,0,0|0,0,0]=2 12484 B18R2.61 OCc1ccc(cc1)COCc2ccccc2 7a_100000210790_100000067286 [0,2,0,0,0,0|0,0,0]=2 12485 B18R2.61 OCc1ccc(cc1)CSCc2ccccc2 62a_100000067286_100015291786 [0,2,0,0,0,0|0,1,0]=3 12486 B18R2.61 OCc1ccc(cc1)CSCc2ccccc2 62a_100000211182_100000067286 [0,2,0,0,0,0|0,1,0]=3 12487 B18R2.61 OCc1ccc(cc1)CSCc2ccccn2 62a_100000067286_100000721315 [0,2,0,0,0,0|1,1,0]=4 12488 B18R2.61 OCc1ccc(cc1)CSCc2ccccn2 62a_100000721315_100000067286 [0,2,0,0,0,0|1,1,0]=4 12489 B18R2.61 OCc1ccc(cc1)CSCc2cccnc2 62a_100000067286_100000741622 [0,2,0,0,0,0|1,1,0]=4 12490 B18R2.61 OCc1ccc(cc1)CSCc2cccnc2 62a_100000741622_100000067286 [0,2,0,0,0,0|1,1,0]=4 12491 B18R2.61 OCc1ccc(cc1)CSCc2ccncc2 62a_100000067286_100015193705 [0,2,0,0,0,0|1,1,0]=4 12492 B18R2.61 OCc1ccc(cc1)CSCc2ccncc2 62a_100015193705_100000067286 [0,2,0,0,0,0|1,1,0]=4 12493 B18R2.61 OCc1ccc(cc1)NCCc2ccccc2 2230a_100011215238_100000765856 [0,2,0,0,0,0|2,0,0]=4 12494 B18R2.61 OCc1ccc(cc1)NCCc2ccccc2 34a_100011215238_100000765856 [0,2,0,0,0,0|2,0,0]=4 12495 B18R2.61 OCc1ccc(cc1)OCCc2ccccc2 34a_100000211755_100000765856 [0,2,0,0,0,0|2,0,0]=4 12496 B18R2.61 OCc1ccc(cc1)SCCc2ccccc2 62a_100000690907_100011218657 [0,2,0,0,0,0|2,0,0]=4 12497 B18R2.61 OCc1ccc(cc1)SCCc2ccccc2 62a_100000765856_100000690907 [0,2,0,0,0,0|2,0,0]=4 12498 B18R2.61 ON=C1C=CC(=NNCc2ccccc2)C=C1 4a_100000007032_200000095120 [0,2,0,0,0,0|2,0,0]=4 12499 B18R2.61 [13CH3]Oc1ccc(cc1)C/C=C/c2ccccc2 34a_200031373784_200025704644 [0,2,0,0,0,0|1,0,1]=4 12500 B18R2.61 [13CH3]Oc1ccc(cc1)C/C=C/c2ccccc2 7a_200031373784_200025704644 [0,2,0,0,0,0|1,0,1]=4 12501 B18R2.61 [13CH3]Sc1ccc(cc1)CNCc2ccccc2 62a_100000195849_200025704644 [0,2,0,0,0,0|1,0,0]=3 12502 B18R2.61 [13CH3]Sc1ccc(cc1)CNCc2ccccc2 62a_200025704644_100000195849 [0,2,0,0,0,0|1,0,0]=3 12503 B18R2.253 CC(NCc1ccccc1)c2cc[n+](cc2)[O-] 269862a_100015324214_100000076990 [0,2,0,0,0,0|2,0,0]=4 12504 B18R2.253 CC(NCc1ccccc1)c2ccc(cc2)Br 2230a_100015324214_100000755118 [0,2,0,0,0,0|1,0,0]=3 12505 B18R2.253 CC(NCc1ccccc1)c2ccc(cc2)Br 269862a_100015324214_100000185794 [0,2,0,0,0,0|1,0,0]=3 12506 B18R2.253 CC(NCc1ccccc1)c2ccc(cc2)Br 34a_100015324214_100000755118 [0,2,0,0,0,0|1,0,0]=3 12507 B18R2.253 CC(NCc1ccccc1)c2ccc(cc2)Cl 2230a_100015324214_100000684792 [0,2,0,0,0,0|1,0,0]=3 12508 B18R2.253 CC(NCc1ccccc1)c2ccc(cc2)Cl 269862a_100015324214_100000185797 [0,2,0,0,0,0|1,0,0]=3 12509 B18R2.253 CC(NCc1ccccc1)c2ccc(cc2)F 2230a_100015324214_100000743420 [0,2,0,0,0,0|1,0,0]=3 12510 B18R2.253 CC(NCc1ccccc1)c2ccc(cc2)F 269862a_100015324214_100000185800 [0,2,0,0,0,0|1,0,0]=3 12511 B18R2.253 CC(NCc1ccccc1)c2ccc(cc2)F 34a_100015324214_100000743420 [0,2,0,0,0,0|1,0,0]=3 12512 B18R2.253 CC(NCc1ccccc1)c2ccc(cc2)I 269862a_100015324214_100000185465 [0,2,0,0,0,0|1,0,0]=3 12513 B18R2.253 CC(NCc1ccccc1)c2ccc(cn2)Br 207a_100000723930_100015611070 [0,2,0,0,0,0|2,0,0]=4 12514 B18R2.253 CC(NCc1ccccc1)c2ccc(cn2)Br 2230a_100000723930_100015291786 [0,2,0,0,0,0|2,0,0]=4 12515 B18R2.253 CC(NCc1ccccc1)c2ccc(cn2)Br 269862a_100015324214_100000686046 [0,2,0,0,0,0|2,0,0]=4 12516 B18R2.253 CC(NCc1ccccc1)c2ccc(cn2)Br 270004a_100000723930_100015611070 [0,2,0,0,0,0|2,0,0]=4 12517 B18R2.253 CC(NCc1ccccc1)c2ccc(cn2)Br 270004a_100015324214_100000686046 [0,2,0,0,0,0|2,0,0]=4 12518 B18R2.253 CC(NCc1ccccc1)c2ccc(cn2)Cl 269862a_100015324214_100000692432 [0,2,0,0,0,0|2,0,0]=4 12519 B18R2.253 CC(NCc1ccccc1)c2ccc(cn2)Cl 270004a_100015324214_100000692432 [0,2,0,0,0,0|2,0,0]=4 12520 B18R2.253 CC(NCc1ccccc1)c2ccc(cn2)F 269862a_100015324214_100102946652 [0,2,0,0,0,0|2,0,0]=4 12521 B18R2.253 CC(NCc1ccccc1)c2ccc(cn2)F 270004a_100015324214_100102946652 [0,2,0,0,0,0|2,0,0]=4 12522 B18R2.253 CC(NCc1ccccc1)c2ccc(nc2)Br 269862a_100015324214_100000684857 [0,2,0,0,0,0|2,0,0]=4 12523 B18R2.253 CC(NCc1ccccc1)c2ccc(nc2)Cl 269862a_100015324214_100000690552 [0,2,0,0,0,0|2,0,0]=4 12524 B18R2.253 CC(NCc1ccccc1)c2ccc(nc2)F 269862a_100015324214_100000085738 [0,2,0,0,0,0|2,0,0]=4 12525 B18R2.253 CC(NCc1cccnc1)c2ccc(cc2)Br 269862a_100000210453_100000185794 [0,2,0,0,0,0|2,0,0]=4 12526 B18R2.253 CC(NCc1cccnc1)c2ccc(cc2)Cl 269862a_100000210453_100000185797 [0,2,0,0,0,0|2,0,0]=4 12527 B18R2.253 CC(NCc1cccnc1)c2ccc(cc2)F 269862a_100000210453_100000185800 [0,2,0,0,0,0|2,0,0]=4 12528 B18R2.253 CC(NCc1cccnc1)c2ccc(cc2)I 269862a_100000210453_100000185465 [0,2,0,0,0,0|2,0,0]=4 12529 B18R2.253 CC(NCc1ccncc1)c2ccc(cc2)Br 269862a_100000210450_100000185794 [0,2,0,0,0,0|2,0,0]=4 12530 B18R2.253 CC(NCc1ccncc1)c2ccc(cc2)Cl 269862a_100000210450_100000185797 [0,2,0,0,0,0|2,0,0]=4 12531 B18R2.253 CC(NCc1ccncc1)c2ccc(cc2)F 269862a_100000210450_100000185800 [0,2,0,0,0,0|2,0,0]=4 12532 B18R2.253 CC(NCc1ccncc1)c2ccc(cc2)I 269862a_100000210450_100000185465 [0,2,0,0,0,0|2,0,0]=4 12533 B18R2.253 CC(OCc1ccccc1)c2ccc(cc2)Br 34a_100000210790_100000755118 [0,2,0,0,0,0|0,0,0]=2 12534 B18R2.253 CC(OCc1ccccc1)c2ccc(cc2)Br 34a_100000745893_100015291786 [0,2,0,0,0,0|0,0,0]=2 12535 B18R2.253 CC(OCc1ccccc1)c2ccc(cc2)Br 7a_100000745893_100000211182 [0,2,0,0,0,0|0,0,0]=2 12536 B18R2.253 CC(OCc1ccccc1)c2ccc(cc2)Cl 7a_100000210790_100000684792 [0,2,0,0,0,0|0,0,0]=2 12537 B18R2.253 CC(OCc1ccccc1)c2ccc(cc2)F 34a_100000181323_100015291786 [0,2,0,0,0,0|0,0,0]=2 12538 B18R2.253 CC(OCc1ccccc1)c2ccc(cc2)F 34a_100000210790_100000743420 [0,2,0,0,0,0|0,0,0]=2 12539 B18R2.253 CC(OCc1ccccc1)c2ccc(cc2)F 7a_100000181323_100000211182 [0,2,0,0,0,0|0,0,0]=2 12540 B18R2.253 CC(OCc1ccccc1)c2ccc(cc2)F 7a_100000210790_100000743420 [0,2,0,0,0,0|0,0,0]=2 12541 B18R2.253 CC(OCc1ccccc1)c2ccc(cc2)N 34a_100011216399_100015291786 [0,2,0,0,0,0|0,0,0]=2 12542 B18R2.253 CC(OCc1ccccc1)c2ccc(cn2)Br 34a_100012353650_100015291786 [0,2,0,0,0,0|1,0,0]=3 12543 B18R2.253 CC(OCc1ccccc1)c2ccc(cn2)Br 7a_100012353650_100000211182 [0,2,0,0,0,0|1,0,0]=3 12544 B18R2.253 CC(OCc1ccccc1)c2ccc(nc2)Br 34a_200010274204_100015291786 [0,2,0,0,0,0|1,0,0]=3 12545 B18R2.253 CC(OCc1ccccc1)c2ccc(nc2)Br 7a_200010274204_100000211182 [0,2,0,0,0,0|1,0,0]=3 12546 B18R2.253 CC(OCc1ccccc1)c2ccc(nc2)Cl 34a_200012017543_100015291786 [0,2,0,0,0,0|1,0,0]=3 12547 B18R2.253 CC(OCc1ccccc1)c2ccc(nc2)Cl 7a_200012017543_100000211182 [0,2,0,0,0,0|1,0,0]=3 12548 B18R2.253 CC(OCc1ccccn1)c2ccc(cc2)Br 34a_100000745893_100000721315 [0,2,0,0,0,0|1,0,0]=3 12549 B18R2.253 CC(OCc1ccccn1)c2ccc(cc2)Br 7a_100000745893_100000721315 [0,2,0,0,0,0|1,0,0]=3 12550 B18R2.253 CC(OCc1ccccn1)c2ccc(cc2)F 34a_100000181323_100000721315 [0,2,0,0,0,0|1,0,0]=3 12551 B18R2.253 CC(OCc1ccccn1)c2ccc(cc2)F 7a_100000181323_100000721315 [0,2,0,0,0,0|1,0,0]=3 12552 B18R2.253 CC(OCc1ccccn1)c2ccc(cc2)N 34a_100011216399_100000721315 [0,2,0,0,0,0|1,0,0]=3 12553 B18R2.253 CC(OCc1ccccn1)c2ccc(cn2)Br 34a_100012353650_100000721315 [0,2,0,0,0,0|2,0,0]=4 12554 B18R2.253 CC(OCc1ccccn1)c2ccc(cn2)Br 7a_100012353650_100000721315 [0,2,0,0,0,0|2,0,0]=4 12555 B18R2.253 CC(OCc1ccccn1)c2ccc(nc2)Br 34a_200010274204_100000721315 [0,2,0,0,0,0|2,0,0]=4 12556 B18R2.253 CC(OCc1ccccn1)c2ccc(nc2)Br 7a_200010274204_100000721315 [0,2,0,0,0,0|2,0,0]=4 12557 B18R2.253 CC(OCc1ccccn1)c2ccc(nc2)Cl 34a_200012017543_100000721315 [0,2,0,0,0,0|2,0,0]=4 12558 B18R2.253 CC(OCc1ccccn1)c2ccc(nc2)Cl 7a_200012017543_100000721315 [0,2,0,0,0,0|2,0,0]=4 12559 B18R2.253 CC(OCc1cccnc1)c2ccc(cc2)Br 34a_100000745893_100000733263 [0,2,0,0,0,0|1,0,0]=3 12560 B18R2.253 CC(OCc1cccnc1)c2ccc(cc2)Br 7a_100000745893_100000741622 [0,2,0,0,0,0|1,0,0]=3 12561 B18R2.253 CC(OCc1cccnc1)c2ccc(cc2)F 34a_100000181323_100000733263 [0,2,0,0,0,0|1,0,0]=3 12562 B18R2.253 CC(OCc1cccnc1)c2ccc(cc2)F 7a_100000181323_100000741622 [0,2,0,0,0,0|1,0,0]=3 12563 B18R2.253 CC(OCc1cccnc1)c2ccc(cc2)N 34a_100011216399_100000733263 [0,2,0,0,0,0|1,0,0]=3 12564 B18R2.253 CC(OCc1cccnc1)c2ccc(cn2)Br 34a_100012353650_100000733263 [0,2,0,0,0,0|2,0,0]=4 12565 B18R2.253 CC(OCc1cccnc1)c2ccc(cn2)Br 7a_100012353650_100000741622 [0,2,0,0,0,0|2,0,0]=4 12566 B18R2.253 CC(OCc1cccnc1)c2ccc(nc2)Br 34a_200010274204_100000733263 [0,2,0,0,0,0|2,0,0]=4 12567 B18R2.253 CC(OCc1cccnc1)c2ccc(nc2)Br 7a_200010274204_100000741622 [0,2,0,0,0,0|2,0,0]=4 12568 B18R2.253 CC(OCc1cccnc1)c2ccc(nc2)Cl 34a_200012017543_100000733263 [0,2,0,0,0,0|2,0,0]=4 12569 B18R2.253 CC(OCc1cccnc1)c2ccc(nc2)Cl 7a_200012017543_100000741622 [0,2,0,0,0,0|2,0,0]=4 12570 B18R2.253 CC(OCc1cccnn1)c2ccc(cc2)Br 34a_100000745893_100016990269 [0,2,0,0,0,0|2,0,0]=4 12571 B18R2.253 CC(OCc1cccnn1)c2ccc(cc2)Br 7a_100000745893_100016990269 [0,2,0,0,0,0|2,0,0]=4 12572 B18R2.253 CC(OCc1cccnn1)c2ccc(cc2)F 34a_100000181323_100016990269 [0,2,0,0,0,0|2,0,0]=4 12573 B18R2.253 CC(OCc1cccnn1)c2ccc(cc2)F 7a_100000181323_100016990269 [0,2,0,0,0,0|2,0,0]=4 12574 B18R2.253 CC(OCc1cccnn1)c2ccc(cc2)N 34a_100011216399_100016990269 [0,2,0,0,0,0|2,0,0]=4 12575 B18R2.253 CC(OCc1ccncc1)c2ccc(cc2)Br 7a_100000745893_100015193705 [0,2,0,0,0,0|1,0,0]=3 12576 B18R2.253 CC(OCc1ccncc1)c2ccc(cc2)F 7a_100000181323_100015193705 [0,2,0,0,0,0|1,0,0]=3 12577 B18R2.253 CC(OCc1ccncc1)c2ccc(cn2)Br 7a_100012353650_100015193705 [0,2,0,0,0,0|2,0,0]=4 12578 B18R2.253 CC(OCc1ccncc1)c2ccc(nc2)Br 7a_200010274204_100015193705 [0,2,0,0,0,0|2,0,0]=4 12579 B18R2.253 CC(OCc1ccncc1)c2ccc(nc2)Cl 7a_200012017543_100015193705 [0,2,0,0,0,0|2,0,0]=4 12580 B18R2.253 CC(OCc1cnccn1)c2ccc(cc2)Br 34a_100000745893_100016995436 [0,2,0,0,0,0|2,0,0]=4 12581 B18R2.253 CC(OCc1cnccn1)c2ccc(cc2)Br 7a_100000745893_100016995436 [0,2,0,0,0,0|2,0,0]=4 12582 B18R2.253 CC(OCc1cnccn1)c2ccc(cc2)F 34a_100000181323_100016995436 [0,2,0,0,0,0|2,0,0]=4 12583 B18R2.253 CC(OCc1cnccn1)c2ccc(cc2)F 7a_100000181323_100016995436 [0,2,0,0,0,0|2,0,0]=4 12584 B18R2.253 CC(OCc1cnccn1)c2ccc(cc2)N 34a_100011216399_100016995436 [0,2,0,0,0,0|2,0,0]=4 12585 B18R2.253 CC(OCc1cncnc1)c2ccc(cc2)Br 34a_100000745893_100015196519 [0,2,0,0,0,0|2,0,0]=4 12586 B18R2.253 CC(OCc1cncnc1)c2ccc(cc2)Br 7a_100000745893_100015196519 [0,2,0,0,0,0|2,0,0]=4 12587 B18R2.253 CC(OCc1cncnc1)c2ccc(cc2)F 34a_100000181323_100015196519 [0,2,0,0,0,0|2,0,0]=4 12588 B18R2.253 CC(OCc1cncnc1)c2ccc(cc2)F 7a_100000181323_100015196519 [0,2,0,0,0,0|2,0,0]=4 12589 B18R2.253 CC(OCc1cncnc1)c2ccc(cc2)N 34a_100011216399_100015196519 [0,2,0,0,0,0|2,0,0]=4 12590 B18R2.253 CC(OCc1ncccn1)c2ccc(cc2)Br 34a_100000745893_100000703007 [0,2,0,0,0,0|2,0,0]=4 12591 B18R2.253 CC(OCc1ncccn1)c2ccc(cc2)Br 7a_100000745893_100000703007 [0,2,0,0,0,0|2,0,0]=4 12592 B18R2.253 CC(OCc1ncccn1)c2ccc(cc2)F 34a_100000181323_100000703007 [0,2,0,0,0,0|2,0,0]=4 12593 B18R2.253 CC(OCc1ncccn1)c2ccc(cc2)F 7a_100000181323_100000703007 [0,2,0,0,0,0|2,0,0]=4 12594 B18R2.253 CC(OCc1ncccn1)c2ccc(cc2)N 34a_100011216399_100000703007 [0,2,0,0,0,0|2,0,0]=4 12595 B18R2.253 CC(SCc1ccccc1)c2ccc(cc2)Br 62a_100000211182_100000755118 [0,2,0,0,0,0|0,1,0]=3 12596 B18R2.253 CC(SCc1ccccc1)c2ccc(cc2)Br 62a_100000755118_100015291786 [0,2,0,0,0,0|0,1,0]=3 12597 B18R2.253 CC(SCc1ccccc1)c2ccc(cc2)Cl 62a_100000211182_100000684792 [0,2,0,0,0,0|0,1,0]=3 12598 B18R2.253 CC(SCc1ccccc1)c2ccc(cc2)Cl 62a_100000684792_100015291786 [0,2,0,0,0,0|0,1,0]=3 12599 B18R2.253 CC(SCc1ccccc1)c2ccc(cc2)F 62a_100000211182_100000743420 [0,2,0,0,0,0|0,1,0]=3 12600 B18R2.253 CC(SCc1ccccc1)c2ccc(cc2)F 62a_100000743420_100015291786 [0,2,0,0,0,0|0,1,0]=3 12601 B18R2.253 CC(SCc1ccccn1)c2ccc(cc2)Br 62a_100000721315_100000755118 [0,2,0,0,0,0|1,1,0]=4 12602 B18R2.253 CC(SCc1ccccn1)c2ccc(cc2)Br 62a_100000755118_100000721315 [0,2,0,0,0,0|1,1,0]=4 12603 B18R2.253 CC(SCc1ccccn1)c2ccc(cc2)Cl 62a_100000684792_100000721315 [0,2,0,0,0,0|1,1,0]=4 12604 B18R2.253 CC(SCc1ccccn1)c2ccc(cc2)Cl 62a_100000721315_100000684792 [0,2,0,0,0,0|1,1,0]=4 12605 B18R2.253 CC(SCc1ccccn1)c2ccc(cc2)F 62a_100000721315_100000743420 [0,2,0,0,0,0|1,1,0]=4 12606 B18R2.253 CC(SCc1ccccn1)c2ccc(cc2)F 62a_100000743420_100000721315 [0,2,0,0,0,0|1,1,0]=4 12607 B18R2.253 CC(SCc1cccnc1)c2ccc(cc2)Br 62a_100000741622_100000755118 [0,2,0,0,0,0|1,1,0]=4 12608 B18R2.253 CC(SCc1cccnc1)c2ccc(cc2)Br 62a_100000755118_100000741622 [0,2,0,0,0,0|1,1,0]=4 12609 B18R2.253 CC(SCc1cccnc1)c2ccc(cc2)Cl 62a_100000684792_100000741622 [0,2,0,0,0,0|1,1,0]=4 12610 B18R2.253 CC(SCc1cccnc1)c2ccc(cc2)Cl 62a_100000741622_100000684792 [0,2,0,0,0,0|1,1,0]=4 12611 B18R2.253 CC(SCc1cccnc1)c2ccc(cc2)F 62a_100000741622_100000743420 [0,2,0,0,0,0|1,1,0]=4 12612 B18R2.253 CC(SCc1cccnc1)c2ccc(cc2)F 62a_100000743420_100000741622 [0,2,0,0,0,0|1,1,0]=4 12613 B18R2.253 CC(SCc1ccncc1)c2ccc(cc2)Br 62a_100000755118_100015193705 [0,2,0,0,0,0|1,1,0]=4 12614 B18R2.253 CC(SCc1ccncc1)c2ccc(cc2)Br 62a_100015193705_100000755118 [0,2,0,0,0,0|1,1,0]=4 12615 B18R2.253 CC(SCc1ccncc1)c2ccc(cc2)Cl 62a_100000684792_100015193705 [0,2,0,0,0,0|1,1,0]=4 12616 B18R2.253 CC(SCc1ccncc1)c2ccc(cc2)Cl 62a_100015193705_100000684792 [0,2,0,0,0,0|1,1,0]=4 12617 B18R2.253 CC(SCc1ccncc1)c2ccc(cc2)F 62a_100000743420_100015193705 [0,2,0,0,0,0|1,1,0]=4 12618 B18R2.253 CC(SCc1ccncc1)c2ccc(cc2)F 62a_100015193705_100000743420 [0,2,0,0,0,0|1,1,0]=4 12619 B18R2.253 CN(CCc1ccccc1)c2ccc(cc2)Br 2230a_100000219623_100000765856 [0,2,0,0,0,0|2,0,0]=4 12620 B18R2.253 CN(CCc1ccccc1)c2ccc(cc2)Br 269982a_100000219623_100000765856 [0,2,0,0,0,0|2,0,0]=4 12621 B18R2.253 CN(CCc1ccccc1)c2ccc(cc2)Br 34a_100000219623_100000765856 [0,2,0,0,0,0|2,0,0]=4 12622 B18R2.253 CN(CCc1ccccc1)c2ccc(cc2)Cl 2230a_100020629279_100000765856 [0,2,0,0,0,0|2,0,0]=4 12623 B18R2.253 CN(CCc1ccccc1)c2ccc(cc2)Cl 269982a_100020629279_100000765856 [0,2,0,0,0,0|2,0,0]=4 12624 B18R2.253 CN(CCc1ccccc1)c2ccc(cc2)Cl 34a_100020629279_100000765856 [0,2,0,0,0,0|2,0,0]=4 12625 B18R2.253 CN(CCc1ccccc1)c2ccc(cc2)F 2230a_100000219829_100000765856 [0,2,0,0,0,0|2,0,0]=4 12626 B18R2.253 CN(CCc1ccccc1)c2ccc(cc2)F 269982a_100000219829_100000765856 [0,2,0,0,0,0|2,0,0]=4 12627 B18R2.253 CN(CCc1ccccc1)c2ccc(cc2)F 34a_100000219829_100000765856 [0,2,0,0,0,0|2,0,0]=4 12628 B18R2.253 CN(CCc1ccccc1)c2ccc(cc2)I 2230a_100000743151_100000765856 [0,2,0,0,0,0|2,0,0]=4 12629 B18R2.253 CN(CCc1ccccc1)c2ccc(cc2)I 269982a_100000743151_100000765856 [0,2,0,0,0,0|2,0,0]=4 12630 B18R2.253 CN(CCc1ccccc1)c2ccc(cc2)I 34a_100000743151_100000765856 [0,2,0,0,0,0|2,0,0]=4 12631 B18R2.253 CN(CCc1ccccc1)c2ccc(cc2)O 269982a_100000182112_100000765856 [0,2,0,0,0,0|2,0,0]=4 12632 B18R2.253 CN(CCc1ccccc1)c2ccc(cc2)O 34a_100000182112_100000765856 [0,2,0,0,0,0|2,0,0]=4 12633 B18R2.253 C[C@@H](NCc1ccccc1)c2ccc(cc2)Br 207a_100000720352_100015611070 [0,2,0,0,0,0|1,0,0]=3 12634 B18R2.253 C[C@@H](NCc1ccccc1)c2ccc(cc2)Br 2230a_100000720352_100015291786 [0,2,0,0,0,0|1,0,0]=3 12635 B18R2.253 C[C@@H](NCc1ccccc1)c2ccc(cc2)Br 270004a_100000720352_100015611070 [0,2,0,0,0,0|1,0,0]=3 12636 B18R2.253 C[C@@H](NCc1ccccc1)c2ccc(cc2)Cl 207a_100015205461_100015611070 [0,2,0,0,0,0|1,0,0]=3 12637 B18R2.253 C[C@@H](NCc1ccccc1)c2ccc(cc2)Cl 2230a_100015205461_100015291786 [0,2,0,0,0,0|1,0,0]=3 12638 B18R2.253 C[C@@H](NCc1ccccc1)c2ccc(cc2)Cl 270004a_100015205461_100015611070 [0,2,0,0,0,0|1,0,0]=3 12639 B18R2.253 C[C@@H](NCc1ccccc1)c2ccc(cc2)Cl 34a_100015205461_100015291786 [0,2,0,0,0,0|1,0,0]=3 12640 B18R2.253 C[C@@H](NCc1ccccn1)c2ccc(cc2)Br 207a_100000720352_100000209966 [0,2,0,0,0,0|2,0,0]=4 12641 B18R2.253 C[C@@H](NCc1ccccn1)c2ccc(cc2)Br 2230a_100000720352_100000721315 [0,2,0,0,0,0|2,0,0]=4 12642 B18R2.253 C[C@@H](NCc1ccccn1)c2ccc(cc2)Br 270004a_100000720352_100000209966 [0,2,0,0,0,0|2,0,0]=4 12643 B18R2.253 C[C@@H](NCc1ccccn1)c2ccc(cc2)Cl 207a_100015205461_100000209966 [0,2,0,0,0,0|2,0,0]=4 12644 B18R2.253 C[C@@H](NCc1ccccn1)c2ccc(cc2)Cl 2230a_100015205461_100000721315 [0,2,0,0,0,0|2,0,0]=4 12645 B18R2.253 C[C@@H](NCc1ccccn1)c2ccc(cc2)Cl 270004a_100015205461_100000209966 [0,2,0,0,0,0|2,0,0]=4 12646 B18R2.253 C[C@@H](NCc1ccccn1)c2ccc(cc2)Cl 34a_100015205461_100000721315 [0,2,0,0,0,0|2,0,0]=4 12647 B18R2.253 C[C@@H](NCc1cccnc1)c2ccc(cc2)Br 207a_100000720352_100000209961 [0,2,0,0,0,0|2,0,0]=4 12648 B18R2.253 C[C@@H](NCc1cccnc1)c2ccc(cc2)Br 2230a_100000720352_100000741622 [0,2,0,0,0,0|2,0,0]=4 12649 B18R2.253 C[C@@H](NCc1cccnc1)c2ccc(cc2)Br 270004a_100000720352_100000209961 [0,2,0,0,0,0|2,0,0]=4 12650 B18R2.253 C[C@@H](NCc1cccnc1)c2ccc(cc2)Cl 207a_100015205461_100000209961 [0,2,0,0,0,0|2,0,0]=4 12651 B18R2.253 C[C@@H](NCc1cccnc1)c2ccc(cc2)Cl 2230a_100015205461_100000741622 [0,2,0,0,0,0|2,0,0]=4 12652 B18R2.253 C[C@@H](NCc1cccnc1)c2ccc(cc2)Cl 270004a_100015205461_100000209961 [0,2,0,0,0,0|2,0,0]=4 12653 B18R2.253 C[C@@H](NCc1cccnc1)c2ccc(cc2)Cl 34a_100015205461_100000733263 [0,2,0,0,0,0|2,0,0]=4 12654 B18R2.253 C[C@@H](NCc1ccncc1)c2ccc(cc2)Br 207a_100000720352_100000186114 [0,2,0,0,0,0|2,0,0]=4 12655 B18R2.253 C[C@@H](NCc1ccncc1)c2ccc(cc2)Br 2230a_100000720352_100015193705 [0,2,0,0,0,0|2,0,0]=4 12656 B18R2.253 C[C@@H](NCc1ccncc1)c2ccc(cc2)Cl 207a_100015205461_100000186114 [0,2,0,0,0,0|2,0,0]=4 12657 B18R2.253 C[C@@H](NCc1ccncc1)c2ccc(cc2)Cl 2230a_100015205461_100015193705 [0,2,0,0,0,0|2,0,0]=4 12658 B18R2.253 C[C@H](NCc1ccccc1)c2ccc(cc2)F 207a_100025705893_100015611070 [0,2,0,0,0,0|1,0,0]=3 12659 B18R2.253 C[C@H](NCc1ccccc1)c2ccc(cc2)F 2230a_100025705893_100015291786 [0,2,0,0,0,0|1,0,0]=3 12660 B18R2.253 C[C@H](NCc1ccccc1)c2ccc(cc2)F 270004a_100025705893_100015611070 [0,2,0,0,0,0|1,0,0]=3 12661 B18R2.253 C[C@H](NCc1ccccc1)c2ccc(cc2)F 34a_100025705893_100015291786 [0,2,0,0,0,0|1,0,0]=3 12662 B18R2.253 C[C@H](NCc1ccccc1)c2ccc(cc2)I 207a_100000753911_100015611070 [0,2,0,0,0,0|1,0,0]=3 12663 B18R2.253 C[C@H](NCc1ccccc1)c2ccc(cc2)I 2230a_100000753911_100015291786 [0,2,0,0,0,0|1,0,0]=3 12664 B18R2.253 C[C@H](NCc1ccccc1)c2ccc(cc2)I 270004a_100000753911_100015611070 [0,2,0,0,0,0|1,0,0]=3 12665 B18R2.253 C[C@H](NCc1ccccc1)c2ccc(cc2)O 2230a_100161106496_100015291786 [0,2,0,0,0,0|1,0,0]=3 12666 B18R2.253 C[C@H](NCc1ccccc1)c2ccc(cc2)O 270004a_100161106496_100015611070 [0,2,0,0,0,0|1,0,0]=3 12667 B18R2.253 C[C@H](NCc1ccccc1)c2ccc(nc2)Br 207a_100015387476_100015611070 [0,2,0,0,0,0|2,0,0]=4 12668 B18R2.253 C[C@H](NCc1ccccc1)c2ccc(nc2)Br 2230a_100015387476_100015291786 [0,2,0,0,0,0|2,0,0]=4 12669 B18R2.253 C[C@H](NCc1ccccc1)c2ccc(nc2)Br 270004a_100015387476_100015611070 [0,2,0,0,0,0|2,0,0]=4 12670 B18R2.253 C[C@H](NCc1ccccn1)c2ccc(cc2)F 207a_100025705893_100000209966 [0,2,0,0,0,0|2,0,0]=4 12671 B18R2.253 C[C@H](NCc1ccccn1)c2ccc(cc2)F 2230a_100025705893_100000721315 [0,2,0,0,0,0|2,0,0]=4 12672 B18R2.253 C[C@H](NCc1ccccn1)c2ccc(cc2)F 270004a_100025705893_100000209966 [0,2,0,0,0,0|2,0,0]=4 12673 B18R2.253 C[C@H](NCc1ccccn1)c2ccc(cc2)F 34a_100025705893_100000721315 [0,2,0,0,0,0|2,0,0]=4 12674 B18R2.253 C[C@H](NCc1ccccn1)c2ccc(cc2)I 207a_100000753911_100000209966 [0,2,0,0,0,0|2,0,0]=4 12675 B18R2.253 C[C@H](NCc1ccccn1)c2ccc(cc2)I 2230a_100000753911_100000721315 [0,2,0,0,0,0|2,0,0]=4 12676 B18R2.253 C[C@H](NCc1ccccn1)c2ccc(cc2)I 270004a_100000753911_100000209966 [0,2,0,0,0,0|2,0,0]=4 12677 B18R2.253 C[C@H](NCc1ccccn1)c2ccc(cc2)O 2230a_100161106496_100000721315 [0,2,0,0,0,0|2,0,0]=4 12678 B18R2.253 C[C@H](NCc1ccccn1)c2ccc(cc2)O 270004a_100161106496_100000209966 [0,2,0,0,0,0|2,0,0]=4 12679 B18R2.253 C[C@H](NCc1cccnc1)c2ccc(cc2)F 207a_100025705893_100000209961 [0,2,0,0,0,0|2,0,0]=4 12680 B18R2.253 C[C@H](NCc1cccnc1)c2ccc(cc2)F 2230a_100025705893_100000741622 [0,2,0,0,0,0|2,0,0]=4 12681 B18R2.253 C[C@H](NCc1cccnc1)c2ccc(cc2)F 270004a_100025705893_100000209961 [0,2,0,0,0,0|2,0,0]=4 12682 B18R2.253 C[C@H](NCc1cccnc1)c2ccc(cc2)F 34a_100025705893_100000733263 [0,2,0,0,0,0|2,0,0]=4 12683 B18R2.253 C[C@H](NCc1cccnc1)c2ccc(cc2)I 207a_100000753911_100000209961 [0,2,0,0,0,0|2,0,0]=4 12684 B18R2.253 C[C@H](NCc1cccnc1)c2ccc(cc2)I 2230a_100000753911_100000741622 [0,2,0,0,0,0|2,0,0]=4 12685 B18R2.253 C[C@H](NCc1cccnc1)c2ccc(cc2)I 270004a_100000753911_100000209961 [0,2,0,0,0,0|2,0,0]=4 12686 B18R2.253 C[C@H](NCc1cccnc1)c2ccc(cc2)O 2230a_100161106496_100000741622 [0,2,0,0,0,0|2,0,0]=4 12687 B18R2.253 C[C@H](NCc1cccnc1)c2ccc(cc2)O 270004a_100161106496_100000209961 [0,2,0,0,0,0|2,0,0]=4 12688 B18R2.253 C[C@H](NCc1ccncc1)c2ccc(cc2)F 207a_100025705893_100000186114 [0,2,0,0,0,0|2,0,0]=4 12689 B18R2.253 C[C@H](NCc1ccncc1)c2ccc(cc2)F 2230a_100025705893_100015193705 [0,2,0,0,0,0|2,0,0]=4 12690 B18R2.253 C[C@H](NCc1ccncc1)c2ccc(cc2)I 207a_100000753911_100000186114 [0,2,0,0,0,0|2,0,0]=4 12691 B18R2.253 C[C@H](NCc1ccncc1)c2ccc(cc2)I 2230a_100000753911_100015193705 [0,2,0,0,0,0|2,0,0]=4 12692 B18R2.253 C[C@H](NCc1ccncc1)c2ccc(cc2)O 2230a_100161106496_100015193705 [0,2,0,0,0,0|2,0,0]=4 12693 B18R2.253 C[C@H](OCc1ccccc1)c2ccc(cc2)Cl 34a_100011852131_100015291786 [0,2,0,0,0,0|0,0,0]=2 12694 B18R2.253 C[C@H](OCc1ccccc1)c2ccc(cc2)Cl 7a_100011852131_100000211182 [0,2,0,0,0,0|0,0,0]=2 12695 B18R2.253 C[C@H](OCc1ccccn1)c2ccc(cc2)Cl 34a_100011852131_100000721315 [0,2,0,0,0,0|1,0,0]=3 12696 B18R2.253 C[C@H](OCc1ccccn1)c2ccc(cc2)Cl 7a_100011852131_100000721315 [0,2,0,0,0,0|1,0,0]=3 12697 B18R2.253 C[C@H](OCc1cccnc1)c2ccc(cc2)Cl 34a_100011852131_100000733263 [0,2,0,0,0,0|1,0,0]=3 12698 B18R2.253 C[C@H](OCc1cccnc1)c2ccc(cc2)Cl 7a_100011852131_100000741622 [0,2,0,0,0,0|1,0,0]=3 12699 B18R2.253 C[C@H](OCc1cccnn1)c2ccc(cc2)Cl 34a_100011852131_100016990269 [0,2,0,0,0,0|2,0,0]=4 12700 B18R2.253 C[C@H](OCc1cccnn1)c2ccc(cc2)Cl 7a_100011852131_100016990269 [0,2,0,0,0,0|2,0,0]=4 12701 B18R2.253 C[C@H](OCc1ccncc1)c2ccc(cc2)Cl 7a_100011852131_100015193705 [0,2,0,0,0,0|1,0,0]=3 12702 B18R2.253 C[C@H](OCc1cnccn1)c2ccc(cc2)Cl 34a_100011852131_100016995436 [0,2,0,0,0,0|2,0,0]=4 12703 B18R2.253 C[C@H](OCc1cnccn1)c2ccc(cc2)Cl 7a_100011852131_100016995436 [0,2,0,0,0,0|2,0,0]=4 12704 B18R2.253 C[C@H](OCc1cncnc1)c2ccc(cc2)Cl 34a_100011852131_100015196519 [0,2,0,0,0,0|2,0,0]=4 12705 B18R2.253 C[C@H](OCc1cncnc1)c2ccc(cc2)Cl 7a_100011852131_100015196519 [0,2,0,0,0,0|2,0,0]=4 12706 B18R2.253 C[C@H](OCc1ncccn1)c2ccc(cc2)Cl 34a_100011852131_100000703007 [0,2,0,0,0,0|2,0,0]=4 12707 B18R2.253 C[C@H](OCc1ncccn1)c2ccc(cc2)Cl 7a_100011852131_100000703007 [0,2,0,0,0,0|2,0,0]=4 12708 B18R2.253 Cc1ccc(cc1)C(=O)CCc2ccccc2 1458a_100000188618_100000765856 [0,2,0,0,0,0|1,0,1]=4 12709 B18R2.253 Cc1ccc(cc1)C(=O)NCc2ccccc2 11a_100015324214_100000188618 [0,2,0,0,0,0|1,0,1]=4 12710 B18R2.253 Cc1ccc(cc1)C(=O)NCc2ccccc2 1626a_100015324214_100000188618 [0,2,0,0,0,0|1,0,1]=4 12711 B18R2.253 Cc1ccc(cc1)C(=O)NCc2ccccc2 240690a_100015324214_100000188618 [0,2,0,0,0,0|1,0,1]=4 12712 B18R2.253 Cc1ccc(cc1)C(=O)NCc2ccccc2 527a_100015324214_100000188618 [0,2,0,0,0,0|1,0,1]=4 12713 B18R2.253 Cc1ccc(cc1)C(C)NCc2ccccc2 2230a_100015324214_100011261388 [0,2,0,0,0,0|1,0,0]=3 12714 B18R2.253 Cc1ccc(cc1)C(C)NCc2ccccc2 269862a_100015324214_100000185793 [0,2,0,0,0,0|1,0,0]=3 12715 B18R2.253 Cc1ccc(cc1)C(C)NCc2ccccc2 34a_100015324214_100011261388 [0,2,0,0,0,0|1,0,0]=3 12716 B18R2.253 Cc1ccc(cc1)C(C)NCc2cccnc2 269862a_100000210453_100000185793 [0,2,0,0,0,0|2,0,0]=4 12717 B18R2.253 Cc1ccc(cc1)C(C)NCc2ccncc2 269862a_100000210450_100000185793 [0,2,0,0,0,0|2,0,0]=4 12718 B18R2.253 Cc1ccc(cc1)C(C)OCc2ccccc2 34a_100000210790_100011261388 [0,2,0,0,0,0|0,0,0]=2 12719 B18R2.253 Cc1ccc(cc1)C(C)OCc2ccccc2 7a_100000210790_100011261388 [0,2,0,0,0,0|0,0,0]=2 12720 B18R2.253 Cc1ccc(cc1)C(C)SCc2ccccc2 62a_100000211182_100011261388 [0,2,0,0,0,0|0,1,0]=3 12721 B18R2.253 Cc1ccc(cc1)C(C)SCc2ccccc2 62a_100011261388_100015291786 [0,2,0,0,0,0|0,1,0]=3 12722 B18R2.253 Cc1ccc(cc1)C(C)SCc2ccccn2 62a_100000721315_100011261388 [0,2,0,0,0,0|1,1,0]=4 12723 B18R2.253 Cc1ccc(cc1)C(C)SCc2ccccn2 62a_100011261388_100000721315 [0,2,0,0,0,0|1,1,0]=4 12724 B18R2.253 Cc1ccc(cc1)C(C)SCc2cccnc2 62a_100000741622_100011261388 [0,2,0,0,0,0|1,1,0]=4 12725 B18R2.253 Cc1ccc(cc1)C(C)SCc2cccnc2 62a_100011261388_100000741622 [0,2,0,0,0,0|1,1,0]=4 12726 B18R2.253 Cc1ccc(cc1)C(C)SCc2ccncc2 62a_100011261388_100015193705 [0,2,0,0,0,0|1,1,0]=4 12727 B18R2.253 Cc1ccc(cc1)C(C)SCc2ccncc2 62a_100015193705_100011261388 [0,2,0,0,0,0|1,1,0]=4 12728 B18R2.253 Cc1ccc(cc1)N(C)CCc2ccccc2 2230a_100000219977_100000765856 [0,2,0,0,0,0|2,0,0]=4 12729 B18R2.253 Cc1ccc(cc1)N(C)CCc2ccccc2 269982a_100000219977_100000765856 [0,2,0,0,0,0|2,0,0]=4 12730 B18R2.253 Cc1ccc(cc1)N(C)CCc2ccccc2 34a_100000219977_100000765856 [0,2,0,0,0,0|2,0,0]=4 12731 B18R2.253 Cc1ccc(cc1)[C@@H](C)NCc2ccccc2 207a_100016988085_100015611070 [0,2,0,0,0,0|1,0,0]=3 12732 B18R2.253 Cc1ccc(cc1)[C@@H](C)NCc2ccccc2 2230a_100016988085_100015291786 [0,2,0,0,0,0|1,0,0]=3 12733 B18R2.253 Cc1ccc(cc1)[C@@H](C)NCc2ccccc2 270004a_100016988085_100015611070 [0,2,0,0,0,0|1,0,0]=3 12734 B18R2.253 Cc1ccc(cc1)[C@@H](C)NCc2ccccc2 34a_100016988085_100015291786 [0,2,0,0,0,0|1,0,0]=3 12735 B18R2.253 Cc1ccc(cc1)[C@@H](C)NCc2ccccn2 207a_100016988085_100000209966 [0,2,0,0,0,0|2,0,0]=4 12736 B18R2.253 Cc1ccc(cc1)[C@@H](C)NCc2ccccn2 2230a_100016988085_100000721315 [0,2,0,0,0,0|2,0,0]=4 12737 B18R2.253 Cc1ccc(cc1)[C@@H](C)NCc2ccccn2 270004a_100016988085_100000209966 [0,2,0,0,0,0|2,0,0]=4 12738 B18R2.253 Cc1ccc(cc1)[C@@H](C)NCc2ccccn2 34a_100016988085_100000721315 [0,2,0,0,0,0|2,0,0]=4 12739 B18R2.253 Cc1ccc(cc1)[C@@H](C)NCc2cccnc2 207a_100016988085_100000209961 [0,2,0,0,0,0|2,0,0]=4 12740 B18R2.253 Cc1ccc(cc1)[C@@H](C)NCc2cccnc2 2230a_100016988085_100000741622 [0,2,0,0,0,0|2,0,0]=4 12741 B18R2.253 Cc1ccc(cc1)[C@@H](C)NCc2cccnc2 270004a_100016988085_100000209961 [0,2,0,0,0,0|2,0,0]=4 12742 B18R2.253 Cc1ccc(cc1)[C@@H](C)NCc2cccnc2 34a_100016988085_100000733263 [0,2,0,0,0,0|2,0,0]=4 12743 B18R2.253 Cc1ccc(cc1)[C@@H](C)NCc2ccncc2 207a_100016988085_100000186114 [0,2,0,0,0,0|2,0,0]=4 12744 B18R2.253 Cc1ccc(cc1)[C@@H](C)NCc2ccncc2 2230a_100016988085_100015193705 [0,2,0,0,0,0|2,0,0]=4 12745 B18R2.253 Cc1ccc(cc1)[C@@H](C)OCc2ccccc2 34a_100000690690_100015291786 [0,2,0,0,0,0|0,0,0]=2 12746 B18R2.253 Cc1ccc(cc1)[C@@H](C)OCc2ccccc2 7a_100000690690_100000211182 [0,2,0,0,0,0|0,0,0]=2 12747 B18R2.253 Cc1ccc(cc1)[C@@H](C)OCc2ccccn2 34a_100000690690_100000721315 [0,2,0,0,0,0|1,0,0]=3 12748 B18R2.253 Cc1ccc(cc1)[C@@H](C)OCc2ccccn2 7a_100000690690_100000721315 [0,2,0,0,0,0|1,0,0]=3 12749 B18R2.253 Cc1ccc(cc1)[C@@H](C)OCc2cccnc2 34a_100000690690_100000733263 [0,2,0,0,0,0|1,0,0]=3 12750 B18R2.253 Cc1ccc(cc1)[C@@H](C)OCc2cccnc2 7a_100000690690_100000741622 [0,2,0,0,0,0|1,0,0]=3 12751 B18R2.253 Cc1ccc(cc1)[C@@H](C)OCc2cccnn2 34a_100000690690_100016990269 [0,2,0,0,0,0|2,0,0]=4 12752 B18R2.253 Cc1ccc(cc1)[C@@H](C)OCc2cccnn2 7a_100000690690_100016990269 [0,2,0,0,0,0|2,0,0]=4 12753 B18R2.253 Cc1ccc(cc1)[C@@H](C)OCc2ccncc2 7a_100000690690_100015193705 [0,2,0,0,0,0|1,0,0]=3 12754 B18R2.253 Cc1ccc(cc1)[C@@H](C)OCc2cnccn2 34a_100000690690_100016995436 [0,2,0,0,0,0|2,0,0]=4 12755 B18R2.253 Cc1ccc(cc1)[C@@H](C)OCc2cnccn2 7a_100000690690_100016995436 [0,2,0,0,0,0|2,0,0]=4 12756 B18R2.253 Cc1ccc(cc1)[C@@H](C)OCc2cncnc2 34a_100000690690_100015196519 [0,2,0,0,0,0|2,0,0]=4 12757 B18R2.253 Cc1ccc(cc1)[C@@H](C)OCc2cncnc2 7a_100000690690_100015196519 [0,2,0,0,0,0|2,0,0]=4 12758 B18R2.253 Cc1ccc(cc1)[C@@H](C)OCc2ncccn2 34a_100000690690_100000703007 [0,2,0,0,0,0|2,0,0]=4 12759 B18R2.253 Cc1ccc(cc1)[C@@H](C)OCc2ncccn2 7a_100000690690_100000703007 [0,2,0,0,0,0|2,0,0]=4 12760 B18R2.253 Cc1ccc(cn1)C(C)NCc2ccccc2 207a_100011815741_100015611070 [0,2,0,0,0,0|2,0,0]=4 12761 B18R2.253 Cc1ccc(cn1)C(C)NCc2ccccc2 2230a_100011815741_100015291786 [0,2,0,0,0,0|2,0,0]=4 12762 B18R2.253 Cc1ccc(cn1)C(C)NCc2ccccc2 269862a_100015324214_100011280547 [0,2,0,0,0,0|2,0,0]=4 12763 B18R2.253 Cc1ccc(cn1)C(C)NCc2ccccc2 270004a_100011815741_100015611070 [0,2,0,0,0,0|2,0,0]=4 12764 B18R2.253 Cc1ccc(cn1)C(C)NCc2ccccc2 34a_100011815741_100015291786 [0,2,0,0,0,0|2,0,0]=4 12765 B18R2.253 Cc1ccc(cn1)C(C)OCc2ccccc2 34a_200011815720_100015291786 [0,2,0,0,0,0|1,0,0]=3 12766 B18R2.253 Cc1ccc(cn1)C(C)OCc2ccccc2 7a_200011815720_100000211182 [0,2,0,0,0,0|1,0,0]=3 12767 B18R2.253 Cc1ccc(cn1)C(C)OCc2ccccn2 34a_200011815720_100000721315 [0,2,0,0,0,0|2,0,0]=4 12768 B18R2.253 Cc1ccc(cn1)C(C)OCc2ccccn2 7a_200011815720_100000721315 [0,2,0,0,0,0|2,0,0]=4 12769 B18R2.253 Cc1ccc(cn1)C(C)OCc2cccnc2 34a_200011815720_100000733263 [0,2,0,0,0,0|2,0,0]=4 12770 B18R2.253 Cc1ccc(cn1)C(C)OCc2cccnc2 7a_200011815720_100000741622 [0,2,0,0,0,0|2,0,0]=4 12771 B18R2.253 Cc1ccc(cn1)C(C)OCc2ccncc2 7a_200011815720_100015193705 [0,2,0,0,0,0|2,0,0]=4 12772 B18R2.253 Cc1ccc(nc1)C(C)NCc2ccccc2 269862a_100015324214_100000084104 [0,2,0,0,0,0|2,0,0]=4 12773 B18R2.253 Cc1ccc(nc1)C(C)NCc2ccccc2 270004a_100015324214_100000084104 [0,2,0,0,0,0|2,0,0]=4 12774 B18R2.253 O=C(CCc1ccccc1)c2ccc(cc2)Br 1458a_100000185839_100000765856 [0,2,0,0,0,0|1,0,1]=4 12775 B18R2.253 O=C(CCc1ccccc1)c2ccc(cc2)Cl 1458a_100000210187_100000765856 [0,2,0,0,0,0|1,0,1]=4 12776 B18R2.253 O=C(CCc1ccccc1)c2ccc(cc2)F 1458a_100000187176_100000765856 [0,2,0,0,0,0|1,0,1]=4 12777 B18R2.253 O=C(CCc1ccccc1)c2ccc(cc2)I 1458a_100000187904_100000765856 [0,2,0,0,0,0|1,0,1]=4 12778 B18R2.253 O=C(CCc1ccccc1)c2ccc(cc2)O 1458a_100000212099_100000765856 [0,2,0,0,0,0|1,0,1]=4 12779 B18R2.253 O=C(NCc1ccccc1)c2ccc(cc2)Br 11a_100015324214_100000185839 [0,2,0,0,0,0|1,0,1]=4 12780 B18R2.253 O=C(NCc1ccccc1)c2ccc(cc2)Br 1626a_100015324214_100000185839 [0,2,0,0,0,0|1,0,1]=4 12781 B18R2.253 O=C(NCc1ccccc1)c2ccc(cc2)Br 240690a_100015324214_100000185839 [0,2,0,0,0,0|1,0,1]=4 12782 B18R2.253 O=C(NCc1ccccc1)c2ccc(cc2)Br 527a_100015324214_100000185839 [0,2,0,0,0,0|1,0,1]=4 12783 B18R2.253 O=C(NCc1ccccc1)c2ccc(cc2)Cl 11a_100015324214_100000210187 [0,2,0,0,0,0|1,0,1]=4 12784 B18R2.253 O=C(NCc1ccccc1)c2ccc(cc2)Cl 1626a_100015324214_100000210187 [0,2,0,0,0,0|1,0,1]=4 12785 B18R2.253 O=C(NCc1ccccc1)c2ccc(cc2)Cl 240690a_100015324214_100000210187 [0,2,0,0,0,0|1,0,1]=4 12786 B18R2.253 O=C(NCc1ccccc1)c2ccc(cc2)Cl 527a_100015324214_100000210187 [0,2,0,0,0,0|1,0,1]=4 12787 B18R2.253 O=C(NCc1ccccc1)c2ccc(cc2)F 11a_100015324214_100000187176 [0,2,0,0,0,0|1,0,1]=4 12788 B18R2.253 O=C(NCc1ccccc1)c2ccc(cc2)F 1626a_100015324214_100000187176 [0,2,0,0,0,0|1,0,1]=4 12789 B18R2.253 O=C(NCc1ccccc1)c2ccc(cc2)F 240690a_100015324214_100000187176 [0,2,0,0,0,0|1,0,1]=4 12790 B18R2.253 O=C(NCc1ccccc1)c2ccc(cc2)F 527a_100015324214_100000187176 [0,2,0,0,0,0|1,0,1]=4 12791 B18R2.253 O=C(NCc1ccccc1)c2ccc(cc2)I 11a_100015324214_100000187904 [0,2,0,0,0,0|1,0,1]=4 12792 B18R2.253 O=C(NCc1ccccc1)c2ccc(cc2)I 1626a_100015324214_100000187904 [0,2,0,0,0,0|1,0,1]=4 12793 B18R2.253 O=C(NCc1ccccc1)c2ccc(cc2)I 240690a_100015324214_100000187904 [0,2,0,0,0,0|1,0,1]=4 12794 B18R2.253 O=C(NCc1ccccc1)c2ccc(cc2)I 527a_100015324214_100000187904 [0,2,0,0,0,0|1,0,1]=4 12795 B18R2.253 O=C(NCc1ccccc1)c2ccc(cc2)O 240690a_100015324214_100000212099 [0,2,0,0,0,0|1,0,1]=4 12796 B18R2.253 O=C(NCc1ccccc1)c2ccc(cc2)O 271570a_203496583355_200000153122 [0,2,0,0,0,0|1,0,1]=4 12797 B18R2.253 O=C(NCc1ccccc1)c2ccc(cc2)O 527a_100015324214_100000212099 [0,2,0,0,0,0|1,0,1]=4 12798 B18R2.253 O=C(OCc1ccccc1)c2ccc(cc2)O 271570a_203496583355_100000000856 [0,2,0,0,0,0|0,0,1]=3 12799 B18R2.253 O=C(OCc1ccccc1)c2ccc(cn2)O 271570a_203496583355_100009815727 [0,2,0,0,0,0|1,0,1]=4 12800 B18R2.253 OC(CNc1ccccc1)c2ccc(cc2)Cl 34a_100000106764_200011996143 [0,2,0,0,0,0|2,0,0]=4 12801 B18R2.253 OC(COc1ccccc1)c2ccc(cc2)Cl 34a_100000210340_200011996143 [0,2,0,0,0,0|2,0,0]=4 12802 B18R2.253 OC(COc1ccccc1)c2ccc(cc2)Cl 7a_100000210340_200011996143 [0,2,0,0,0,0|2,0,0]=4 12803 B18R2.253 OC(CSc1ccccc1)c2ccc(cc2)Cl 62a_100000719477_200011996143 [0,2,0,0,0,0|2,0,0]=4 12804 B18R2.253 OC(CSc1ccccc1)c2ccc(cc2)Cl 62a_200011996143_100000041952 [0,2,0,0,0,0|2,0,0]=4 12805 B18R2.253 O[C@@H](CNc1ccccc1)c2ccc(cc2)F 34a_100000106764_100000720402 [0,2,0,0,0,0|2,0,0]=4 12806 B18R2.253 O[C@@H](COc1ccccc1)c2ccc(cc2)F 34a_100000210340_100000720402 [0,2,0,0,0,0|2,0,0]=4 12807 B18R2.253 O[C@@H](COc1ccccc1)c2ccc(cc2)F 7a_100000210340_100000720402 [0,2,0,0,0,0|2,0,0]=4 12808 B18R2.253 O[C@@H](CSc1ccccc1)c2ccc(cc2)F 62a_100000719477_100000720402 [0,2,0,0,0,0|2,0,0]=4 12809 B18R2.253 O[C@@H](CSc1ccccc1)c2ccc(cc2)F 62a_100000720402_100000041952 [0,2,0,0,0,0|2,0,0]=4 12810 B18R2.253 [2H]C(OCc1ccccc1)c2ccc(cc2)F 34a_217856618577_100015291786 [0,2,0,0,0,0|0,0,0]=2 12811 B18R2.253 [2H]C(OCc1ccccc1)c2ccc(cc2)F 7a_217856618577_100000211182 [0,2,0,0,0,0|0,0,0]=2 12812 B18R2.253 [2H]C(OCc1ccccn1)c2ccc(cc2)F 34a_217856618577_100000721315 [0,2,0,0,0,0|1,0,0]=3 12813 B18R2.253 [2H]C(OCc1ccccn1)c2ccc(cc2)F 7a_217856618577_100000721315 [0,2,0,0,0,0|1,0,0]=3 12814 B18R2.253 [2H]C(OCc1cccnc1)c2ccc(cc2)F 34a_217856618577_100000733263 [0,2,0,0,0,0|1,0,0]=3 12815 B18R2.253 [2H]C(OCc1cccnc1)c2ccc(cc2)F 7a_217856618577_100000741622 [0,2,0,0,0,0|1,0,0]=3 12816 B18R2.253 [2H]C(OCc1cccnn1)c2ccc(cc2)F 34a_217856618577_100016990269 [0,2,0,0,0,0|2,0,0]=4 12817 B18R2.253 [2H]C(OCc1cccnn1)c2ccc(cc2)F 7a_217856618577_100016990269 [0,2,0,0,0,0|2,0,0]=4 12818 B18R2.253 [2H]C(OCc1ccncc1)c2ccc(cc2)F 7a_217856618577_100015193705 [0,2,0,0,0,0|1,0,0]=3 12819 B18R2.253 [2H]C(OCc1cnccn1)c2ccc(cc2)F 34a_217856618577_100016995436 [0,2,0,0,0,0|2,0,0]=4 12820 B18R2.253 [2H]C(OCc1cnccn1)c2ccc(cc2)F 7a_217856618577_100016995436 [0,2,0,0,0,0|2,0,0]=4 12821 B18R2.253 [2H]C(OCc1cncnc1)c2ccc(cc2)F 34a_217856618577_100015196519 [0,2,0,0,0,0|2,0,0]=4 12822 B18R2.253 [2H]C(OCc1cncnc1)c2ccc(cc2)F 7a_217856618577_100015196519 [0,2,0,0,0,0|2,0,0]=4 12823 B18R2.253 [2H]C(OCc1ncccn1)c2ccc(cc2)F 34a_217856618577_100000703007 [0,2,0,0,0,0|2,0,0]=4 12824 B18R2.253 [2H]C(OCc1ncccn1)c2ccc(cc2)F 7a_217856618577_100000703007 [0,2,0,0,0,0|2,0,0]=4 12825 B18R2.257 CC(CNc1ccc(cc1)Br)c2ccccc2 2230a_100000210018_100000756946 [0,2,0,0,0,0|2,0,0]=4 12826 B18R2.257 CC(CNc1ccc(cc1)Br)c2ccccc2 34a_100000210018_100000756946 [0,2,0,0,0,0|2,0,0]=4 12827 B18R2.257 CC(CNc1ccc(cc1)Cl)c2ccccc2 2230a_100000210052_100000756946 [0,2,0,0,0,0|2,0,0]=4 12828 B18R2.257 CC(CNc1ccc(cc1)Cl)c2ccccc2 34a_100000210052_100000756946 [0,2,0,0,0,0|2,0,0]=4 12829 B18R2.257 CC(CNc1ccc(cc1)F)c2ccccc2 34a_100000185862_100000756946 [0,2,0,0,0,0|2,0,0]=4 12830 B18R2.257 CC(CNc1ccc(cc1)I)c2ccccc2 34a_100000185761_100000756946 [0,2,0,0,0,0|2,0,0]=4 12831 B18R2.257 CC(CNc1ccc(cc1)O)c2ccccc2 34a_100000185829_100000756946 [0,2,0,0,0,0|2,0,0]=4 12832 B18R2.257 CC(COc1ccc(cc1)Br)c2ccccc2 34a_100000185759_100000756946 [0,2,0,0,0,0|2,0,0]=4 12833 B18R2.257 CC(COc1ccc(cc1)Br)c2ccccc2 7a_100000185759_100000756946 [0,2,0,0,0,0|2,0,0]=4 12834 B18R2.257 CC(COc1ccc(cc1)Cl)c2ccccc2 34a_100000210216_100000756946 [0,2,0,0,0,0|2,0,0]=4 12835 B18R2.257 CC(COc1ccc(cc1)Cl)c2ccccc2 7a_100000210216_100000756946 [0,2,0,0,0,0|2,0,0]=4 12836 B18R2.257 CC(COc1ccc(cc1)F)c2ccccc2 34a_100000210339_100000756946 [0,2,0,0,0,0|2,0,0]=4 12837 B18R2.257 CC(COc1ccc(cc1)I)c2ccccc2 34a_100000212066_100000756946 [0,2,0,0,0,0|2,0,0]=4 12838 B18R2.257 CC(COc1ccc(cc1)I)c2ccccc2 7a_100000212066_100000756946 [0,2,0,0,0,0|2,0,0]=4 12839 B18R2.257 CC(COc1ccc(cc1)N)c2ccccc2 34a_100000185829_100000756946 [0,2,0,0,0,0|2,0,0]=4 12840 B18R2.257 CC(CSc1ccc(cc1)Br)c2ccccc2 62a_100000752885_100000756946 [0,2,0,0,0,0|2,0,0]=4 12841 B18R2.257 CC(CSc1ccc(cc1)Br)c2ccccc2 62a_100000756946_100000752885 [0,2,0,0,0,0|2,0,0]=4 12842 B18R2.257 CC(CSc1ccc(cc1)Cl)c2ccccc2 62a_100000755918_100000756946 [0,2,0,0,0,0|2,0,0]=4 12843 B18R2.257 CC(CSc1ccc(cc1)Cl)c2ccccc2 62a_100000756946_100000755918 [0,2,0,0,0,0|2,0,0]=4 12844 B18R2.257 CC(CSc1ccc(cc1)F)c2ccccc2 62a_100000211213_100000756946 [0,2,0,0,0,0|2,0,0]=4 12845 B18R2.257 CC(CSc1ccc(cc1)F)c2ccccc2 62a_100000756946_100000211213 [0,2,0,0,0,0|2,0,0]=4 12846 B18R2.257 CC(CSc1ccc(cc1)N)c2ccccc2 62a_100000185761_100000756946 [0,2,0,0,0,0|2,0,0]=4 12847 B18R2.257 CC(CSc1ccc(cc1)N)c2ccccc2 62a_100000756946_100000185761 [0,2,0,0,0,0|2,0,0]=4 12848 B18R2.257 CC(CSc1ccc(cc1)O)c2ccccc2 62a_100000756946_100000185759 [0,2,0,0,0,0|2,0,0]=4 12849 B18R2.257 CC(NCc1ccc(cc1)Br)c2ccccc2 2230a_100000174875_100000230085 [0,2,0,0,0,0|1,0,0]=3 12850 B18R2.257 CC(NCc1ccc(cc1)Br)c2ccccc2 269862a_100000174875_100000185851 [0,2,0,0,0,0|1,0,0]=3 12851 B18R2.257 CC(NCc1ccc(cc1)Br)c2ccccc2 34a_100000174875_100000211855 [0,2,0,0,0,0|1,0,0]=3 12852 B18R2.257 CC(NCc1ccc(cc1)Br)c2ccccn2 207a_100000181244_100000186029 [0,2,0,0,0,0|2,0,0]=4 12853 B18R2.257 CC(NCc1ccc(cc1)Br)c2ccccn2 2230a_100000181244_100011217064 [0,2,0,0,0,0|2,0,0]=4 12854 B18R2.257 CC(NCc1ccc(cc1)Br)c2ccccn2 269862a_100000174875_100000210467 [0,2,0,0,0,0|2,0,0]=4 12855 B18R2.257 CC(NCc1ccc(cc1)Br)c2ccccn2 270004a_100000181244_100000186029 [0,2,0,0,0,0|2,0,0]=4 12856 B18R2.257 CC(NCc1ccc(cc1)Br)c2cccnc2 207a_100000195435_100000186029 [0,2,0,0,0,0|2,0,0]=4 12857 B18R2.257 CC(NCc1ccc(cc1)Br)c2cccnc2 2230a_100000195435_100011217064 [0,2,0,0,0,0|2,0,0]=4 12858 B18R2.257 CC(NCc1ccc(cc1)Br)c2cccnc2 269862a_100000174875_100000210468 [0,2,0,0,0,0|2,0,0]=4 12859 B18R2.257 CC(NCc1ccc(cc1)Br)c2cccnc2 270004a_100000195435_100000186029 [0,2,0,0,0,0|2,0,0]=4 12860 B18R2.257 CC(NCc1ccc(cc1)Br)c2ccncc2 207a_100000181269_100000186029 [0,2,0,0,0,0|2,0,0]=4 12861 B18R2.257 CC(NCc1ccc(cc1)Br)c2ccncc2 2230a_100000181269_100011217064 [0,2,0,0,0,0|2,0,0]=4 12862 B18R2.257 CC(NCc1ccc(cc1)Br)c2ccncc2 269862a_100000174875_100000185792 [0,2,0,0,0,0|2,0,0]=4 12863 B18R2.257 CC(NCc1ccc(cc1)Br)c2ccncc2 270004a_100000181269_100000186029 [0,2,0,0,0,0|2,0,0]=4 12864 B18R2.257 CC(NCc1ccc(cc1)Cl)c2ccccc2 2230a_100000174871_100000230085 [0,2,0,0,0,0|1,0,0]=3 12865 B18R2.257 CC(NCc1ccc(cc1)Cl)c2ccccc2 269862a_100000174871_100000185851 [0,2,0,0,0,0|1,0,0]=3 12866 B18R2.257 CC(NCc1ccc(cc1)Cl)c2ccccc2 34a_100000174871_100000211855 [0,2,0,0,0,0|1,0,0]=3 12867 B18R2.257 CC(NCc1ccc(cc1)Cl)c2ccccn2 207a_100000181244_100000189385 [0,2,0,0,0,0|2,0,0]=4 12868 B18R2.257 CC(NCc1ccc(cc1)Cl)c2ccccn2 2230a_100000181244_100000694040 [0,2,0,0,0,0|2,0,0]=4 12869 B18R2.257 CC(NCc1ccc(cc1)Cl)c2ccccn2 269862a_100000174871_100000210467 [0,2,0,0,0,0|2,0,0]=4 12870 B18R2.257 CC(NCc1ccc(cc1)Cl)c2ccccn2 270004a_100000181244_100000189385 [0,2,0,0,0,0|2,0,0]=4 12871 B18R2.257 CC(NCc1ccc(cc1)Cl)c2cccnc2 207a_100000195435_100000189385 [0,2,0,0,0,0|2,0,0]=4 12872 B18R2.257 CC(NCc1ccc(cc1)Cl)c2cccnc2 2230a_100000195435_100000694040 [0,2,0,0,0,0|2,0,0]=4 12873 B18R2.257 CC(NCc1ccc(cc1)Cl)c2cccnc2 269862a_100000174871_100000210468 [0,2,0,0,0,0|2,0,0]=4 12874 B18R2.257 CC(NCc1ccc(cc1)Cl)c2cccnc2 270004a_100000195435_100000189385 [0,2,0,0,0,0|2,0,0]=4 12875 B18R2.257 CC(NCc1ccc(cc1)Cl)c2ccncc2 207a_100000181269_100000189385 [0,2,0,0,0,0|2,0,0]=4 12876 B18R2.257 CC(NCc1ccc(cc1)Cl)c2ccncc2 2230a_100000181269_100000694040 [0,2,0,0,0,0|2,0,0]=4 12877 B18R2.257 CC(NCc1ccc(cc1)Cl)c2ccncc2 269862a_100000174871_100000185792 [0,2,0,0,0,0|2,0,0]=4 12878 B18R2.257 CC(NCc1ccc(cc1)Cl)c2ccncc2 270004a_100000181269_100000189385 [0,2,0,0,0,0|2,0,0]=4 12879 B18R2.257 CC(NCc1ccc(cc1)F)c2ccccc2 2230a_100000174882_100000230085 [0,2,0,0,0,0|1,0,0]=3 12880 B18R2.257 CC(NCc1ccc(cc1)F)c2ccccc2 269862a_100000174882_100000185851 [0,2,0,0,0,0|1,0,0]=3 12881 B18R2.257 CC(NCc1ccc(cc1)F)c2ccccc2 34a_100000174882_100000211855 [0,2,0,0,0,0|1,0,0]=3 12882 B18R2.257 CC(NCc1ccc(cc1)F)c2ccccn2 207a_100000181244_100000210084 [0,2,0,0,0,0|2,0,0]=4 12883 B18R2.257 CC(NCc1ccc(cc1)F)c2ccccn2 2230a_100000181244_100000198546 [0,2,0,0,0,0|2,0,0]=4 12884 B18R2.257 CC(NCc1ccc(cc1)F)c2ccccn2 269862a_100000174882_100000210467 [0,2,0,0,0,0|2,0,0]=4 12885 B18R2.257 CC(NCc1ccc(cc1)F)c2ccccn2 270004a_100000181244_100000210084 [0,2,0,0,0,0|2,0,0]=4 12886 B18R2.257 CC(NCc1ccc(cc1)F)c2cccnc2 207a_100000195435_100000210084 [0,2,0,0,0,0|2,0,0]=4 12887 B18R2.257 CC(NCc1ccc(cc1)F)c2cccnc2 2230a_100000195435_100000198546 [0,2,0,0,0,0|2,0,0]=4 12888 B18R2.257 CC(NCc1ccc(cc1)F)c2cccnc2 269862a_100000174882_100000210468 [0,2,0,0,0,0|2,0,0]=4 12889 B18R2.257 CC(NCc1ccc(cc1)F)c2cccnc2 270004a_100000195435_100000210084 [0,2,0,0,0,0|2,0,0]=4 12890 B18R2.257 CC(NCc1ccc(cc1)F)c2ccncc2 207a_100000181269_100000210084 [0,2,0,0,0,0|2,0,0]=4 12891 B18R2.257 CC(NCc1ccc(cc1)F)c2ccncc2 2230a_100000181269_100000198546 [0,2,0,0,0,0|2,0,0]=4 12892 B18R2.257 CC(NCc1ccc(cc1)F)c2ccncc2 269862a_100000174882_100000185792 [0,2,0,0,0,0|2,0,0]=4 12893 B18R2.257 CC(NCc1ccc(cc1)F)c2ccncc2 270004a_100000181269_100000210084 [0,2,0,0,0,0|2,0,0]=4 12894 B18R2.257 CC(NCc1ccc(cc1)I)c2ccccc2 2230a_100016989417_100000230085 [0,2,0,0,0,0|1,0,0]=3 12895 B18R2.257 CC(NCc1ccc(cc1)I)c2ccccc2 269862a_100016989417_100000185851 [0,2,0,0,0,0|1,0,0]=3 12896 B18R2.257 CC(NCc1ccc(cc1)I)c2ccccc2 34a_100016989417_100000211855 [0,2,0,0,0,0|1,0,0]=3 12897 B18R2.257 CC(NCc1ccc(cc1)I)c2ccccn2 207a_100000181244_100000188517 [0,2,0,0,0,0|2,0,0]=4 12898 B18R2.257 CC(NCc1ccc(cc1)I)c2ccccn2 2230a_100000181244_100000189116 [0,2,0,0,0,0|2,0,0]=4 12899 B18R2.257 CC(NCc1ccc(cc1)I)c2ccccn2 269862a_100016989417_100000210467 [0,2,0,0,0,0|2,0,0]=4 12900 B18R2.257 CC(NCc1ccc(cc1)I)c2cccnc2 207a_100000195435_100000188517 [0,2,0,0,0,0|2,0,0]=4 12901 B18R2.257 CC(NCc1ccc(cc1)I)c2cccnc2 2230a_100000195435_100000189116 [0,2,0,0,0,0|2,0,0]=4 12902 B18R2.257 CC(NCc1ccc(cc1)I)c2cccnc2 269862a_100016989417_100000210468 [0,2,0,0,0,0|2,0,0]=4 12903 B18R2.257 CC(NCc1ccc(cc1)I)c2ccncc2 207a_100000181269_100000188517 [0,2,0,0,0,0|2,0,0]=4 12904 B18R2.257 CC(NCc1ccc(cc1)I)c2ccncc2 2230a_100000181269_100000189116 [0,2,0,0,0,0|2,0,0]=4 12905 B18R2.257 CC(NCc1ccc(cc1)I)c2ccncc2 269862a_100016989417_100000185792 [0,2,0,0,0,0|2,0,0]=4 12906 B18R2.257 CC(NCc1ccc(cc1)O)c2ccccc2 34a_100000185549_100000211855 [0,2,0,0,0,0|1,0,0]=3 12907 B18R2.257 CC(NCc1ccc(cn1)Br)c2ccccc2 34a_100015188789_100000211855 [0,2,0,0,0,0|2,0,0]=4 12908 B18R2.257 CC(NCc1ccc(cn1)Cl)c2ccccc2 269862a_100000697193_100000185851 [0,2,0,0,0,0|2,0,0]=4 12909 B18R2.257 CC(NCc1ccc(cn1)Cl)c2ccccc2 34a_100000697193_100000211855 [0,2,0,0,0,0|2,0,0]=4 12910 B18R2.257 CC(NCc1ccc(cn1)F)c2ccccc2 34a_100020620131_100000211855 [0,2,0,0,0,0|2,0,0]=4 12911 B18R2.257 CC(NCc1ccc(nc1)Br)c2ccccc2 2230a_100009817727_100000230085 [0,2,0,0,0,0|2,0,0]=4 12912 B18R2.257 CC(NCc1ccc(nc1)Br)c2ccccc2 269862a_100009817727_100000185851 [0,2,0,0,0,0|2,0,0]=4 12913 B18R2.257 CC(NCc1ccc(nc1)Br)c2ccccc2 34a_100009817727_100000211855 [0,2,0,0,0,0|2,0,0]=4 12914 B18R2.257 CC(NCc1ccc(nc1)Cl)c2ccccc2 2230a_100000735879_100000230085 [0,2,0,0,0,0|2,0,0]=4 12915 B18R2.257 CC(NCc1ccc(nc1)Cl)c2ccccc2 269862a_100000735879_100000185851 [0,2,0,0,0,0|2,0,0]=4 12916 B18R2.257 CC(NCc1ccc(nc1)Cl)c2ccccc2 34a_100000735879_100000211855 [0,2,0,0,0,0|2,0,0]=4 12917 B18R2.257 CC(NCc1ccc(nc1)F)c2ccccc2 2230a_100000101913_100000230085 [0,2,0,0,0,0|2,0,0]=4 12918 B18R2.257 CC(NCc1ccc(nc1)F)c2ccccc2 269862a_100000101913_100000185851 [0,2,0,0,0,0|2,0,0]=4 12919 B18R2.257 CC(NCc1ccc(nc1)F)c2ccccc2 34a_100000101913_100000211855 [0,2,0,0,0,0|2,0,0]=4 12920 B18R2.257 CC(NCc1ccc(nc1)O)c2ccccc2 2230a_100000757128_100000230085 [0,2,0,0,0,0|2,0,0]=4 12921 B18R2.257 CC(OCc1cc[n+](cc1)C)c2ccccc2 34a_100009831711_100000211855 [0,2,0,0,0,0|1,0,0]=3 12922 B18R2.257 CC(OCc1cc[n+](cc1)[O-])c2ccccc2 34a_100000031831_100000211855 [0,2,0,0,0,0|1,0,0]=3 12923 B18R2.257 CC(OCc1cc[n+](cc1)[O-])c2ccccc2 7a_100000031831_100000230085 [0,2,0,0,0,0|1,0,0]=3 12924 B18R2.257 CC(OCc1ccc(=O)[nH]c1)c2ccccc2 34a_100011999846_100000211855 [0,2,0,0,0,0|1,0,0]=3 12925 B18R2.257 CC(OCc1ccc(cc1)Br)c2ccccc2 34a_100000695286_100000211855 [0,2,0,0,0,0|0,0,0]=2 12926 B18R2.257 CC(OCc1ccc(cc1)Cl)c2ccccc2 34a_100000211118_100000211855 [0,2,0,0,0,0|0,0,0]=2 12927 B18R2.257 CC(OCc1ccc(cc1)Cl)c2ccccc2 7a_100000211118_100000230085 [0,2,0,0,0,0|0,0,0]=2 12928 B18R2.257 CC(OCc1ccc(cc1)Cl)c2cnccn2 7a_100000211118_200000703233 [0,2,0,0,0,0|2,0,0]=4 12929 B18R2.257 CC(OCc1ccc(cc1)F)c2ccccc2 34a_100000210977_100000211855 [0,2,0,0,0,0|0,0,0]=2 12930 B18R2.257 CC(OCc1ccc(cc1)F)c2ccccc2 7a_100000210977_100000230085 [0,2,0,0,0,0|0,0,0]=2 12931 B18R2.257 CC(OCc1ccc(cc1)F)c2cnccn2 7a_100000210977_200000703233 [0,2,0,0,0,0|2,0,0]=4 12932 B18R2.257 CC(OCc1ccc(cc1)I)c2ccccc2 34a_100000690907_100000211855 [0,2,0,0,0,0|0,0,0]=2 12933 B18R2.257 CC(OCc1ccc(cc1)I)c2ccccc2 7a_100000690907_100000230085 [0,2,0,0,0,0|0,0,0]=2 12934 B18R2.257 CC(OCc1ccc(cc1)I)c2cnccn2 7a_100000690907_200000703233 [0,2,0,0,0,0|2,0,0]=4 12935 B18R2.257 CC(OCc1ccc(cc1)N)c2ccccc2 34a_100011215238_100000211855 [0,2,0,0,0,0|0,0,0]=2 12936 B18R2.257 CC(OCc1ccc(cn1)Br)c2ccccc2 34a_100000754261_100000211855 [0,2,0,0,0,0|1,0,0]=3 12937 B18R2.257 CC(OCc1ccc(cn1)Cl)c2ccccc2 34a_100000703999_100000211855 [0,2,0,0,0,0|1,0,0]=3 12938 B18R2.257 CC(OCc1ccc(cn1)F)c2ccccc2 34a_100011999454_100000211855 [0,2,0,0,0,0|1,0,0]=3 12939 B18R2.257 CC(OCc1ccc(cn1)N)c2ccccc2 34a_100011998161_100000211855 [0,2,0,0,0,0|1,0,0]=3 12940 B18R2.257 CC(OCc1ccc(nc1)Br)c2ccccc2 34a_100009816760_100000211855 [0,2,0,0,0,0|1,0,0]=3 12941 B18R2.257 CC(OCc1ccc(nc1)Br)c2ccccc2 7a_100009816760_100000230085 [0,2,0,0,0,0|1,0,0]=3 12942 B18R2.257 CC(OCc1ccc(nc1)Cl)c2ccccc2 34a_100000755211_100000211855 [0,2,0,0,0,0|1,0,0]=3 12943 B18R2.257 CC(OCc1ccc(nc1)Cl)c2ccccc2 7a_100000755211_100000230085 [0,2,0,0,0,0|1,0,0]=3 12944 B18R2.257 CC(OCc1ccc(nc1)F)c2ccccc2 34a_100000079959_100000211855 [0,2,0,0,0,0|1,0,0]=3 12945 B18R2.257 CC(OCc1ccc(nc1)N)c2ccccc2 34a_100000704267_100000211855 [0,2,0,0,0,0|1,0,0]=3 12946 B18R2.257 CC(OCc1cnc(cn1)Cl)c2ccccc2 34a_100012002382_100000211855 [0,2,0,0,0,0|2,0,0]=4 12947 B18R2.257 CC(OCc1cnc(nc1)Cl)c2ccccc2 34a_100009855073_100000211855 [0,2,0,0,0,0|2,0,0]=4 12948 B18R2.257 CC(OCc1cnc(nc1)Cl)c2ccccc2 7a_100009855073_100000230085 [0,2,0,0,0,0|2,0,0]=4 12949 B18R2.257 CC(SCc1ccc(cc1)Br)c2ccccc2 62a_100000189115_100000230085 [0,2,0,0,0,0|0,1,0]=3 12950 B18R2.257 CC(SCc1ccc(cc1)Br)c2ccccc2 62a_100000230085_100000189115 [0,2,0,0,0,0|0,1,0]=3 12951 B18R2.257 CC(SCc1ccc(cc1)Cl)c2ccccc2 62a_100000187161_100000230085 [0,2,0,0,0,0|0,1,0]=3 12952 B18R2.257 CC(SCc1ccc(cc1)Cl)c2ccccc2 62a_100000230085_100000187161 [0,2,0,0,0,0|0,1,0]=3 12953 B18R2.257 CC(SCc1ccc(cc1)F)c2ccccc2 62a_100000198546_100000230085 [0,2,0,0,0,0|0,1,0]=3 12954 B18R2.257 CC(SCc1ccc(cc1)F)c2ccccc2 62a_100000230085_100000187164 [0,2,0,0,0,0|0,1,0]=3 12955 B18R2.257 CC(SCc1ccc(cc1)I)c2ccccc2 62a_100000189116_100000230085 [0,2,0,0,0,0|0,1,0]=3 12956 B18R2.257 CC(SCc1ccc(cc1)I)c2ccccc2 62a_100000230085_100000189116 [0,2,0,0,0,0|0,1,0]=3 12957 B18R2.257 CC(SCc1ccc(cn1)Br)c2ccccc2 62a_100000230085_100000702658 [0,2,0,0,0,0|1,1,0]=4 12958 B18R2.257 CC(SCc1ccc(cn1)Br)c2ccccc2 62a_100000702658_100000230085 [0,2,0,0,0,0|1,1,0]=4 12959 B18R2.257 CC(SCc1ccc(cn1)Cl)c2ccccc2 62a_100000230085_100000697101 [0,2,0,0,0,0|1,1,0]=4 12960 B18R2.257 CC(SCc1ccc(cn1)Cl)c2ccccc2 62a_100012066911_100000230085 [0,2,0,0,0,0|1,1,0]=4 12961 B18R2.257 CC(SCc1ccc(cn1)F)c2ccccc2 62a_100000230085_100000703193 [0,2,0,0,0,0|1,1,0]=4 12962 B18R2.257 CC(SCc1ccc(cn1)F)c2ccccc2 62a_100000703193_100000230085 [0,2,0,0,0,0|1,1,0]=4 12963 B18R2.257 CC(SCc1ccc(nc1)Br)c2ccccc2 62a_100000230085_100009831999 [0,2,0,0,0,0|1,1,0]=4 12964 B18R2.257 CC(SCc1ccc(nc1)Br)c2ccccc2 62a_100009831999_100000230085 [0,2,0,0,0,0|1,1,0]=4 12965 B18R2.257 CC(SCc1ccc(nc1)Cl)c2ccccc2 62a_100000230085_100000735431 [0,2,0,0,0,0|1,1,0]=4 12966 B18R2.257 CC(SCc1ccc(nc1)Cl)c2ccccc2 62a_100000735431_100000230085 [0,2,0,0,0,0|1,1,0]=4 12967 B18R2.257 CC(SCc1ccc(nc1)F)c2ccccc2 62a_100000230085_100000099788 [0,2,0,0,0,0|1,1,0]=4 12968 B18R2.257 CC(SCc1ccc(nc1)F)c2ccccc2 62a_100009820150_100000230085 [0,2,0,0,0,0|1,1,0]=4 12969 B18R2.257 CN(CCc1ccc(cc1)Br)c2ccccc2 2230a_100000210012_100011740612 [0,2,0,0,0,0|2,0,0]=4 12970 B18R2.257 CN(CCc1ccc(cc1)Br)c2ccccc2 269982a_100000210012_100011740612 [0,2,0,0,0,0|2,0,0]=4 12971 B18R2.257 CN(CCc1ccc(cc1)Br)c2ccccc2 34a_100000210012_100011740612 [0,2,0,0,0,0|2,0,0]=4 12972 B18R2.257 CN(CCc1ccc(cc1)Cl)c2ccccc2 2230a_100000210012_100011713675 [0,2,0,0,0,0|2,0,0]=4 12973 B18R2.257 CN(CCc1ccc(cc1)Cl)c2ccccc2 269982a_100000210012_100011713675 [0,2,0,0,0,0|2,0,0]=4 12974 B18R2.257 CN(CCc1ccc(cc1)Cl)c2ccccc2 34a_100000210012_100011713675 [0,2,0,0,0,0|2,0,0]=4 12975 B18R2.257 CN(CCc1ccc(cc1)F)c2ccccc2 2230a_100000210012_100011217392 [0,2,0,0,0,0|2,0,0]=4 12976 B18R2.257 CN(CCc1ccc(cc1)F)c2ccccc2 269982a_100000210012_100011217392 [0,2,0,0,0,0|2,0,0]=4 12977 B18R2.257 CN(CCc1ccc(cc1)F)c2ccccc2 34a_100000210012_100011217392 [0,2,0,0,0,0|2,0,0]=4 12978 B18R2.257 CN(CCc1ccc(cc1)O)c2ccccc2 2230a_100000210012_100009816426 [0,2,0,0,0,0|2,0,0]=4 12979 B18R2.257 CN(CCc1ccc(cc1)O)c2ccccc2 269982a_100000210012_100009816426 [0,2,0,0,0,0|2,0,0]=4 12980 B18R2.257 C[C@@H](NCc1ccc(cc1)Br)c2ccccc2 207a_100000751104_100000186029 [0,2,0,0,0,0|1,0,0]=3 12981 B18R2.257 C[C@@H](NCc1ccc(cc1)Br)c2ccccc2 2230a_100000751104_100011217064 [0,2,0,0,0,0|1,0,0]=3 12982 B18R2.257 C[C@@H](NCc1ccc(cc1)Br)c2ccccc2 270004a_100000751104_100000186029 [0,2,0,0,0,0|1,0,0]=3 12983 B18R2.257 C[C@@H](NCc1ccc(cc1)Cl)c2ccccc2 207a_100000751104_100000189385 [0,2,0,0,0,0|1,0,0]=3 12984 B18R2.257 C[C@@H](NCc1ccc(cc1)Cl)c2ccccc2 2230a_100000751104_100000694040 [0,2,0,0,0,0|1,0,0]=3 12985 B18R2.257 C[C@@H](NCc1ccc(cc1)Cl)c2ccccc2 270004a_100000751104_100000189385 [0,2,0,0,0,0|1,0,0]=3 12986 B18R2.257 C[C@@H](NCc1ccc(cc1)F)c2ccccc2 207a_100000751104_100000210084 [0,2,0,0,0,0|1,0,0]=3 12987 B18R2.257 C[C@@H](NCc1ccc(cc1)F)c2ccccc2 2230a_100000751104_100000198546 [0,2,0,0,0,0|1,0,0]=3 12988 B18R2.257 C[C@@H](NCc1ccc(cc1)F)c2ccccc2 270004a_100000751104_100000210084 [0,2,0,0,0,0|1,0,0]=3 12989 B18R2.257 C[C@@H](NCc1ccc(cc1)I)c2ccccc2 207a_100000751104_100000188517 [0,2,0,0,0,0|1,0,0]=3 12990 B18R2.257 C[C@@H](NCc1ccc(cc1)I)c2ccccc2 2230a_100000751104_100000189116 [0,2,0,0,0,0|1,0,0]=3 12991 B18R2.257 C[C@@H](NCc1ccc(cn1)Br)c2ccccc2 207a_100000751104_100000754260 [0,2,0,0,0,0|2,0,0]=4 12992 B18R2.257 C[C@@H](NCc1ccc(cn1)Br)c2ccccc2 2230a_100000751104_100000702658 [0,2,0,0,0,0|2,0,0]=4 12993 B18R2.257 C[C@@H](NCc1ccc(cn1)Br)c2ccccc2 270004a_100000751104_100000754260 [0,2,0,0,0,0|2,0,0]=4 12994 B18R2.257 C[C@@H](NCc1ccc(cn1)Cl)c2ccccc2 207a_100000751104_100011361569 [0,2,0,0,0,0|2,0,0]=4 12995 B18R2.257 C[C@@H](NCc1ccc(cn1)Cl)c2ccccc2 2230a_100000751104_100012066911 [0,2,0,0,0,0|2,0,0]=4 12996 B18R2.257 C[C@@H](NCc1ccc(cn1)Cl)c2ccccc2 270004a_100000751104_100011361569 [0,2,0,0,0,0|2,0,0]=4 12997 B18R2.257 C[C@@H](NCc1ccc(cn1)F)c2ccccc2 207a_100000751104_100011934744 [0,2,0,0,0,0|2,0,0]=4 12998 B18R2.257 C[C@@H](NCc1ccc(cn1)F)c2ccccc2 2230a_100000751104_100000703193 [0,2,0,0,0,0|2,0,0]=4 12999 B18R2.257 C[C@@H](NCc1ccc(cn1)F)c2ccccc2 270004a_100000751104_100011934744 [0,2,0,0,0,0|2,0,0]=4 13000 B18R2.257 C[C@@H](NCc1ccc(nc1)Br)c2ccccc2 2230a_100000751104_100009831999 [0,2,0,0,0,0|2,0,0]=4 13001 B18R2.257 C[C@@H](NCc1ccc(nc1)Cl)c2ccccc2 2230a_100000751104_100000735431 [0,2,0,0,0,0|2,0,0]=4 13002 B18R2.257 C[C@@H](NCc1ccc(nc1)F)c2ccccc2 2230a_100000751104_100009820150 [0,2,0,0,0,0|2,0,0]=4 13003 B18R2.257 C[C@@H](NCc1ccc(nc1)O)c2ccccc2 207a_100000751104_100011361521 [0,2,0,0,0,0|2,0,0]=4 13004 B18R2.257 C[C@@H](OCc1ccc(cc1)Br)c2ccccc2 34a_100000761318_100000189115 [0,2,0,0,0,0|0,0,0]=2 13005 B18R2.257 C[C@@H](OCc1ccc(cc1)Br)c2ccccc2 7a_100000761318_100011217064 [0,2,0,0,0,0|0,0,0]=2 13006 B18R2.257 C[C@@H](OCc1ccc(cc1)Cl)c2ccccc2 34a_100000761318_100000694040 [0,2,0,0,0,0|0,0,0]=2 13007 B18R2.257 C[C@@H](OCc1ccc(cc1)Cl)c2ccccc2 7a_100000761318_100000187161 [0,2,0,0,0,0|0,0,0]=2 13008 B18R2.257 C[C@@H](OCc1ccc(cc1)F)c2ccccc2 34a_100000761318_100000198546 [0,2,0,0,0,0|0,0,0]=2 13009 B18R2.257 C[C@@H](OCc1ccc(cc1)F)c2ccccc2 7a_100000761318_100000198546 [0,2,0,0,0,0|0,0,0]=2 13010 B18R2.257 C[C@@H](OCc1ccc(cc1)I)c2ccccc2 34a_100000761318_100000189116 [0,2,0,0,0,0|0,0,0]=2 13011 B18R2.257 C[C@@H](OCc1ccc(cc1)I)c2ccccc2 7a_100000761318_100000189116 [0,2,0,0,0,0|0,0,0]=2 13012 B18R2.257 C[C@@H](OCc1ccc(cn1)Br)c2ccccc2 34a_100000761318_100000702658 [0,2,0,0,0,0|1,0,0]=3 13013 B18R2.257 C[C@@H](OCc1ccc(cn1)Br)c2ccccc2 7a_100000761318_100000702658 [0,2,0,0,0,0|1,0,0]=3 13014 B18R2.257 C[C@@H](OCc1ccc(cn1)Cl)c2ccccc2 34a_100000761318_100012066911 [0,2,0,0,0,0|1,0,0]=3 13015 B18R2.257 C[C@@H](OCc1ccc(cn1)Cl)c2ccccc2 7a_100000761318_100012066911 [0,2,0,0,0,0|1,0,0]=3 13016 B18R2.257 C[C@@H](OCc1ccc(cn1)F)c2ccccc2 34a_100000761318_100000703193 [0,2,0,0,0,0|1,0,0]=3 13017 B18R2.257 C[C@@H](OCc1ccc(cn1)F)c2ccccc2 7a_100000761318_100000703193 [0,2,0,0,0,0|1,0,0]=3 13018 B18R2.257 C[C@@H](OCc1ccc(nc1)Br)c2ccccc2 34a_100000761318_100009831999 [0,2,0,0,0,0|1,0,0]=3 13019 B18R2.257 C[C@@H](OCc1ccc(nc1)Br)c2ccccc2 7a_100000761318_100009831999 [0,2,0,0,0,0|1,0,0]=3 13020 B18R2.257 C[C@@H](OCc1ccc(nc1)Cl)c2ccccc2 34a_100000761318_100000735431 [0,2,0,0,0,0|1,0,0]=3 13021 B18R2.257 C[C@@H](OCc1ccc(nc1)Cl)c2ccccc2 7a_100000761318_100000735431 [0,2,0,0,0,0|1,0,0]=3 13022 B18R2.257 C[C@@H](OCc1ccc(nc1)F)c2ccccc2 34a_100000761318_100000099788 [0,2,0,0,0,0|1,0,0]=3 13023 B18R2.257 C[C@@H](OCc1ccc(nc1)F)c2ccccc2 7a_100000761318_100009820150 [0,2,0,0,0,0|1,0,0]=3 13024 B18R2.257 C[C@@H](OCc1ccc(nn1)Cl)c2ccccc2 34a_100000761318_100016992710 [0,2,0,0,0,0|2,0,0]=4 13025 B18R2.257 C[C@@H](OCc1ccc(nn1)Cl)c2ccccc2 7a_100000761318_100016992710 [0,2,0,0,0,0|2,0,0]=4 13026 B18R2.257 C[C@@H](OCc1ncc(cn1)Br)c2ccccc2 34a_100000761318_100010064664 [0,2,0,0,0,0|2,0,0]=4 13027 B18R2.257 C[C@@H](OCc1ncc(cn1)Br)c2ccccc2 7a_100000761318_100010064664 [0,2,0,0,0,0|2,0,0]=4 13028 B18R2.257 Cc1ccc(cc1)CCC(=O)c2ccccc2 1458a_100000185807_100011713686 [0,2,0,0,0,0|1,0,1]=4 13029 B18R2.257 Cc1ccc(cc1)CCN(C)c2ccccc2 2230a_100000210012_100011713686 [0,2,0,0,0,0|2,0,0]=4 13030 B18R2.257 Cc1ccc(cc1)CCN(C)c2ccccc2 269982a_100000210012_100011713686 [0,2,0,0,0,0|2,0,0]=4 13031 B18R2.257 Cc1ccc(cc1)CCN(C)c2ccccc2 34a_100000210012_100011713686 [0,2,0,0,0,0|2,0,0]=4 13032 B18R2.257 Cc1ccc(cc1)CNC(=O)c2ccccc2 11a_100000174908_100000185807 [0,2,0,0,0,0|1,0,1]=4 13033 B18R2.257 Cc1ccc(cc1)CNC(=O)c2ccccc2 1626a_100000174908_100000185807 [0,2,0,0,0,0|1,0,1]=4 13034 B18R2.257 Cc1ccc(cc1)CNC(=O)c2ccccc2 240690a_100000174908_100000185807 [0,2,0,0,0,0|1,0,1]=4 13035 B18R2.257 Cc1ccc(cc1)CNC(=O)c2ccccc2 527a_100000174908_100000185807 [0,2,0,0,0,0|1,0,1]=4 13036 B18R2.257 Cc1ccc(cc1)CNC(C)c2ccccc2 2230a_100000174908_100000230085 [0,2,0,0,0,0|1,0,0]=3 13037 B18R2.257 Cc1ccc(cc1)CNC(C)c2ccccc2 269862a_100000174908_100000185851 [0,2,0,0,0,0|1,0,0]=3 13038 B18R2.257 Cc1ccc(cc1)CNC(C)c2ccccc2 34a_100000174908_100000211855 [0,2,0,0,0,0|1,0,0]=3 13039 B18R2.257 Cc1ccc(cc1)CNC(C)c2ccccn2 207a_100000181244_100000211033 [0,2,0,0,0,0|2,0,0]=4 13040 B18R2.257 Cc1ccc(cc1)CNC(C)c2ccccn2 2230a_100000181244_100000210814 [0,2,0,0,0,0|2,0,0]=4 13041 B18R2.257 Cc1ccc(cc1)CNC(C)c2ccccn2 269862a_100000174908_100000210467 [0,2,0,0,0,0|2,0,0]=4 13042 B18R2.257 Cc1ccc(cc1)CNC(C)c2ccccn2 270004a_100000181244_100000211033 [0,2,0,0,0,0|2,0,0]=4 13043 B18R2.257 Cc1ccc(cc1)CNC(C)c2cccnc2 207a_100000195435_100000211033 [0,2,0,0,0,0|2,0,0]=4 13044 B18R2.257 Cc1ccc(cc1)CNC(C)c2cccnc2 2230a_100000195435_100000210814 [0,2,0,0,0,0|2,0,0]=4 13045 B18R2.257 Cc1ccc(cc1)CNC(C)c2cccnc2 269862a_100000174908_100000210468 [0,2,0,0,0,0|2,0,0]=4 13046 B18R2.257 Cc1ccc(cc1)CNC(C)c2cccnc2 270004a_100000195435_100000211033 [0,2,0,0,0,0|2,0,0]=4 13047 B18R2.257 Cc1ccc(cc1)CNC(C)c2ccncc2 207a_100000181269_100000211033 [0,2,0,0,0,0|2,0,0]=4 13048 B18R2.257 Cc1ccc(cc1)CNC(C)c2ccncc2 2230a_100000181269_100000210814 [0,2,0,0,0,0|2,0,0]=4 13049 B18R2.257 Cc1ccc(cc1)CNC(C)c2ccncc2 269862a_100000174908_100000185792 [0,2,0,0,0,0|2,0,0]=4 13050 B18R2.257 Cc1ccc(cc1)CNC(C)c2ccncc2 270004a_100000181269_100000211033 [0,2,0,0,0,0|2,0,0]=4 13051 B18R2.257 Cc1ccc(cc1)CN[C@H](C)c2ccccc2 207a_100000751104_100000211033 [0,2,0,0,0,0|1,0,0]=3 13052 B18R2.257 Cc1ccc(cc1)CN[C@H](C)c2ccccc2 2230a_100000751104_100000210814 [0,2,0,0,0,0|1,0,0]=3 13053 B18R2.257 Cc1ccc(cc1)CN[C@H](C)c2ccccc2 270004a_100000751104_100000211033 [0,2,0,0,0,0|1,0,0]=3 13054 B18R2.257 Cc1ccc(cc1)COC(C)c2ccccc2 34a_100011215236_100000211855 [0,2,0,0,0,0|0,0,0]=2 13055 B18R2.257 Cc1ccc(cc1)COC(C)c2ccccc2 7a_100011215236_100000230085 [0,2,0,0,0,0|0,0,0]=2 13056 B18R2.257 Cc1ccc(cc1)COC(C)c2cnccn2 7a_100011215236_200000703233 [0,2,0,0,0,0|2,0,0]=4 13057 B18R2.257 Cc1ccc(cc1)CO[C@H](C)c2ccccc2 34a_100000761318_100000210814 [0,2,0,0,0,0|0,0,0]=2 13058 B18R2.257 Cc1ccc(cc1)CO[C@H](C)c2ccccc2 7a_100000761318_100000210814 [0,2,0,0,0,0|0,0,0]=2 13059 B18R2.257 Cc1ccc(cc1)CSC(C)c2ccccc2 62a_100000210814_100000230085 [0,2,0,0,0,0|0,1,0]=3 13060 B18R2.257 Cc1ccc(cc1)CSC(C)c2ccccc2 62a_100000230085_100000210814 [0,2,0,0,0,0|0,1,0]=3 13061 B18R2.257 Cc1ccc(cc1)NCC(C)c2ccccc2 34a_100000124888_100000756946 [0,2,0,0,0,0|2,0,0]=4 13062 B18R2.257 Cc1ccc(cc1)NCC(O)c2ccccc2 34a_100000124888_100000185958 [0,2,0,0,0,0|2,0,0]=4 13063 B18R2.257 Cc1ccc(cc1)NC[C@@H](O)c2ccccc2 34a_100000124888_100011933945 [0,2,0,0,0,0|2,0,0]=4 13064 B18R2.257 Cc1ccc(cc1)OCC(C)c2ccccc2 34a_100000210336_100000756946 [0,2,0,0,0,0|2,0,0]=4 13065 B18R2.257 Cc1ccc(cc1)OCC(C)c2ccccc2 7a_100000210336_100000756946 [0,2,0,0,0,0|2,0,0]=4 13066 B18R2.257 Cc1ccc(cc1)OCC(O)c2ccccc2 34a_100000210336_100000185958 [0,2,0,0,0,0|2,0,0]=4 13067 B18R2.257 Cc1ccc(cc1)OCC(O)c2ccccc2 7a_100000210336_100000185958 [0,2,0,0,0,0|2,0,0]=4 13068 B18R2.257 Cc1ccc(cc1)OC[C@@H](O)c2ccccc2 34a_100000210336_100011933945 [0,2,0,0,0,0|2,0,0]=4 13069 B18R2.257 Cc1ccc(cc1)OC[C@@H](O)c2ccccc2 7a_100000210336_100011933945 [0,2,0,0,0,0|2,0,0]=4 13070 B18R2.257 Cc1ccc(cc1)SCC(C)c2ccccc2 62a_100000186775_100000756946 [0,2,0,0,0,0|2,0,0]=4 13071 B18R2.257 Cc1ccc(cc1)SCC(C)c2ccccc2 62a_100000756946_100000186775 [0,2,0,0,0,0|2,0,0]=4 13072 B18R2.257 Cc1ccc(cc1)SCC(O)c2ccccc2 62a_100000185958_100000186775 [0,2,0,0,0,0|2,0,0]=4 13073 B18R2.257 Cc1ccc(cc1)SCC(O)c2ccccc2 62a_100000186775_100000185958 [0,2,0,0,0,0|2,0,0]=4 13074 B18R2.257 Cc1ccc(cc1)SC[C@@H](O)c2ccccc2 62a_100000186775_100011933945 [0,2,0,0,0,0|2,0,0]=4 13075 B18R2.257 Cc1ccc(cc1)SC[C@@H](O)c2ccccc2 62a_100011933945_100000186775 [0,2,0,0,0,0|2,0,0]=4 13076 B18R2.257 Cc1ccc(cn1)CNC(C)c2ccccc2 269862a_100000740942_100000185851 [0,2,0,0,0,0|2,0,0]=4 13077 B18R2.257 Cc1ccc(cn1)CNC(C)c2ccccc2 34a_100000740942_100000211855 [0,2,0,0,0,0|2,0,0]=4 13078 B18R2.257 Cc1ccc(cn1)CN[C@H](C)c2ccccc2 2230a_100000751104_100016987292 [0,2,0,0,0,0|2,0,0]=4 13079 B18R2.257 Cc1ccc(cn1)CN[C@H](C)c2ccccc2 270004a_100000751104_100000743784 [0,2,0,0,0,0|2,0,0]=4 13080 B18R2.257 Cc1ccc(cn1)COC(C)c2ccccc2 34a_100011248133_100000211855 [0,2,0,0,0,0|1,0,0]=3 13081 B18R2.257 Cc1ccc(cn1)CO[C@H](C)c2ccccc2 34a_100000761318_100016987292 [0,2,0,0,0,0|1,0,0]=3 13082 B18R2.257 Cc1ccc(cn1)CO[C@H](C)c2ccccc2 7a_100000761318_100016987292 [0,2,0,0,0,0|1,0,0]=3 13083 B18R2.257 Cc1ccc(cn1)CSC(C)c2ccccc2 62a_100000230085_100016987292 [0,2,0,0,0,0|1,1,0]=4 13084 B18R2.257 Cc1ccc(cn1)CSC(C)c2ccccc2 62a_100016987292_100000230085 [0,2,0,0,0,0|1,1,0]=4 13085 B18R2.257 Cc1ccc(nc1)CNC(C)c2ccccc2 34a_100015187455_100000211855 [0,2,0,0,0,0|2,0,0]=4 13086 B18R2.257 Cc1ccc(nc1)CN[C@H](C)c2ccccc2 207a_100000751104_100000050478 [0,2,0,0,0,0|2,0,0]=4 13087 B18R2.257 Cc1ccc(nc1)CN[C@H](C)c2ccccc2 2230a_100000751104_100000691093 [0,2,0,0,0,0|2,0,0]=4 13088 B18R2.257 Cc1ccc(nc1)CN[C@H](C)c2ccccc2 270004a_100000751104_100000050478 [0,2,0,0,0,0|2,0,0]=4 13089 B18R2.257 Cc1ccc(nc1)COC(C)c2ccccc2 34a_100012001401_100000211855 [0,2,0,0,0,0|1,0,0]=3 13090 B18R2.257 Cc1ccc(nc1)CO[C@H](C)c2ccccc2 34a_100000761318_100000691093 [0,2,0,0,0,0|1,0,0]=3 13091 B18R2.257 Cc1ccc(nc1)CO[C@H](C)c2ccccc2 7a_100000761318_100000691093 [0,2,0,0,0,0|1,0,0]=3 13092 B18R2.257 Cc1ccc(nc1)CSC(C)c2ccccc2 62a_100000230085_100000691093 [0,2,0,0,0,0|1,1,0]=4 13093 B18R2.257 Cc1ccc(nc1)CSC(C)c2ccccc2 62a_100000691093_100000230085 [0,2,0,0,0,0|1,1,0]=4 13094 B18R2.257 Cc1cnc(cn1)COC(C)c2ccccc2 34a_100011273949_100000211855 [0,2,0,0,0,0|2,0,0]=4 13095 B18R2.257 Cc1cnc(cn1)CO[C@H](C)c2ccccc2 7a_100000761318_100000752025 [0,2,0,0,0,0|2,0,0]=4 13096 B18R2.257 Cc1cnc(nc1)CO[C@H](C)c2ccccc2 34a_100000761318_100000685645 [0,2,0,0,0,0|2,0,0]=4 13097 B18R2.257 Cc1cnc(nc1)CO[C@H](C)c2ccccc2 7a_100000761318_100000685645 [0,2,0,0,0,0|2,0,0]=4 13098 B18R2.257 Cc1ncc(cn1)COC(C)c2ccccc2 34a_100011746891_100000211855 [0,2,0,0,0,0|2,0,0]=4 13099 B18R2.257 Nc1ccc(cc1)OCC(O)c2ccccc2 34a_100000185829_100000185958 [0,2,0,0,0,0|2,0,0]=4 13100 B18R2.257 Nc1ccc(cc1)OC[C@@H](O)c2ccccc2 34a_100000185829_100011933945 [0,2,0,0,0,0|2,0,0]=4 13101 B18R2.257 Nc1ccc(cc1)SCC(O)c2ccccc2 62a_100000185761_100000185958 [0,2,0,0,0,0|2,0,0]=4 13102 B18R2.257 Nc1ccc(cc1)SCC(O)c2ccccc2 62a_100000185958_100000185761 [0,2,0,0,0,0|2,0,0]=4 13103 B18R2.257 Nc1ccc(cc1)SC[C@@H](O)c2ccccc2 62a_100000185761_100011933945 [0,2,0,0,0,0|2,0,0]=4 13104 B18R2.257 Nc1ccc(cc1)SC[C@@H](O)c2ccccc2 62a_100011933945_100000185761 [0,2,0,0,0,0|2,0,0]=4 13105 B18R2.257 O=C(CCc1ccc(cc1)Br)c2ccccc2 1458a_100000185807_100011740612 [0,2,0,0,0,0|1,0,1]=4 13106 B18R2.257 O=C(CCc1ccc(cc1)Cl)c2ccccc2 1458a_100000185807_100011713675 [0,2,0,0,0,0|1,0,1]=4 13107 B18R2.257 O=C(CCc1ccc(cc1)F)c2ccccc2 1458a_100000185807_100011217392 [0,2,0,0,0,0|1,0,1]=4 13108 B18R2.257 O=C(CCc1ccc(cc1)O)c2ccccc2 1458a_100000185807_100009816426 [0,2,0,0,0,0|1,0,1]=4 13109 B18R2.257 O=C(NCc1ccc(cc1)Br)c2ccccc2 11a_100000174875_100000185807 [0,2,0,0,0,0|1,0,1]=4 13110 B18R2.257 O=C(NCc1ccc(cc1)Br)c2ccccc2 1626a_100000174875_100000185807 [0,2,0,0,0,0|1,0,1]=4 13111 B18R2.257 O=C(NCc1ccc(cc1)Br)c2ccccc2 240690a_100000174875_100000185807 [0,2,0,0,0,0|1,0,1]=4 13112 B18R2.257 O=C(NCc1ccc(cc1)Br)c2ccccc2 527a_100000174875_100000185807 [0,2,0,0,0,0|1,0,1]=4 13113 B18R2.257 O=C(NCc1ccc(cc1)Cl)c2ccccc2 11a_100000174871_100000185807 [0,2,0,0,0,0|1,0,1]=4 13114 B18R2.257 O=C(NCc1ccc(cc1)Cl)c2ccccc2 1626a_100000174871_100000185807 [0,2,0,0,0,0|1,0,1]=4 13115 B18R2.257 O=C(NCc1ccc(cc1)Cl)c2ccccc2 240690a_100000174871_100000185807 [0,2,0,0,0,0|1,0,1]=4 13116 B18R2.257 O=C(NCc1ccc(cc1)Cl)c2ccccc2 527a_100000174871_100000185807 [0,2,0,0,0,0|1,0,1]=4 13117 B18R2.257 O=C(NCc1ccc(cc1)F)c2ccccc2 11a_100000174882_100000185807 [0,2,0,0,0,0|1,0,1]=4 13118 B18R2.257 O=C(NCc1ccc(cc1)F)c2ccccc2 1626a_100000174882_100000185807 [0,2,0,0,0,0|1,0,1]=4 13119 B18R2.257 O=C(NCc1ccc(cc1)F)c2ccccc2 240690a_100000174882_100000185807 [0,2,0,0,0,0|1,0,1]=4 13120 B18R2.257 O=C(NCc1ccc(cc1)F)c2ccccc2 527a_100000174882_100000185807 [0,2,0,0,0,0|1,0,1]=4 13121 B18R2.257 O=C(NCc1ccc(cc1)I)c2ccccc2 11a_100016989417_100000185807 [0,2,0,0,0,0|1,0,1]=4 13122 B18R2.257 O=C(NCc1ccc(cc1)I)c2ccccc2 1626a_100016989417_100000185807 [0,2,0,0,0,0|1,0,1]=4 13123 B18R2.257 O=C(NCc1ccc(cc1)I)c2ccccc2 240690a_100016989417_100000185807 [0,2,0,0,0,0|1,0,1]=4 13124 B18R2.257 O=C(NCc1ccc(cc1)I)c2ccccc2 527a_100016989417_100000185807 [0,2,0,0,0,0|1,0,1]=4 13125 B18R2.257 O=C(NCc1ccc(cc1)O)c2ccccc2 240690a_100000185549_100000185807 [0,2,0,0,0,0|1,0,1]=4 13126 B18R2.257 O=C(NCc1ccc(cc1)O)c2ccccc2 527a_100000185549_100000185807 [0,2,0,0,0,0|1,0,1]=4 13127 B18R2.257 OC(CNc1ccc(cc1)Br)c2ccccc2 2230a_100000210018_100000185958 [0,2,0,0,0,0|2,0,0]=4 13128 B18R2.257 OC(CNc1ccc(cc1)Br)c2ccccc2 34a_100000210018_100000185958 [0,2,0,0,0,0|2,0,0]=4 13129 B18R2.257 OC(CNc1ccc(cc1)Cl)c2ccccc2 2230a_100000210052_100000185958 [0,2,0,0,0,0|2,0,0]=4 13130 B18R2.257 OC(CNc1ccc(cc1)Cl)c2ccccc2 34a_100000210052_100000185958 [0,2,0,0,0,0|2,0,0]=4 13131 B18R2.257 OC(CNc1ccc(cc1)F)c2ccccc2 34a_100000185862_100000185958 [0,2,0,0,0,0|2,0,0]=4 13132 B18R2.257 OC(CNc1ccc(cc1)I)c2ccccc2 34a_100000185761_100000185958 [0,2,0,0,0,0|2,0,0]=4 13133 B18R2.257 OC(COc1ccc(cc1)Br)c2ccccc2 34a_100000185759_100000185958 [0,2,0,0,0,0|2,0,0]=4 13134 B18R2.257 OC(COc1ccc(cc1)Br)c2ccccc2 7a_100000185759_100000185958 [0,2,0,0,0,0|2,0,0]=4 13135 B18R2.257 OC(COc1ccc(cc1)Cl)c2ccccc2 34a_100000210216_100000185958 [0,2,0,0,0,0|2,0,0]=4 13136 B18R2.257 OC(COc1ccc(cc1)Cl)c2ccccc2 7a_100000210216_100000185958 [0,2,0,0,0,0|2,0,0]=4 13137 B18R2.257 OC(COc1ccc(cc1)F)c2ccccc2 34a_100000210339_100000185958 [0,2,0,0,0,0|2,0,0]=4 13138 B18R2.257 OC(COc1ccc(cc1)I)c2ccccc2 34a_100000212066_100000185958 [0,2,0,0,0,0|2,0,0]=4 13139 B18R2.257 OC(COc1ccc(cc1)I)c2ccccc2 7a_100000212066_100000185958 [0,2,0,0,0,0|2,0,0]=4 13140 B18R2.257 OC(CSc1ccc(cc1)Br)c2ccccc2 62a_100000185958_100000752885 [0,2,0,0,0,0|2,0,0]=4 13141 B18R2.257 OC(CSc1ccc(cc1)Br)c2ccccc2 62a_100000752885_100000185958 [0,2,0,0,0,0|2,0,0]=4 13142 B18R2.257 OC(CSc1ccc(cc1)Cl)c2ccccc2 62a_100000185958_100000755918 [0,2,0,0,0,0|2,0,0]=4 13143 B18R2.257 OC(CSc1ccc(cc1)Cl)c2ccccc2 62a_100000755918_100000185958 [0,2,0,0,0,0|2,0,0]=4 13144 B18R2.257 OC(CSc1ccc(cc1)F)c2ccccc2 62a_100000185958_100000211213 [0,2,0,0,0,0|2,0,0]=4 13145 B18R2.257 OC(CSc1ccc(cc1)F)c2ccccc2 62a_100000211213_100000185958 [0,2,0,0,0,0|2,0,0]=4 13146 B18R2.257 O[C@H](CNc1ccc(cc1)Br)c2ccccc2 2230a_100000210018_100011933945 [0,2,0,0,0,0|2,0,0]=4 13147 B18R2.257 O[C@H](CNc1ccc(cc1)Br)c2ccccc2 34a_100000210018_100011933945 [0,2,0,0,0,0|2,0,0]=4 13148 B18R2.257 O[C@H](CNc1ccc(cc1)Cl)c2ccccc2 2230a_100000210052_100011933945 [0,2,0,0,0,0|2,0,0]=4 13149 B18R2.257 O[C@H](CNc1ccc(cc1)Cl)c2ccccc2 34a_100000210052_100011933945 [0,2,0,0,0,0|2,0,0]=4 13150 B18R2.257 O[C@H](CNc1ccc(cc1)F)c2ccccc2 34a_100000185862_100011933945 [0,2,0,0,0,0|2,0,0]=4 13151 B18R2.257 O[C@H](CNc1ccc(cc1)I)c2ccccc2 34a_100000185761_100011933945 [0,2,0,0,0,0|2,0,0]=4 13152 B18R2.257 O[C@H](COc1ccc(cc1)Br)c2ccccc2 34a_100000185759_100011933945 [0,2,0,0,0,0|2,0,0]=4 13153 B18R2.257 O[C@H](COc1ccc(cc1)Br)c2ccccc2 7a_100000185759_100011933945 [0,2,0,0,0,0|2,0,0]=4 13154 B18R2.257 O[C@H](COc1ccc(cc1)Cl)c2ccccc2 34a_100000210216_100011933945 [0,2,0,0,0,0|2,0,0]=4 13155 B18R2.257 O[C@H](COc1ccc(cc1)Cl)c2ccccc2 7a_100000210216_100011933945 [0,2,0,0,0,0|2,0,0]=4 13156 B18R2.257 O[C@H](COc1ccc(cc1)F)c2ccccc2 34a_100000210339_100011933945 [0,2,0,0,0,0|2,0,0]=4 13157 B18R2.257 O[C@H](COc1ccc(cc1)I)c2ccccc2 34a_100000212066_100011933945 [0,2,0,0,0,0|2,0,0]=4 13158 B18R2.257 O[C@H](COc1ccc(cc1)I)c2ccccc2 7a_100000212066_100011933945 [0,2,0,0,0,0|2,0,0]=4 13159 B18R2.257 O[C@H](CSc1ccc(cc1)Br)c2ccccc2 62a_100000752885_100011933945 [0,2,0,0,0,0|2,0,0]=4 13160 B18R2.257 O[C@H](CSc1ccc(cc1)Br)c2ccccc2 62a_100011933945_100000752885 [0,2,0,0,0,0|2,0,0]=4 13161 B18R2.257 O[C@H](CSc1ccc(cc1)Cl)c2ccccc2 62a_100000755918_100011933945 [0,2,0,0,0,0|2,0,0]=4 13162 B18R2.257 O[C@H](CSc1ccc(cc1)Cl)c2ccccc2 62a_100011933945_100000755918 [0,2,0,0,0,0|2,0,0]=4 13163 B18R2.257 O[C@H](CSc1ccc(cc1)F)c2ccccc2 62a_100000211213_100011933945 [0,2,0,0,0,0|2,0,0]=4 13164 B18R2.257 O[C@H](CSc1ccc(cc1)F)c2ccccc2 62a_100011933945_100000211213 [0,2,0,0,0,0|2,0,0]=4 13165 B18R2.257 Oc1ccc(cc1)NCC(O)c2ccccc2 34a_100000185829_100000185958 [0,2,0,0,0,0|2,0,0]=4 13166 B18R2.257 Oc1ccc(cc1)NC[C@@H](O)c2ccccc2 34a_100000185829_100011933945 [0,2,0,0,0,0|2,0,0]=4 13167 B18R2.257 Oc1ccc(cc1)SCC(O)c2ccccc2 62a_100000185958_100000185759 [0,2,0,0,0,0|2,0,0]=4 13168 B18R2.257 Oc1ccc(cc1)SC[C@@H](O)c2ccccc2 62a_100011933945_100000185759 [0,2,0,0,0,0|2,0,0]=4 13169 B18R2.269 Brc1cc(ccn1)CNCc2ccc(cc2)I 2230a_100016989417_100010243470 [0,2,0,0,0,0|2,0,0]=4 13170 B18R2.269 Brc1cc(ccn1)CNCc2ccc(cc2)I 2230a_100025757509_100000189116 [0,2,0,0,0,0|2,0,0]=4 13171 B18R2.269 Brc1cc(ccn1)CNCc2ccc(cc2)I 270004a_100016989417_100009814634 [0,2,0,0,0,0|2,0,0]=4 13172 B18R2.269 Brc1cc(ccn1)CNCc2ccc(cc2)I 34a_100016989417_100010243470 [0,2,0,0,0,0|2,0,0]=4 13173 B18R2.269 Brc1cc(ccn1)CNCc2ccc(cc2)I 34a_100025757509_100000189116 [0,2,0,0,0,0|2,0,0]=4 13174 B18R2.269 Brc1cc(ccn1)COCc2ccc(cc2)I 34a_100000690907_100010243470 [0,2,0,0,0,0|1,0,0]=3 13175 B18R2.269 Brc1cc(ccn1)COCc2ccc(cc2)I 34a_100009814636_100000189116 [0,2,0,0,0,0|1,0,0]=3 13176 B18R2.269 Brc1cc(ccn1)COCc2ccc(cc2)I 7a_100000690907_100010254460 [0,2,0,0,0,0|1,0,0]=3 13177 B18R2.269 Brc1cc(ccn1)COCc2ccc(cc2)I 7a_100009814636_100000189116 [0,2,0,0,0,0|1,0,0]=3 13178 B18R2.269 Brc1cc(ccn1)CSCc2ccc(cc2)I 62a_100000189116_100010243470 [0,2,0,0,0,0|1,1,0]=4 13179 B18R2.269 Brc1cc(ccn1)CSCc2ccc(cc2)I 62a_100010254460_100000189116 [0,2,0,0,0,0|1,1,0]=4 13180 B18R2.269 Brc1ccc(cc1)CCNc2cccc(c2)Br 34a_100000210019_100011740612 [0,2,0,0,0,0|2,0,0]=4 13181 B18R2.269 Brc1ccc(cc1)CCNc2cccc(c2)I 34a_100000211102_100011740612 [0,2,0,0,0,0|2,0,0]=4 13182 B18R2.269 Brc1ccc(cc1)CCOc2cccc(c2)Br 34a_100000210342_100011740612 [0,2,0,0,0,0|2,0,0]=4 13183 B18R2.269 Brc1ccc(cc1)CCOc2cccc(c2)Br 7a_100000210342_100011740612 [0,2,0,0,0,0|2,0,0]=4 13184 B18R2.269 Brc1ccc(cc1)CCOc2cccc(c2)I 34a_100000211634_100011740612 [0,2,0,0,0,0|2,0,0]=4 13185 B18R2.269 Brc1ccc(cc1)CCOc2cccc(c2)I 7a_100000211634_100011740612 [0,2,0,0,0,0|2,0,0]=4 13186 B18R2.269 Brc1ccc(cc1)CCSc2cccc(c2)Br 62a_100000691529_100011740612 [0,2,0,0,0,0|2,0,0]=4 13187 B18R2.269 Brc1ccc(cc1)CCSc2cccc(c2)Br 62a_100011740612_100000691529 [0,2,0,0,0,0|2,0,0]=4 13188 B18R2.269 Brc1ccc(cc1)CNCc2cc(ccn2)Br 2230a_100000174875_100010173614 [0,2,0,0,0,0|2,0,0]=4 13189 B18R2.269 Brc1ccc(cc1)CNCc2cc(ccn2)Br 270004a_100000174875_100009818557 [0,2,0,0,0,0|2,0,0]=4 13190 B18R2.269 Brc1ccc(cc1)CNCc2cc(ccn2)Br 34a_100000174875_100010173614 [0,2,0,0,0,0|2,0,0]=4 13191 B18R2.269 Brc1ccc(cc1)CNCc2cccc(c2)Br 207a_100000174875_100000210085 [0,2,0,0,0,0|1,0,0]=3 13192 B18R2.269 Brc1ccc(cc1)CNCc2cccc(c2)Br 207a_100000174977_100000186029 [0,2,0,0,0,0|1,0,0]=3 13193 B18R2.269 Brc1ccc(cc1)CNCc2cccc(c2)Br 2230a_100000174875_100000698116 [0,2,0,0,0,0|1,0,0]=3 13194 B18R2.269 Brc1ccc(cc1)CNCc2cccc(c2)Br 2230a_100000174977_100011217064 [0,2,0,0,0,0|1,0,0]=3 13195 B18R2.269 Brc1ccc(cc1)CNCc2cccc(c2)Br 26a_100000174875_100000210342 [0,2,0,0,0,0|1,0,0]=3 13196 B18R2.269 Brc1ccc(cc1)CNCc2cccc(c2)Br 26a_100000174977_100000185759 [0,2,0,0,0,0|1,0,0]=3 13197 B18R2.269 Brc1ccc(cc1)CNCc2cccc(c2)Br 270004a_100000174875_100000210085 [0,2,0,0,0,0|1,0,0]=3 13198 B18R2.269 Brc1ccc(cc1)CNCc2cccc(c2)Br 270004a_100000174977_100000186029 [0,2,0,0,0,0|1,0,0]=3 13199 B18R2.269 Brc1ccc(cc1)CNCc2cccc(c2)Br 34a_100000174875_100000698116 [0,2,0,0,0,0|1,0,0]=3 13200 B18R2.269 Brc1ccc(cc1)CNCc2cccc(c2)Br 34a_100000174977_100000189115 [0,2,0,0,0,0|1,0,0]=3 13201 B18R2.269 Brc1ccc(cc1)CNCc2cccc(c2)I 207a_100000106179_100000186029 [0,2,0,0,0,0|1,0,0]=3 13202 B18R2.269 Brc1ccc(cc1)CNCc2cccc(c2)I 207a_100000174875_100000014684 [0,2,0,0,0,0|1,0,0]=3 13203 B18R2.269 Brc1ccc(cc1)CNCc2cccc(c2)I 2230a_100000106179_100011217064 [0,2,0,0,0,0|1,0,0]=3 13204 B18R2.269 Brc1ccc(cc1)CNCc2cccc(c2)I 2230a_100000174875_100011218688 [0,2,0,0,0,0|1,0,0]=3 13205 B18R2.269 Brc1ccc(cc1)CNCc2cccc(c2)I 270004a_100000106179_100000186029 [0,2,0,0,0,0|1,0,0]=3 13206 B18R2.269 Brc1ccc(cc1)CNCc2cccc(c2)I 270004a_100000174875_100000014684 [0,2,0,0,0,0|1,0,0]=3 13207 B18R2.269 Brc1ccc(cc1)CNCc2cccc(c2)I 34a_100000106179_100000189115 [0,2,0,0,0,0|1,0,0]=3 13208 B18R2.269 Brc1ccc(cc1)CNCc2cccc(c2)I 34a_100000174875_100011218688 [0,2,0,0,0,0|1,0,0]=3 13209 B18R2.269 Brc1ccc(cc1)CNCc2cccc(n2)Br 2230a_100000174875_100009889011 [0,2,0,0,0,0|2,0,0]=4 13210 B18R2.269 Brc1ccc(cc1)CNCc2cccc(n2)Br 2230a_100016987751_100011217064 [0,2,0,0,0,0|2,0,0]=4 13211 B18R2.269 Brc1ccc(cc1)CNCc2cccc(n2)Br 270004a_100000174875_100000688028 [0,2,0,0,0,0|2,0,0]=4 13212 B18R2.269 Brc1ccc(cc1)CNCc2cccc(n2)Br 34a_100000174875_100009889011 [0,2,0,0,0,0|2,0,0]=4 13213 B18R2.269 Brc1ccc(cc1)CNCc2ccnc(c2)Br 2230a_100000174875_100010243470 [0,2,0,0,0,0|2,0,0]=4 13214 B18R2.269 Brc1ccc(cc1)CNCc2ccnc(c2)Br 2230a_100025757509_100011217064 [0,2,0,0,0,0|2,0,0]=4 13215 B18R2.269 Brc1ccc(cc1)CNCc2ccnc(c2)Br 26a_100025757509_100000185759 [0,2,0,0,0,0|2,0,0]=4 13216 B18R2.269 Brc1ccc(cc1)CNCc2ccnc(c2)Br 270004a_100000174875_100009814634 [0,2,0,0,0,0|2,0,0]=4 13217 B18R2.269 Brc1ccc(cc1)CNCc2ccnc(c2)Br 270004a_100025757509_100000186029 [0,2,0,0,0,0|2,0,0]=4 13218 B18R2.269 Brc1ccc(cc1)CNCc2ccnc(c2)Br 34a_100000174875_100010243470 [0,2,0,0,0,0|2,0,0]=4 13219 B18R2.269 Brc1ccc(cc1)CNCc2ccnc(c2)Br 34a_100025757509_100000189115 [0,2,0,0,0,0|2,0,0]=4 13220 B18R2.269 Brc1ccc(cc1)CNCc2cncc(c2)Br 207a_100000174875_100000687066 [0,2,0,0,0,0|2,0,0]=4 13221 B18R2.269 Brc1ccc(cc1)CNCc2cncc(c2)Br 207a_100011249555_100000186029 [0,2,0,0,0,0|2,0,0]=4 13222 B18R2.269 Brc1ccc(cc1)CNCc2cncc(c2)Br 2230a_100000174875_100000738771 [0,2,0,0,0,0|2,0,0]=4 13223 B18R2.269 Brc1ccc(cc1)CNCc2cncc(c2)Br 270004a_100000174875_100000687066 [0,2,0,0,0,0|2,0,0]=4 13224 B18R2.269 Brc1ccc(cc1)CNCc2cncc(c2)Br 270004a_100011249555_100000186029 [0,2,0,0,0,0|2,0,0]=4 13225 B18R2.269 Brc1ccc(cc1)CNCc2cncc(c2)Br 34a_100000174875_100000738771 [0,2,0,0,0,0|2,0,0]=4 13226 B18R2.269 Brc1ccc(cc1)COCc2cc(ccn2)Br 34a_100000695286_100010173614 [0,2,0,0,0,0|1,0,0]=3 13227 B18R2.269 Brc1ccc(cc1)COCc2cccc(c2)Br 34a_100000687537_100000189115 [0,2,0,0,0,0|0,0,0]=2 13228 B18R2.269 Brc1ccc(cc1)COCc2cccc(c2)Br 34a_100000695286_100000698116 [0,2,0,0,0,0|0,0,0]=2 13229 B18R2.269 Brc1ccc(cc1)COCc2cccc(c2)Br 7a_100000687537_100011217064 [0,2,0,0,0,0|0,0,0]=2 13230 B18R2.269 Brc1ccc(cc1)COCc2cccc(c2)I 34a_100000695286_100011218688 [0,2,0,0,0,0|0,0,0]=2 13231 B18R2.269 Brc1ccc(cc1)COCc2cccc(c2)I 34a_100011215336_100000189115 [0,2,0,0,0,0|0,0,0]=2 13232 B18R2.269 Brc1ccc(cc1)COCc2cccc(c2)I 7a_100011215336_100011217064 [0,2,0,0,0,0|0,0,0]=2 13233 B18R2.269 Brc1ccc(cc1)COCc2cccc(n2)Br 34a_100000694195_100000189115 [0,2,0,0,0,0|1,0,0]=3 13234 B18R2.269 Brc1ccc(cc1)COCc2cccc(n2)Br 34a_100000695286_100009889011 [0,2,0,0,0,0|1,0,0]=3 13235 B18R2.269 Brc1ccc(cc1)COCc2ccnc(c2)Br 34a_100000695286_100010243470 [0,2,0,0,0,0|1,0,0]=3 13236 B18R2.269 Brc1ccc(cc1)COCc2ccnc(c2)Br 34a_100009814636_100000189115 [0,2,0,0,0,0|1,0,0]=3 13237 B18R2.269 Brc1ccc(cc1)COCc2ccnc(c2)Br 7a_100009814636_100011217064 [0,2,0,0,0,0|1,0,0]=3 13238 B18R2.269 Brc1ccc(cc1)COCc2cncc(c2)Br 34a_100000695286_100000738771 [0,2,0,0,0,0|1,0,0]=3 13239 B18R2.269 Brc1ccc(cc1)COCc2cncc(c2)Br 34a_100011259137_100000189115 [0,2,0,0,0,0|1,0,0]=3 13240 B18R2.269 Brc1ccc(cc1)COCc2cncc(c2)Br 7a_100011259137_100011217064 [0,2,0,0,0,0|1,0,0]=3 13241 B18R2.269 Brc1ccc(cc1)CSCc2cc(ccn2)Br 62a_100000189115_100010173614 [0,2,0,0,0,0|1,1,0]=4 13242 B18R2.269 Brc1ccc(cc1)CSCc2cc(ccn2)Br 62a_100010173614_100000189115 [0,2,0,0,0,0|1,1,0]=4 13243 B18R2.269 Brc1ccc(cc1)CSCc2cccc(c2)Br 62a_100000189115_100000211773 [0,2,0,0,0,0|0,1,0]=3 13244 B18R2.269 Brc1ccc(cc1)CSCc2cccc(c2)Br 62a_100000211773_100000189115 [0,2,0,0,0,0|0,1,0]=3 13245 B18R2.269 Brc1ccc(cc1)CSCc2cccc(c2)I 62a_100000189115_100011218688 [0,2,0,0,0,0|0,1,0]=3 13246 B18R2.269 Brc1ccc(cc1)CSCc2cccc(c2)I 62a_100011218688_100000189115 [0,2,0,0,0,0|0,1,0]=3 13247 B18R2.269 Brc1ccc(cc1)CSCc2cccc(n2)Br 62a_100000189115_100009889011 [0,2,0,0,0,0|1,1,0]=4 13248 B18R2.269 Brc1ccc(cc1)CSCc2cccc(n2)Br 62a_100009889011_100000189115 [0,2,0,0,0,0|1,1,0]=4 13249 B18R2.269 Brc1ccc(cc1)CSCc2ccnc(c2)Br 62a_100000189115_100010243470 [0,2,0,0,0,0|1,1,0]=4 13250 B18R2.269 Brc1ccc(cc1)CSCc2ccnc(c2)Br 62a_100010254460_100000189115 [0,2,0,0,0,0|1,1,0]=4 13251 B18R2.269 Brc1ccc(cc1)CSCc2cncc(c2)Br 62a_100000189115_100000738771 [0,2,0,0,0,0|1,1,0]=4 13252 B18R2.269 Brc1ccc(cc1)CSCc2cncc(c2)Br 62a_100000738771_100000189115 [0,2,0,0,0,0|1,1,0]=4 13253 B18R2.269 Brc1ccc(cc1)NCCc2cccc(c2)Br 2230a_100000210018_100011740638 [0,2,0,0,0,0|2,0,0]=4 13254 B18R2.269 Brc1ccc(cc1)NCCc2cccc(c2)Br 34a_100000210018_100011740638 [0,2,0,0,0,0|2,0,0]=4 13255 B18R2.269 Brc1ccc(cc1)OCCc2cccc(c2)Br 34a_100000185759_100011740638 [0,2,0,0,0,0|2,0,0]=4 13256 B18R2.269 Brc1ccc(cc1)OCCc2cccc(c2)Br 7a_100000185759_100011740638 [0,2,0,0,0,0|2,0,0]=4 13257 B18R2.269 Brc1ccc(cc1)SCCc2cccc(c2)Br 62a_100000752885_100011740638 [0,2,0,0,0,0|2,0,0]=4 13258 B18R2.269 Brc1ccc(cc1)SCCc2cccc(c2)Br 62a_100011740638_100000752885 [0,2,0,0,0,0|2,0,0]=4 13259 B18R2.269 Brc1ccc(cn1)CNCc2cccc(c2)I 207a_100009817727_100000014684 [0,2,0,0,0,0|2,0,0]=4 13260 B18R2.269 Brc1ccc(cn1)CNCc2cccc(c2)I 2230a_100000106179_100009831999 [0,2,0,0,0,0|2,0,0]=4 13261 B18R2.269 Brc1ccc(cn1)CNCc2cccc(c2)I 2230a_100009817727_100011218688 [0,2,0,0,0,0|2,0,0]=4 13262 B18R2.269 Brc1ccc(cn1)CNCc2cccc(c2)I 270004a_100009817727_100000014684 [0,2,0,0,0,0|2,0,0]=4 13263 B18R2.269 Brc1ccc(cn1)CNCc2cccc(c2)I 34a_100000106179_100009831999 [0,2,0,0,0,0|2,0,0]=4 13264 B18R2.269 Brc1ccc(cn1)CNCc2cccc(c2)I 34a_100009817727_100011218688 [0,2,0,0,0,0|2,0,0]=4 13265 B18R2.269 Brc1ccc(cn1)COCc2cccc(c2)I 34a_100009816760_100011218688 [0,2,0,0,0,0|1,0,0]=3 13266 B18R2.269 Brc1ccc(cn1)COCc2cccc(c2)I 34a_100011215336_100009831999 [0,2,0,0,0,0|1,0,0]=3 13267 B18R2.269 Brc1ccc(cn1)COCc2cccc(c2)I 7a_100009816760_100011218688 [0,2,0,0,0,0|1,0,0]=3 13268 B18R2.269 Brc1ccc(cn1)COCc2cccc(c2)I 7a_100011215336_100009831999 [0,2,0,0,0,0|1,0,0]=3 13269 B18R2.269 Brc1ccc(cn1)COCc2cccc(n2)Br 34a_100000694195_100009831999 [0,2,0,0,0,0|2,0,0]=4 13270 B18R2.269 Brc1ccc(cn1)COCc2cccc(n2)Br 34a_100009816760_100009889011 [0,2,0,0,0,0|2,0,0]=4 13271 B18R2.269 Brc1ccc(cn1)COCc2cccc(n2)Br 7a_100009816760_100009889011 [0,2,0,0,0,0|2,0,0]=4 13272 B18R2.269 Brc1ccc(cn1)COCc2ccnc(c2)Br 34a_100009814636_100009831999 [0,2,0,0,0,0|2,0,0]=4 13273 B18R2.269 Brc1ccc(cn1)COCc2ccnc(c2)Br 34a_100009816760_100010243470 [0,2,0,0,0,0|2,0,0]=4 13274 B18R2.269 Brc1ccc(cn1)COCc2ccnc(c2)Br 7a_100009814636_100009831999 [0,2,0,0,0,0|2,0,0]=4 13275 B18R2.269 Brc1ccc(cn1)COCc2ccnc(c2)Br 7a_100009816760_100010254460 [0,2,0,0,0,0|2,0,0]=4 13276 B18R2.269 Brc1ccc(cn1)CSCc2cccc(c2)I 62a_100009831999_100011218688 [0,2,0,0,0,0|1,1,0]=4 13277 B18R2.269 Brc1ccc(cn1)CSCc2cccc(c2)I 62a_100011218688_100009831999 [0,2,0,0,0,0|1,1,0]=4 13278 B18R2.269 Brc1ccc(nc1)CNCc2cccc(c2)Br 207a_100000174977_100000754260 [0,2,0,0,0,0|2,0,0]=4 13279 B18R2.269 Brc1ccc(nc1)CNCc2cccc(c2)Br 2230a_100000174977_100000702658 [0,2,0,0,0,0|2,0,0]=4 13280 B18R2.269 Brc1ccc(nc1)CNCc2cccc(c2)Br 270004a_100000174977_100000754260 [0,2,0,0,0,0|2,0,0]=4 13281 B18R2.269 Brc1ccc(nc1)CNCc2cccc(c2)Br 34a_100000174977_100000702658 [0,2,0,0,0,0|2,0,0]=4 13282 B18R2.269 Brc1ccc(nc1)CNCc2cccc(c2)Br 34a_100015188789_100000698116 [0,2,0,0,0,0|2,0,0]=4 13283 B18R2.269 Brc1ccc(nc1)CNCc2cccc(c2)I 207a_100000106179_100000754260 [0,2,0,0,0,0|2,0,0]=4 13284 B18R2.269 Brc1ccc(nc1)CNCc2cccc(c2)I 2230a_100000106179_100000702658 [0,2,0,0,0,0|2,0,0]=4 13285 B18R2.269 Brc1ccc(nc1)CNCc2cccc(c2)I 270004a_100000106179_100000754260 [0,2,0,0,0,0|2,0,0]=4 13286 B18R2.269 Brc1ccc(nc1)CNCc2cccc(c2)I 34a_100000106179_100000702658 [0,2,0,0,0,0|2,0,0]=4 13287 B18R2.269 Brc1ccc(nc1)CNCc2cccc(c2)I 34a_100015188789_100011218688 [0,2,0,0,0,0|2,0,0]=4 13288 B18R2.269 Brc1ccc(nc1)COCc2cc(ccn2)Br 34a_100000754261_100010173614 [0,2,0,0,0,0|2,0,0]=4 13289 B18R2.269 Brc1ccc(nc1)COCc2cccc(c2)Br 34a_100000687537_100000702658 [0,2,0,0,0,0|1,0,0]=3 13290 B18R2.269 Brc1ccc(nc1)COCc2cccc(c2)Br 34a_100000754261_100000698116 [0,2,0,0,0,0|1,0,0]=3 13291 B18R2.269 Brc1ccc(nc1)COCc2cccc(c2)Br 7a_100000687537_100000702658 [0,2,0,0,0,0|1,0,0]=3 13292 B18R2.269 Brc1ccc(nc1)COCc2cccc(c2)I 34a_100000754261_100011218688 [0,2,0,0,0,0|1,0,0]=3 13293 B18R2.269 Brc1ccc(nc1)COCc2cccc(c2)I 34a_100011215336_100000702658 [0,2,0,0,0,0|1,0,0]=3 13294 B18R2.269 Brc1ccc(nc1)COCc2cccc(c2)I 7a_100011215336_100000702658 [0,2,0,0,0,0|1,0,0]=3 13295 B18R2.269 Brc1ccc(nc1)COCc2cccc(n2)Br 34a_100000694195_100000702658 [0,2,0,0,0,0|2,0,0]=4 13296 B18R2.269 Brc1ccc(nc1)COCc2cccc(n2)Br 34a_100000754261_100009889011 [0,2,0,0,0,0|2,0,0]=4 13297 B18R2.269 Brc1ccc(nc1)COCc2ccnc(c2)Br 34a_100000754261_100010243470 [0,2,0,0,0,0|2,0,0]=4 13298 B18R2.269 Brc1ccc(nc1)COCc2ccnc(c2)Br 34a_100009814636_100000702658 [0,2,0,0,0,0|2,0,0]=4 13299 B18R2.269 Brc1ccc(nc1)COCc2ccnc(c2)Br 7a_100009814636_100000702658 [0,2,0,0,0,0|2,0,0]=4 13300 B18R2.269 Brc1ccc(nc1)COCc2cncc(c2)Br 34a_100000754261_100000738771 [0,2,0,0,0,0|2,0,0]=4 13301 B18R2.269 Brc1ccc(nc1)COCc2cncc(c2)Br 34a_100011259137_100000702658 [0,2,0,0,0,0|2,0,0]=4 13302 B18R2.269 Brc1ccc(nc1)COCc2cncc(c2)Br 7a_100011259137_100000702658 [0,2,0,0,0,0|2,0,0]=4 13303 B18R2.269 Brc1ccc(nc1)CSCc2cccc(c2)Br 62a_100000211773_100000702658 [0,2,0,0,0,0|1,1,0]=4 13304 B18R2.269 Brc1ccc(nc1)CSCc2cccc(c2)Br 62a_100000702658_100000211773 [0,2,0,0,0,0|1,1,0]=4 13305 B18R2.269 Brc1ccc(nc1)CSCc2cccc(c2)I 62a_100000702658_100011218688 [0,2,0,0,0,0|1,1,0]=4 13306 B18R2.269 Brc1ccc(nc1)CSCc2cccc(c2)I 62a_100011218688_100000702658 [0,2,0,0,0,0|1,1,0]=4 13307 B18R2.269 Brc1cccc(c1)CCNc2ccc(cc2)I 34a_100000185761_100011740638 [0,2,0,0,0,0|2,0,0]=4 13308 B18R2.269 Brc1cccc(c1)CCOc2ccc(cc2)I 34a_100000212066_100011740638 [0,2,0,0,0,0|2,0,0]=4 13309 B18R2.269 Brc1cccc(c1)CCOc2ccc(cc2)I 7a_100000212066_100011740638 [0,2,0,0,0,0|2,0,0]=4 13310 B18R2.269 Brc1cccc(c1)CNCc2ccc(cc2)I 207a_100000174977_100000188517 [0,2,0,0,0,0|1,0,0]=3 13311 B18R2.269 Brc1cccc(c1)CNCc2ccc(cc2)I 207a_100016989417_100000210085 [0,2,0,0,0,0|1,0,0]=3 13312 B18R2.269 Brc1cccc(c1)CNCc2ccc(cc2)I 2230a_100000174977_100000189116 [0,2,0,0,0,0|1,0,0]=3 13313 B18R2.269 Brc1cccc(c1)CNCc2ccc(cc2)I 2230a_100016989417_100000698116 [0,2,0,0,0,0|1,0,0]=3 13314 B18R2.269 Brc1cccc(c1)CNCc2ccc(cc2)I 270004a_100016989417_100000210085 [0,2,0,0,0,0|1,0,0]=3 13315 B18R2.269 Brc1cccc(c1)CNCc2ccc(cc2)I 34a_100000174977_100000189116 [0,2,0,0,0,0|1,0,0]=3 13316 B18R2.269 Brc1cccc(c1)CNCc2ccc(cc2)I 34a_100016989417_100000698116 [0,2,0,0,0,0|1,0,0]=3 13317 B18R2.269 Brc1cccc(c1)CNCc2ccc(nc2)Br 207a_100009817727_100000210085 [0,2,0,0,0,0|2,0,0]=4 13318 B18R2.269 Brc1cccc(c1)CNCc2ccc(nc2)Br 2230a_100000174977_100009831999 [0,2,0,0,0,0|2,0,0]=4 13319 B18R2.269 Brc1cccc(c1)CNCc2ccc(nc2)Br 2230a_100009817727_100000698116 [0,2,0,0,0,0|2,0,0]=4 13320 B18R2.269 Brc1cccc(c1)CNCc2ccc(nc2)Br 270004a_100009817727_100000210085 [0,2,0,0,0,0|2,0,0]=4 13321 B18R2.269 Brc1cccc(c1)CNCc2ccc(nc2)Br 34a_100000174977_100009831999 [0,2,0,0,0,0|2,0,0]=4 13322 B18R2.269 Brc1cccc(c1)CNCc2ccc(nc2)Br 34a_100009817727_100000698116 [0,2,0,0,0,0|2,0,0]=4 13323 B18R2.269 Brc1cccc(c1)COCc2ccc(cc2)I 34a_100000687537_100000189116 [0,2,0,0,0,0|0,0,0]=2 13324 B18R2.269 Brc1cccc(c1)COCc2ccc(cc2)I 34a_100000690907_100000698116 [0,2,0,0,0,0|0,0,0]=2 13325 B18R2.269 Brc1cccc(c1)COCc2ccc(cc2)I 7a_100000687537_100000189116 [0,2,0,0,0,0|0,0,0]=2 13326 B18R2.269 Brc1cccc(c1)COCc2ccc(cc2)I 7a_100000690907_100000211773 [0,2,0,0,0,0|0,0,0]=2 13327 B18R2.269 Brc1cccc(c1)COCc2ccc(nc2)Br 34a_100000687537_100009831999 [0,2,0,0,0,0|1,0,0]=3 13328 B18R2.269 Brc1cccc(c1)COCc2ccc(nc2)Br 34a_100009816760_100000698116 [0,2,0,0,0,0|1,0,0]=3 13329 B18R2.269 Brc1cccc(c1)COCc2ccc(nc2)Br 7a_100000687537_100009831999 [0,2,0,0,0,0|1,0,0]=3 13330 B18R2.269 Brc1cccc(c1)COCc2ccc(nc2)Br 7a_100009816760_100000211773 [0,2,0,0,0,0|1,0,0]=3 13331 B18R2.269 Brc1cccc(c1)CSCc2ccc(cc2)I 62a_100000189116_100000211773 [0,2,0,0,0,0|0,1,0]=3 13332 B18R2.269 Brc1cccc(c1)CSCc2ccc(cc2)I 62a_100000211773_100000189116 [0,2,0,0,0,0|0,1,0]=3 13333 B18R2.269 Brc1cccc(c1)CSCc2ccc(nc2)Br 62a_100000211773_100009831999 [0,2,0,0,0,0|1,1,0]=4 13334 B18R2.269 Brc1cccc(c1)CSCc2ccc(nc2)Br 62a_100009831999_100000211773 [0,2,0,0,0,0|1,1,0]=4 13335 B18R2.269 Brc1cccc(n1)CNCc2ccc(cc2)I 2230a_100016987751_100000189116 [0,2,0,0,0,0|2,0,0]=4 13336 B18R2.269 Brc1cccc(n1)CNCc2ccc(cc2)I 2230a_100016989417_100009889011 [0,2,0,0,0,0|2,0,0]=4 13337 B18R2.269 Brc1cccc(n1)CNCc2ccc(cc2)I 270004a_100016989417_100000688028 [0,2,0,0,0,0|2,0,0]=4 13338 B18R2.269 Brc1cccc(n1)CNCc2ccc(cc2)I 34a_100016989417_100009889011 [0,2,0,0,0,0|2,0,0]=4 13339 B18R2.269 Brc1cccc(n1)COCc2ccc(cc2)I 34a_100000690907_100009889011 [0,2,0,0,0,0|1,0,0]=3 13340 B18R2.269 Brc1cccc(n1)COCc2ccc(cc2)I 34a_100000694195_100000189116 [0,2,0,0,0,0|1,0,0]=3 13341 B18R2.269 Brc1cccc(n1)COCc2ccc(cc2)I 7a_100000690907_100009889011 [0,2,0,0,0,0|1,0,0]=3 13342 B18R2.269 Brc1cccc(n1)CSCc2ccc(cc2)I 62a_100000189116_100009889011 [0,2,0,0,0,0|1,1,0]=4 13343 B18R2.269 Brc1cccc(n1)CSCc2ccc(cc2)I 62a_100009889011_100000189116 [0,2,0,0,0,0|1,1,0]=4 13344 B18R2.269 Brc1ccnc(c1)CNCc2ccc(cc2)I 2230a_100016989417_100010173614 [0,2,0,0,0,0|2,0,0]=4 13345 B18R2.269 Brc1ccnc(c1)CNCc2ccc(cc2)I 270004a_100016989417_100009818557 [0,2,0,0,0,0|2,0,0]=4 13346 B18R2.269 Brc1ccnc(c1)CNCc2ccc(cc2)I 34a_100016989417_100010173614 [0,2,0,0,0,0|2,0,0]=4 13347 B18R2.269 Brc1ccnc(c1)COCc2ccc(cc2)I 34a_100000690907_100010173614 [0,2,0,0,0,0|1,0,0]=3 13348 B18R2.269 Brc1ccnc(c1)COCc2ccc(cc2)I 7a_100000690907_100010173614 [0,2,0,0,0,0|1,0,0]=3 13349 B18R2.269 Brc1ccnc(c1)COCc2ccc(nc2)Br 34a_100009816760_100010173614 [0,2,0,0,0,0|2,0,0]=4 13350 B18R2.269 Brc1ccnc(c1)COCc2ccc(nc2)Br 7a_100009816760_100010173614 [0,2,0,0,0,0|2,0,0]=4 13351 B18R2.269 Brc1ccnc(c1)CSCc2ccc(cc2)I 62a_100000189116_100010173614 [0,2,0,0,0,0|1,1,0]=4 13352 B18R2.269 Brc1ccnc(c1)CSCc2ccc(cc2)I 62a_100010173614_100000189116 [0,2,0,0,0,0|1,1,0]=4 13353 B18R2.269 Brc1cnc(nc1)COCc2cccc(c2)Br 34a_100000687537_100010064664 [0,2,0,0,0,0|2,0,0]=4 13354 B18R2.269 Brc1cnc(nc1)COCc2cccc(c2)Br 7a_100000687537_100010064664 [0,2,0,0,0,0|2,0,0]=4 13355 B18R2.269 Brc1cnc(nc1)COCc2cccc(c2)I 34a_100011215336_100010064664 [0,2,0,0,0,0|2,0,0]=4 13356 B18R2.269 Brc1cnc(nc1)COCc2cccc(c2)I 7a_100011215336_100010064664 [0,2,0,0,0,0|2,0,0]=4 13357 B18R2.269 Brc1cncc(c1)CNCc2ccc(cc2)I 207a_100011249555_100000188517 [0,2,0,0,0,0|2,0,0]=4 13358 B18R2.269 Brc1cncc(c1)CNCc2ccc(cc2)I 207a_100016989417_100000687066 [0,2,0,0,0,0|2,0,0]=4 13359 B18R2.269 Brc1cncc(c1)CNCc2ccc(cc2)I 2230a_100016989417_100000738771 [0,2,0,0,0,0|2,0,0]=4 13360 B18R2.269 Brc1cncc(c1)CNCc2ccc(cc2)I 270004a_100016989417_100000687066 [0,2,0,0,0,0|2,0,0]=4 13361 B18R2.269 Brc1cncc(c1)CNCc2ccc(cc2)I 34a_100016989417_100000738771 [0,2,0,0,0,0|2,0,0]=4 13362 B18R2.269 Brc1cncc(c1)COCc2ccc(cc2)I 34a_100000690907_100000738771 [0,2,0,0,0,0|1,0,0]=3 13363 B18R2.269 Brc1cncc(c1)COCc2ccc(cc2)I 34a_100011259137_100000189116 [0,2,0,0,0,0|1,0,0]=3 13364 B18R2.269 Brc1cncc(c1)COCc2ccc(cc2)I 7a_100000690907_100000738771 [0,2,0,0,0,0|1,0,0]=3 13365 B18R2.269 Brc1cncc(c1)COCc2ccc(cc2)I 7a_100011259137_100000189116 [0,2,0,0,0,0|1,0,0]=3 13366 B18R2.269 Brc1cncc(c1)COCc2ccc(nc2)Br 34a_100009816760_100000738771 [0,2,0,0,0,0|2,0,0]=4 13367 B18R2.269 Brc1cncc(c1)COCc2ccc(nc2)Br 34a_100011259137_100009831999 [0,2,0,0,0,0|2,0,0]=4 13368 B18R2.269 Brc1cncc(c1)COCc2ccc(nc2)Br 7a_100009816760_100000738771 [0,2,0,0,0,0|2,0,0]=4 13369 B18R2.269 Brc1cncc(c1)COCc2ccc(nc2)Br 7a_100011259137_100009831999 [0,2,0,0,0,0|2,0,0]=4 13370 B18R2.269 Brc1cncc(c1)CSCc2ccc(cc2)I 62a_100000189116_100000738771 [0,2,0,0,0,0|1,1,0]=4 13371 B18R2.269 Brc1cncc(c1)CSCc2ccc(cc2)I 62a_100000738771_100000189116 [0,2,0,0,0,0|1,1,0]=4 13372 B18R2.269 C[n+]1ccc(cc1)COCc2cc(ccn2)Br 34a_100009831711_100010173614 [0,2,0,0,0,0|2,0,0]=4 13373 B18R2.269 C[n+]1ccc(cc1)COCc2cc(ccn2)Cl 34a_100009831711_100016988179 [0,2,0,0,0,0|2,0,0]=4 13374 B18R2.269 C[n+]1ccc(cc1)COCc2cccc(c2)Br 34a_100009831711_100000698116 [0,2,0,0,0,0|1,0,0]=3 13375 B18R2.269 C[n+]1ccc(cc1)COCc2cccc(c2)Cl 34a_100009831711_100000187163 [0,2,0,0,0,0|1,0,0]=3 13376 B18R2.269 C[n+]1ccc(cc1)COCc2cccc(c2)F 34a_100009831711_100000187166 [0,2,0,0,0,0|1,0,0]=3 13377 B18R2.269 C[n+]1ccc(cc1)COCc2cccc(c2)I 34a_100009831711_100011218688 [0,2,0,0,0,0|1,0,0]=3 13378 B18R2.269 C[n+]1ccc(cc1)COCc2cccc(c2)O 34a_100009831711_100011660834 [0,2,0,0,0,0|1,0,0]=3 13379 B18R2.269 C[n+]1ccc(cc1)COCc2cccc(n2)Br 34a_100009831711_100009889011 [0,2,0,0,0,0|2,0,0]=4 13380 B18R2.269 C[n+]1ccc(cc1)COCc2cccc(n2)Cl 34a_100009831711_100000086093 [0,2,0,0,0,0|2,0,0]=4 13381 B18R2.269 C[n+]1ccc(cc1)COCc2cccc(n2)F 34a_100009831711_100009819644 [0,2,0,0,0,0|2,0,0]=4 13382 B18R2.269 C[n+]1ccc(cc1)COCc2ccnc(c2)Br 34a_100009831711_100010243470 [0,2,0,0,0,0|2,0,0]=4 13383 B18R2.269 C[n+]1ccc(cc1)COCc2ccnc(c2)Cl 34a_100009831711_100000764220 [0,2,0,0,0,0|2,0,0]=4 13384 B18R2.269 C[n+]1ccc(cc1)COCc2cncc(c2)Br 34a_100009831711_100000738771 [0,2,0,0,0,0|2,0,0]=4 13385 B18R2.269 C[n+]1ccc(cc1)COCc2cncc(c2)Cl 34a_100009831711_100016992070 [0,2,0,0,0,0|2,0,0]=4 13386 B18R2.269 C[n+]1ccc(cc1)COCc2cncc(c2)F 34a_100009831711_100000725299 [0,2,0,0,0,0|2,0,0]=4 13387 B18R2.269 Cc1cc(ccn1)CNCc2ccc(cc2)Br 207a_100000174875_100011361630 [0,2,0,0,0,0|2,0,0]=4 13388 B18R2.269 Cc1cc(ccn1)CNCc2ccc(cc2)Br 207a_100011934566_100000186029 [0,2,0,0,0,0|2,0,0]=4 13389 B18R2.269 Cc1cc(ccn1)CNCc2ccc(cc2)Br 2230a_100000174875_200020672517 [0,2,0,0,0,0|2,0,0]=4 13390 B18R2.269 Cc1cc(ccn1)CNCc2ccc(cc2)Br 270004a_100000174875_100011361630 [0,2,0,0,0,0|2,0,0]=4 13391 B18R2.269 Cc1cc(ccn1)CNCc2ccc(cc2)Br 270004a_100011934566_100000186029 [0,2,0,0,0,0|2,0,0]=4 13392 B18R2.269 Cc1cc(ccn1)CNCc2ccc(cc2)Br 34a_100000174875_200020672517 [0,2,0,0,0,0|2,0,0]=4 13393 B18R2.269 Cc1cc(ccn1)CNCc2ccc(cc2)Br 34a_100011934566_100000189115 [0,2,0,0,0,0|2,0,0]=4 13394 B18R2.269 Cc1cc(ccn1)CNCc2ccc(cc2)Cl 207a_100000174871_100011361630 [0,2,0,0,0,0|2,0,0]=4 13395 B18R2.269 Cc1cc(ccn1)CNCc2ccc(cc2)Cl 207a_100011934566_100000189385 [0,2,0,0,0,0|2,0,0]=4 13396 B18R2.269 Cc1cc(ccn1)CNCc2ccc(cc2)Cl 2230a_100000174871_200020672517 [0,2,0,0,0,0|2,0,0]=4 13397 B18R2.269 Cc1cc(ccn1)CNCc2ccc(cc2)Cl 270004a_100000174871_100011361630 [0,2,0,0,0,0|2,0,0]=4 13398 B18R2.269 Cc1cc(ccn1)CNCc2ccc(cc2)Cl 270004a_100011934566_100000189385 [0,2,0,0,0,0|2,0,0]=4 13399 B18R2.269 Cc1cc(ccn1)CNCc2ccc(cc2)Cl 34a_100000174871_200020672517 [0,2,0,0,0,0|2,0,0]=4 13400 B18R2.269 Cc1cc(ccn1)CNCc2ccc(cc2)Cl 34a_100011934566_100000694040 [0,2,0,0,0,0|2,0,0]=4 13401 B18R2.269 Cc1cc(ccn1)CNCc2ccc(cc2)F 207a_100000174882_100011361630 [0,2,0,0,0,0|2,0,0]=4 13402 B18R2.269 Cc1cc(ccn1)CNCc2ccc(cc2)F 207a_100011934566_100000210084 [0,2,0,0,0,0|2,0,0]=4 13403 B18R2.269 Cc1cc(ccn1)CNCc2ccc(cc2)F 2230a_100000174882_200020672517 [0,2,0,0,0,0|2,0,0]=4 13404 B18R2.269 Cc1cc(ccn1)CNCc2ccc(cc2)F 270004a_100000174882_100011361630 [0,2,0,0,0,0|2,0,0]=4 13405 B18R2.269 Cc1cc(ccn1)CNCc2ccc(cc2)F 270004a_100011934566_100000210084 [0,2,0,0,0,0|2,0,0]=4 13406 B18R2.269 Cc1cc(ccn1)CNCc2ccc(cc2)F 34a_100000174882_200020672517 [0,2,0,0,0,0|2,0,0]=4 13407 B18R2.269 Cc1cc(ccn1)CNCc2ccc(cc2)F 34a_100011934566_100000198546 [0,2,0,0,0,0|2,0,0]=4 13408 B18R2.269 Cc1cc(ccn1)CNCc2ccc(cc2)I 207a_100011934566_100000188517 [0,2,0,0,0,0|2,0,0]=4 13409 B18R2.269 Cc1cc(ccn1)CNCc2ccc(cc2)I 207a_100016989417_100011361630 [0,2,0,0,0,0|2,0,0]=4 13410 B18R2.269 Cc1cc(ccn1)CNCc2ccc(cc2)I 2230a_100016989417_200020672517 [0,2,0,0,0,0|2,0,0]=4 13411 B18R2.269 Cc1cc(ccn1)CNCc2ccc(cc2)I 270004a_100016989417_100011361630 [0,2,0,0,0,0|2,0,0]=4 13412 B18R2.269 Cc1cc(ccn1)CNCc2ccc(cc2)I 34a_100011934566_100000189116 [0,2,0,0,0,0|2,0,0]=4 13413 B18R2.269 Cc1cc(ccn1)CNCc2ccc(cc2)I 34a_100016989417_200020672517 [0,2,0,0,0,0|2,0,0]=4 13414 B18R2.269 Cc1cc(ccn1)CNCc2ccc(cc2)O 34a_100000185549_200020672517 [0,2,0,0,0,0|2,0,0]=4 13415 B18R2.269 Cc1cc(ccn1)COCc2cc[n+](cc2)C 34a_100009831711_200020672517 [0,2,0,0,0,0|2,0,0]=4 13416 B18R2.269 Cc1cc(ccn1)COCc2cc[n+](cc2)[O-] 34a_100000031831_200020672517 [0,2,0,0,0,0|2,0,0]=4 13417 B18R2.269 Cc1cc(ccn1)COCc2cc[n+](cc2)[O-] 7a_100000031831_200020672517 [0,2,0,0,0,0|2,0,0]=4 13418 B18R2.269 Cc1cc(ccn1)COCc2ccc(=O)[nH]c2 34a_100011999846_200020672517 [0,2,0,0,0,0|2,0,0]=4 13419 B18R2.269 Cc1cc(ccn1)COCc2ccc(cc2)Br 34a_100000695286_200020672517 [0,2,0,0,0,0|1,0,0]=3 13420 B18R2.269 Cc1cc(ccn1)COCc2ccc(cc2)Br 34a_100011998630_100000189115 [0,2,0,0,0,0|1,0,0]=3 13421 B18R2.269 Cc1cc(ccn1)COCc2ccc(cc2)Cl 34a_100000211118_200020672517 [0,2,0,0,0,0|1,0,0]=3 13422 B18R2.269 Cc1cc(ccn1)COCc2ccc(cc2)Cl 34a_100011998630_100000694040 [0,2,0,0,0,0|1,0,0]=3 13423 B18R2.269 Cc1cc(ccn1)COCc2ccc(cc2)Cl 7a_100000211118_200020672517 [0,2,0,0,0,0|1,0,0]=3 13424 B18R2.269 Cc1cc(ccn1)COCc2ccc(cc2)F 34a_100000210977_200020672517 [0,2,0,0,0,0|1,0,0]=3 13425 B18R2.269 Cc1cc(ccn1)COCc2ccc(cc2)F 34a_100011998630_100000198546 [0,2,0,0,0,0|1,0,0]=3 13426 B18R2.269 Cc1cc(ccn1)COCc2ccc(cc2)F 7a_100000210977_200020672517 [0,2,0,0,0,0|1,0,0]=3 13427 B18R2.269 Cc1cc(ccn1)COCc2ccc(cc2)I 34a_100000690907_200020672517 [0,2,0,0,0,0|1,0,0]=3 13428 B18R2.269 Cc1cc(ccn1)COCc2ccc(cc2)I 34a_100011998630_100000189116 [0,2,0,0,0,0|1,0,0]=3 13429 B18R2.269 Cc1cc(ccn1)COCc2ccc(cc2)I 7a_100000690907_200020672517 [0,2,0,0,0,0|1,0,0]=3 13430 B18R2.269 Cc1cc(ccn1)COCc2ccc(cc2)N 34a_100011215238_200020672517 [0,2,0,0,0,0|1,0,0]=3 13431 B18R2.269 Cc1cc(ccn1)COCc2ccc(cn2)Br 34a_100000754261_200020672517 [0,2,0,0,0,0|2,0,0]=4 13432 B18R2.269 Cc1cc(ccn1)COCc2ccc(cn2)Br 34a_100011998630_100000702658 [0,2,0,0,0,0|2,0,0]=4 13433 B18R2.269 Cc1cc(ccn1)COCc2ccc(cn2)Cl 34a_100000703999_200020672517 [0,2,0,0,0,0|2,0,0]=4 13434 B18R2.269 Cc1cc(ccn1)COCc2ccc(cn2)Cl 34a_100011998630_100012066911 [0,2,0,0,0,0|2,0,0]=4 13435 B18R2.269 Cc1cc(ccn1)COCc2ccc(cn2)F 34a_100011998630_100000703193 [0,2,0,0,0,0|2,0,0]=4 13436 B18R2.269 Cc1cc(ccn1)COCc2ccc(cn2)F 34a_100011999454_200020672517 [0,2,0,0,0,0|2,0,0]=4 13437 B18R2.269 Cc1cc(ccn1)COCc2ccc(cn2)N 34a_100011998161_200020672517 [0,2,0,0,0,0|2,0,0]=4 13438 B18R2.269 Cc1cc(ccn1)COCc2ccc(nc2)Br 34a_100009816760_200020672517 [0,2,0,0,0,0|2,0,0]=4 13439 B18R2.269 Cc1cc(ccn1)COCc2ccc(nc2)Br 34a_100011998630_100009831999 [0,2,0,0,0,0|2,0,0]=4 13440 B18R2.269 Cc1cc(ccn1)COCc2ccc(nc2)Br 7a_100009816760_200020672517 [0,2,0,0,0,0|2,0,0]=4 13441 B18R2.269 Cc1cc(ccn1)COCc2ccc(nc2)Cl 34a_100000755211_200020672517 [0,2,0,0,0,0|2,0,0]=4 13442 B18R2.269 Cc1cc(ccn1)COCc2ccc(nc2)Cl 34a_100011998630_100000735431 [0,2,0,0,0,0|2,0,0]=4 13443 B18R2.269 Cc1cc(ccn1)COCc2ccc(nc2)Cl 7a_100000755211_200020672517 [0,2,0,0,0,0|2,0,0]=4 13444 B18R2.269 Cc1cc(ccn1)COCc2ccc(nc2)F 34a_100000079959_200020672517 [0,2,0,0,0,0|2,0,0]=4 13445 B18R2.269 Cc1cc(ccn1)COCc2ccc(nc2)F 34a_100011998630_100000099788 [0,2,0,0,0,0|2,0,0]=4 13446 B18R2.269 Cc1cc(ccn1)COCc2ccc(nc2)N 34a_100000704267_200020672517 [0,2,0,0,0,0|2,0,0]=4 13447 B18R2.269 Cc1cc(ccn1)CSCc2ccc(cc2)Br 62a_100000189115_200020672517 [0,2,0,0,0,0|1,1,0]=4 13448 B18R2.269 Cc1cc(ccn1)CSCc2ccc(cc2)Br 62a_200020672517_100000189115 [0,2,0,0,0,0|1,1,0]=4 13449 B18R2.269 Cc1cc(ccn1)CSCc2ccc(cc2)Cl 62a_100000187161_200020672517 [0,2,0,0,0,0|1,1,0]=4 13450 B18R2.269 Cc1cc(ccn1)CSCc2ccc(cc2)Cl 62a_200020672517_100000187161 [0,2,0,0,0,0|1,1,0]=4 13451 B18R2.269 Cc1cc(ccn1)CSCc2ccc(cc2)F 62a_100000198546_200020672517 [0,2,0,0,0,0|1,1,0]=4 13452 B18R2.269 Cc1cc(ccn1)CSCc2ccc(cc2)F 62a_200020672517_100000187164 [0,2,0,0,0,0|1,1,0]=4 13453 B18R2.269 Cc1cc(ccn1)CSCc2ccc(cc2)I 62a_100000189116_200020672517 [0,2,0,0,0,0|1,1,0]=4 13454 B18R2.269 Cc1cc(ccn1)CSCc2ccc(cc2)I 62a_200020672517_100000189116 [0,2,0,0,0,0|1,1,0]=4 13455 B18R2.269 Cc1ccc(cc1)CCNc2cccc(c2)Br 34a_100000210019_100011713686 [0,2,0,0,0,0|2,0,0]=4 13456 B18R2.269 Cc1ccc(cc1)CCNc2cccc(c2)C 2230a_100000188690_100011713686 [0,2,0,0,0,0|2,0,0]=4 13457 B18R2.269 Cc1ccc(cc1)CCNc2cccc(c2)C 34a_100000188690_100011713686 [0,2,0,0,0,0|2,0,0]=4 13458 B18R2.269 Cc1ccc(cc1)CCNc2cccc(c2)Cl 34a_100000185859_100011713686 [0,2,0,0,0,0|2,0,0]=4 13459 B18R2.269 Cc1ccc(cc1)CCNc2cccc(c2)F 34a_100000210047_100011713686 [0,2,0,0,0,0|2,0,0]=4 13460 B18R2.269 Cc1ccc(cc1)CCNc2cccc(c2)I 34a_100000211102_100011713686 [0,2,0,0,0,0|2,0,0]=4 13461 B18R2.269 Cc1ccc(cc1)CCNc2cccc(c2)O 34a_100000210217_100011713686 [0,2,0,0,0,0|2,0,0]=4 13462 B18R2.269 Cc1ccc(cc1)CCOc2cccc(c2)Br 34a_100000210342_100011713686 [0,2,0,0,0,0|2,0,0]=4 13463 B18R2.269 Cc1ccc(cc1)CCOc2cccc(c2)Br 7a_100000210342_100011713686 [0,2,0,0,0,0|2,0,0]=4 13464 B18R2.269 Cc1ccc(cc1)CCOc2cccc(c2)C 34a_100000210337_100011713686 [0,2,0,0,0,0|2,0,0]=4 13465 B18R2.269 Cc1ccc(cc1)CCOc2cccc(c2)C 7a_100000210337_100011713686 [0,2,0,0,0,0|2,0,0]=4 13466 B18R2.269 Cc1ccc(cc1)CCOc2cccc(c2)Cl 34a_100000210295_100011713686 [0,2,0,0,0,0|2,0,0]=4 13467 B18R2.269 Cc1ccc(cc1)CCOc2cccc(c2)Cl 7a_100000210295_100011713686 [0,2,0,0,0,0|2,0,0]=4 13468 B18R2.269 Cc1ccc(cc1)CCOc2cccc(c2)F 34a_100000210426_100011713686 [0,2,0,0,0,0|2,0,0]=4 13469 B18R2.269 Cc1ccc(cc1)CCOc2cccc(c2)F 7a_100000210426_100011713686 [0,2,0,0,0,0|2,0,0]=4 13470 B18R2.269 Cc1ccc(cc1)CCOc2cccc(c2)I 34a_100000211634_100011713686 [0,2,0,0,0,0|2,0,0]=4 13471 B18R2.269 Cc1ccc(cc1)CCOc2cccc(c2)I 7a_100000211634_100011713686 [0,2,0,0,0,0|2,0,0]=4 13472 B18R2.269 Cc1ccc(cc1)CCOc2cccc(c2)N 34a_100000210217_100011713686 [0,2,0,0,0,0|2,0,0]=4 13473 B18R2.269 Cc1ccc(cc1)CCSc2cccc(c2)Br 62a_100000691529_100011713686 [0,2,0,0,0,0|2,0,0]=4 13474 B18R2.269 Cc1ccc(cc1)CCSc2cccc(c2)Br 62a_100011713686_100000691529 [0,2,0,0,0,0|2,0,0]=4 13475 B18R2.269 Cc1ccc(cc1)CCSc2cccc(c2)C 62a_100011215228_100011713686 [0,2,0,0,0,0|2,0,0]=4 13476 B18R2.269 Cc1ccc(cc1)CCSc2cccc(c2)C 62a_100011713686_100011215228 [0,2,0,0,0,0|2,0,0]=4 13477 B18R2.269 Cc1ccc(cc1)CCSc2cccc(c2)Cl 62a_100000699651_100011713686 [0,2,0,0,0,0|2,0,0]=4 13478 B18R2.269 Cc1ccc(cc1)CCSc2cccc(c2)Cl 62a_100011713686_100000699651 [0,2,0,0,0,0|2,0,0]=4 13479 B18R2.269 Cc1ccc(cc1)CCSc2cccc(c2)F 62a_100000685547_100011713686 [0,2,0,0,0,0|2,0,0]=4 13480 B18R2.269 Cc1ccc(cc1)CCSc2cccc(c2)F 62a_100011713686_100000685547 [0,2,0,0,0,0|2,0,0]=4 13481 B18R2.269 Cc1ccc(cc1)CCSc2cccc(c2)N 62a_100000210019_100011713686 [0,2,0,0,0,0|2,0,0]=4 13482 B18R2.269 Cc1ccc(cc1)CCSc2cccc(c2)N 62a_100011713686_100000210019 [0,2,0,0,0,0|2,0,0]=4 13483 B18R2.269 Cc1ccc(cc1)CCSc2cccc(c2)O 62a_100011713686_100000211634 [0,2,0,0,0,0|2,0,0]=4 13484 B18R2.269 Cc1ccc(cc1)CCSc2cccc(c2)[S] 62a_100011713686_114929384022 [0,2,0,0,0,0|2,0,0]=4 13485 B18R2.269 Cc1ccc(cc1)CCSc2cccc(c2)[S] 62a_114929384022_100011713686 [0,2,0,0,0,0|2,0,0]=4 13486 B18R2.269 Cc1ccc(cc1)CNCc2cc(ccn2)Br 2230a_100000174908_100010173614 [0,2,0,0,0,0|2,0,0]=4 13487 B18R2.269 Cc1ccc(cc1)CNCc2cc(ccn2)Br 270004a_100000174908_100009818557 [0,2,0,0,0,0|2,0,0]=4 13488 B18R2.269 Cc1ccc(cc1)CNCc2cc(ccn2)Br 34a_100000174908_100010173614 [0,2,0,0,0,0|2,0,0]=4 13489 B18R2.269 Cc1ccc(cc1)CNCc2cc(ccn2)C 207a_100000174908_100011361488 [0,2,0,0,0,0|2,0,0]=4 13490 B18R2.269 Cc1ccc(cc1)CNCc2cc(ccn2)C 2230a_100000174908_100000718516 [0,2,0,0,0,0|2,0,0]=4 13491 B18R2.269 Cc1ccc(cc1)CNCc2cc(ccn2)C 270004a_100000174908_100011361488 [0,2,0,0,0,0|2,0,0]=4 13492 B18R2.269 Cc1ccc(cc1)CNCc2cc(ccn2)C 34a_100000174908_100000718516 [0,2,0,0,0,0|2,0,0]=4 13493 B18R2.269 Cc1ccc(cc1)CNCc2cc(ccn2)Cl 2230a_100000174908_100016988179 [0,2,0,0,0,0|2,0,0]=4 13494 B18R2.269 Cc1ccc(cc1)CNCc2cc(ccn2)Cl 270004a_100000174908_100011998288 [0,2,0,0,0,0|2,0,0]=4 13495 B18R2.269 Cc1ccc(cc1)CNCc2cc(ccn2)Cl 34a_100000174908_100016988179 [0,2,0,0,0,0|2,0,0]=4 13496 B18R2.269 Cc1ccc(cc1)CNCc2cccc(=O)[nH]2 207a_100000174908_100011935257 [0,2,0,0,0,0|2,0,0]=4 13497 B18R2.269 Cc1ccc(cc1)CNCc2cccc(=O)[nH]2 2230a_100000696482_100000210814 [0,2,0,0,0,0|2,0,0]=4 13498 B18R2.269 Cc1ccc(cc1)CNCc2cccc(c2)Br 207a_100000174908_100000210085 [0,2,0,0,0,0|1,0,0]=3 13499 B18R2.269 Cc1ccc(cc1)CNCc2cccc(c2)Br 207a_100000174977_100000211033 [0,2,0,0,0,0|1,0,0]=3 13500 B18R2.269 Cc1ccc(cc1)CNCc2cccc(c2)Br 2230a_100000174908_100000698116 [0,2,0,0,0,0|1,0,0]=3 13501 B18R2.269 Cc1ccc(cc1)CNCc2cccc(c2)Br 2230a_100000174977_100000210814 [0,2,0,0,0,0|1,0,0]=3 13502 B18R2.269 Cc1ccc(cc1)CNCc2cccc(c2)Br 26a_100000174977_200020625495 [0,2,0,0,0,0|1,0,0]=3 13503 B18R2.269 Cc1ccc(cc1)CNCc2cccc(c2)Br 270004a_100000174908_100000210085 [0,2,0,0,0,0|1,0,0]=3 13504 B18R2.269 Cc1ccc(cc1)CNCc2cccc(c2)Br 270004a_100000174977_100000211033 [0,2,0,0,0,0|1,0,0]=3 13505 B18R2.269 Cc1ccc(cc1)CNCc2cccc(c2)Br 34a_100000174908_100000698116 [0,2,0,0,0,0|1,0,0]=3 13506 B18R2.269 Cc1ccc(cc1)CNCc2cccc(c2)Br 34a_100000174977_100000210814 [0,2,0,0,0,0|1,0,0]=3 13507 B18R2.269 Cc1ccc(cc1)CNCc2cccc(c2)C 207a_100000174908_100000211157 [0,2,0,0,0,0|1,0,0]=3 13508 B18R2.269 Cc1ccc(cc1)CNCc2cccc(c2)C 207a_100000185548_100000211033 [0,2,0,0,0,0|1,0,0]=3 13509 B18R2.269 Cc1ccc(cc1)CNCc2cccc(c2)C 2230a_100000174908_100000211840 [0,2,0,0,0,0|1,0,0]=3 13510 B18R2.269 Cc1ccc(cc1)CNCc2cccc(c2)C 2230a_100000185548_100000210814 [0,2,0,0,0,0|1,0,0]=3 13511 B18R2.269 Cc1ccc(cc1)CNCc2cccc(c2)C 270004a_100000174908_100000211157 [0,2,0,0,0,0|1,0,0]=3 13512 B18R2.269 Cc1ccc(cc1)CNCc2cccc(c2)C 270004a_100000185548_100000211033 [0,2,0,0,0,0|1,0,0]=3 13513 B18R2.269 Cc1ccc(cc1)CNCc2cccc(c2)C 34a_100000174908_100000211840 [0,2,0,0,0,0|1,0,0]=3 13514 B18R2.269 Cc1ccc(cc1)CNCc2cccc(c2)C 34a_100000185548_100000210814 [0,2,0,0,0,0|1,0,0]=3 13515 B18R2.269 Cc1ccc(cc1)CNCc2cccc(c2)Cl 207a_100000174878_100000211033 [0,2,0,0,0,0|1,0,0]=3 13516 B18R2.269 Cc1ccc(cc1)CNCc2cccc(c2)Cl 207a_100000174908_100000210801 [0,2,0,0,0,0|1,0,0]=3 13517 B18R2.269 Cc1ccc(cc1)CNCc2cccc(c2)Cl 2230a_100000174878_100000210814 [0,2,0,0,0,0|1,0,0]=3 13518 B18R2.269 Cc1ccc(cc1)CNCc2cccc(c2)Cl 2230a_100000174908_100000181238 [0,2,0,0,0,0|1,0,0]=3 13519 B18R2.269 Cc1ccc(cc1)CNCc2cccc(c2)Cl 26a_100000174878_200020625495 [0,2,0,0,0,0|1,0,0]=3 13520 B18R2.269 Cc1ccc(cc1)CNCc2cccc(c2)Cl 270004a_100000174878_100000211033 [0,2,0,0,0,0|1,0,0]=3 13521 B18R2.269 Cc1ccc(cc1)CNCc2cccc(c2)Cl 270004a_100000174908_100000210801 [0,2,0,0,0,0|1,0,0]=3 13522 B18R2.269 Cc1ccc(cc1)CNCc2cccc(c2)Cl 34a_100000174878_100000210814 [0,2,0,0,0,0|1,0,0]=3 13523 B18R2.269 Cc1ccc(cc1)CNCc2cccc(c2)Cl 34a_100000174908_100000187163 [0,2,0,0,0,0|1,0,0]=3 13524 B18R2.269 Cc1ccc(cc1)CNCc2cccc(c2)F 207a_100000174908_100000210812 [0,2,0,0,0,0|1,0,0]=3 13525 B18R2.269 Cc1ccc(cc1)CNCc2cccc(c2)F 207a_100000174948_100000211033 [0,2,0,0,0,0|1,0,0]=3 13526 B18R2.269 Cc1ccc(cc1)CNCc2cccc(c2)F 2230a_100000174908_100000230114 [0,2,0,0,0,0|1,0,0]=3 13527 B18R2.269 Cc1ccc(cc1)CNCc2cccc(c2)F 2230a_100000174948_100000210814 [0,2,0,0,0,0|1,0,0]=3 13528 B18R2.269 Cc1ccc(cc1)CNCc2cccc(c2)F 270004a_100000174908_100000210812 [0,2,0,0,0,0|1,0,0]=3 13529 B18R2.269 Cc1ccc(cc1)CNCc2cccc(c2)F 270004a_100000174948_100000211033 [0,2,0,0,0,0|1,0,0]=3 13530 B18R2.269 Cc1ccc(cc1)CNCc2cccc(c2)F 34a_100000174908_100000187166 [0,2,0,0,0,0|1,0,0]=3 13531 B18R2.269 Cc1ccc(cc1)CNCc2cccc(c2)F 34a_100000174948_100000210814 [0,2,0,0,0,0|1,0,0]=3 13532 B18R2.269 Cc1ccc(cc1)CNCc2cccc(c2)I 207a_100000106179_100000211033 [0,2,0,0,0,0|1,0,0]=3 13533 B18R2.269 Cc1ccc(cc1)CNCc2cccc(c2)I 207a_100000174908_100000014684 [0,2,0,0,0,0|1,0,0]=3 13534 B18R2.269 Cc1ccc(cc1)CNCc2cccc(c2)I 2230a_100000106179_100000210814 [0,2,0,0,0,0|1,0,0]=3 13535 B18R2.269 Cc1ccc(cc1)CNCc2cccc(c2)I 2230a_100000174908_100011218688 [0,2,0,0,0,0|1,0,0]=3 13536 B18R2.269 Cc1ccc(cc1)CNCc2cccc(c2)I 270004a_100000106179_100000211033 [0,2,0,0,0,0|1,0,0]=3 13537 B18R2.269 Cc1ccc(cc1)CNCc2cccc(c2)I 270004a_100000174908_100000014684 [0,2,0,0,0,0|1,0,0]=3 13538 B18R2.269 Cc1ccc(cc1)CNCc2cccc(c2)I 34a_100000106179_100000210814 [0,2,0,0,0,0|1,0,0]=3 13539 B18R2.269 Cc1ccc(cc1)CNCc2cccc(c2)I 34a_100000174908_100011218688 [0,2,0,0,0,0|1,0,0]=3 13540 B18R2.269 Cc1ccc(cc1)CNCc2cccc(c2)O 207a_100000174908_100000188321 [0,2,0,0,0,0|1,0,0]=3 13541 B18R2.269 Cc1ccc(cc1)CNCc2cccc(c2)O 207a_100000743036_100000211033 [0,2,0,0,0,0|1,0,0]=3 13542 B18R2.269 Cc1ccc(cc1)CNCc2cccc(c2)O 2230a_100000174908_100011660834 [0,2,0,0,0,0|1,0,0]=3 13543 B18R2.269 Cc1ccc(cc1)CNCc2cccc(c2)O 2230a_100000743036_100000210814 [0,2,0,0,0,0|1,0,0]=3 13544 B18R2.269 Cc1ccc(cc1)CNCc2cccc(c2)O 270004a_100000174908_100000188321 [0,2,0,0,0,0|1,0,0]=3 13545 B18R2.269 Cc1ccc(cc1)CNCc2cccc(c2)O 270004a_100000743036_100000211033 [0,2,0,0,0,0|1,0,0]=3 13546 B18R2.269 Cc1ccc(cc1)CNCc2cccc(c2)O 34a_100000174908_100011660834 [0,2,0,0,0,0|1,0,0]=3 13547 B18R2.269 Cc1ccc(cc1)CNCc2cccc(c2)O 34a_100000743036_100000210814 [0,2,0,0,0,0|1,0,0]=3 13548 B18R2.269 Cc1ccc(cc1)CNCc2cccc(n2)Br 2230a_100000174908_100009889011 [0,2,0,0,0,0|2,0,0]=4 13549 B18R2.269 Cc1ccc(cc1)CNCc2cccc(n2)Br 2230a_100016987751_100000210814 [0,2,0,0,0,0|2,0,0]=4 13550 B18R2.269 Cc1ccc(cc1)CNCc2cccc(n2)Br 270004a_100000174908_100000688028 [0,2,0,0,0,0|2,0,0]=4 13551 B18R2.269 Cc1ccc(cc1)CNCc2cccc(n2)Br 34a_100000174908_100009889011 [0,2,0,0,0,0|2,0,0]=4 13552 B18R2.269 Cc1ccc(cc1)CNCc2cccc(n2)C 207a_100000174908_100011215050 [0,2,0,0,0,0|2,0,0]=4 13553 B18R2.269 Cc1ccc(cc1)CNCc2cccc(n2)C 2230a_100000174908_100000757606 [0,2,0,0,0,0|2,0,0]=4 13554 B18R2.269 Cc1ccc(cc1)CNCc2cccc(n2)C 270004a_100000174908_100011215050 [0,2,0,0,0,0|2,0,0]=4 13555 B18R2.269 Cc1ccc(cc1)CNCc2cccc(n2)C 34a_100000174908_100000757606 [0,2,0,0,0,0|2,0,0]=4 13556 B18R2.269 Cc1ccc(cc1)CNCc2cccc(n2)C 34a_100000701342_100000210814 [0,2,0,0,0,0|2,0,0]=4 13557 B18R2.269 Cc1ccc(cc1)CNCc2cccc(n2)Cl 2230a_100000174908_100000086093 [0,2,0,0,0,0|2,0,0]=4 13558 B18R2.269 Cc1ccc(cc1)CNCc2cccc(n2)Cl 2230a_100016990191_100000210814 [0,2,0,0,0,0|2,0,0]=4 13559 B18R2.269 Cc1ccc(cc1)CNCc2cccc(n2)Cl 270004a_100000174908_100011361687 [0,2,0,0,0,0|2,0,0]=4 13560 B18R2.269 Cc1ccc(cc1)CNCc2cccc(n2)Cl 34a_100000174908_100000086093 [0,2,0,0,0,0|2,0,0]=4 13561 B18R2.269 Cc1ccc(cc1)CNCc2cccc(n2)F 2230a_100000174908_100009819644 [0,2,0,0,0,0|2,0,0]=4 13562 B18R2.269 Cc1ccc(cc1)CNCc2cccc(n2)F 2230a_100015188798_100000210814 [0,2,0,0,0,0|2,0,0]=4 13563 B18R2.269 Cc1ccc(cc1)CNCc2cccc(n2)F 270004a_100000174908_100000050434 [0,2,0,0,0,0|2,0,0]=4 13564 B18R2.269 Cc1ccc(cc1)CNCc2cccc(n2)F 34a_100000174908_100009819644 [0,2,0,0,0,0|2,0,0]=4 13565 B18R2.269 Cc1ccc(cc1)CNCc2cccc(n2)F 34a_100015188798_100000210814 [0,2,0,0,0,0|2,0,0]=4 13566 B18R2.269 Cc1ccc(cc1)CNCc2ccnc(c2)Br 2230a_100000174908_100010243470 [0,2,0,0,0,0|2,0,0]=4 13567 B18R2.269 Cc1ccc(cc1)CNCc2ccnc(c2)Br 2230a_100025757509_100000210814 [0,2,0,0,0,0|2,0,0]=4 13568 B18R2.269 Cc1ccc(cc1)CNCc2ccnc(c2)Br 26a_100025757509_200020625495 [0,2,0,0,0,0|2,0,0]=4 13569 B18R2.269 Cc1ccc(cc1)CNCc2ccnc(c2)Br 270004a_100000174908_100009814634 [0,2,0,0,0,0|2,0,0]=4 13570 B18R2.269 Cc1ccc(cc1)CNCc2ccnc(c2)Br 270004a_100025757509_100000211033 [0,2,0,0,0,0|2,0,0]=4 13571 B18R2.269 Cc1ccc(cc1)CNCc2ccnc(c2)Br 34a_100000174908_100010243470 [0,2,0,0,0,0|2,0,0]=4 13572 B18R2.269 Cc1ccc(cc1)CNCc2ccnc(c2)Br 34a_100025757509_100000210814 [0,2,0,0,0,0|2,0,0]=4 13573 B18R2.269 Cc1ccc(cc1)CNCc2ccnc(c2)C 207a_100000174908_100011361630 [0,2,0,0,0,0|2,0,0]=4 13574 B18R2.269 Cc1ccc(cc1)CNCc2ccnc(c2)C 207a_100011934566_100000211033 [0,2,0,0,0,0|2,0,0]=4 13575 B18R2.269 Cc1ccc(cc1)CNCc2ccnc(c2)C 2230a_100000174908_200020672517 [0,2,0,0,0,0|2,0,0]=4 13576 B18R2.269 Cc1ccc(cc1)CNCc2ccnc(c2)C 270004a_100000174908_100011361630 [0,2,0,0,0,0|2,0,0]=4 13577 B18R2.269 Cc1ccc(cc1)CNCc2ccnc(c2)C 270004a_100011934566_100000211033 [0,2,0,0,0,0|2,0,0]=4 13578 B18R2.269 Cc1ccc(cc1)CNCc2ccnc(c2)C 34a_100000174908_200020672517 [0,2,0,0,0,0|2,0,0]=4 13579 B18R2.269 Cc1ccc(cc1)CNCc2ccnc(c2)C 34a_100011934566_100000210814 [0,2,0,0,0,0|2,0,0]=4 13580 B18R2.269 Cc1ccc(cc1)CNCc2ccnc(c2)Cl 2230a_100000174908_100000764220 [0,2,0,0,0,0|2,0,0]=4 13581 B18R2.269 Cc1ccc(cc1)CNCc2ccnc(c2)Cl 2230a_100015205668_100000210814 [0,2,0,0,0,0|2,0,0]=4 13582 B18R2.269 Cc1ccc(cc1)CNCc2ccnc(c2)Cl 26a_100015205668_200020625495 [0,2,0,0,0,0|2,0,0]=4 13583 B18R2.269 Cc1ccc(cc1)CNCc2ccnc(c2)Cl 270004a_100000174908_100011290808 [0,2,0,0,0,0|2,0,0]=4 13584 B18R2.269 Cc1ccc(cc1)CNCc2ccnc(c2)Cl 270004a_100015205668_100000211033 [0,2,0,0,0,0|2,0,0]=4 13585 B18R2.269 Cc1ccc(cc1)CNCc2ccnc(c2)Cl 34a_100000174908_100000764220 [0,2,0,0,0,0|2,0,0]=4 13586 B18R2.269 Cc1ccc(cc1)CNCc2ccnc(c2)Cl 34a_100015205668_100000210814 [0,2,0,0,0,0|2,0,0]=4 13587 B18R2.269 Cc1ccc(cc1)CNCc2ccnc(c2)F 2230a_100015188774_100000210814 [0,2,0,0,0,0|2,0,0]=4 13588 B18R2.269 Cc1ccc(cc1)CNCc2ccnc(c2)F 270004a_100000174908_100000068331 [0,2,0,0,0,0|2,0,0]=4 13589 B18R2.269 Cc1ccc(cc1)CNCc2ccnc(c2)F 270004a_100015188774_100000211033 [0,2,0,0,0,0|2,0,0]=4 13590 B18R2.269 Cc1ccc(cc1)CNCc2ccnc(c2)F 34a_100015188774_100000210814 [0,2,0,0,0,0|2,0,0]=4 13591 B18R2.269 Cc1ccc(cc1)CNCc2ccnc(c2)O 207a_100000174908_100000688113 [0,2,0,0,0,0|2,0,0]=4 13592 B18R2.269 Cc1ccc(cc1)CNCc2cncc(c2)Br 207a_100000174908_100000687066 [0,2,0,0,0,0|2,0,0]=4 13593 B18R2.269 Cc1ccc(cc1)CNCc2cncc(c2)Br 207a_100011249555_100000211033 [0,2,0,0,0,0|2,0,0]=4 13594 B18R2.269 Cc1ccc(cc1)CNCc2cncc(c2)Br 2230a_100000174908_100000738771 [0,2,0,0,0,0|2,0,0]=4 13595 B18R2.269 Cc1ccc(cc1)CNCc2cncc(c2)Br 270004a_100000174908_100000687066 [0,2,0,0,0,0|2,0,0]=4 13596 B18R2.269 Cc1ccc(cc1)CNCc2cncc(c2)Br 270004a_100011249555_100000211033 [0,2,0,0,0,0|2,0,0]=4 13597 B18R2.269 Cc1ccc(cc1)CNCc2cncc(c2)Br 34a_100000174908_100000738771 [0,2,0,0,0,0|2,0,0]=4 13598 B18R2.269 Cc1ccc(cc1)CNCc2cncc(c2)C 207a_100000174908_100011998712 [0,2,0,0,0,0|2,0,0]=4 13599 B18R2.269 Cc1ccc(cc1)CNCc2cncc(c2)C 207a_100000692839_100000211033 [0,2,0,0,0,0|2,0,0]=4 13600 B18R2.269 Cc1ccc(cc1)CNCc2cncc(c2)C 2230a_100000174908_100000716715 [0,2,0,0,0,0|2,0,0]=4 13601 B18R2.269 Cc1ccc(cc1)CNCc2cncc(c2)C 2230a_100000692839_100000210814 [0,2,0,0,0,0|2,0,0]=4 13602 B18R2.269 Cc1ccc(cc1)CNCc2cncc(c2)C 270004a_100000174908_100011998712 [0,2,0,0,0,0|2,0,0]=4 13603 B18R2.269 Cc1ccc(cc1)CNCc2cncc(c2)C 270004a_100000692839_100000211033 [0,2,0,0,0,0|2,0,0]=4 13604 B18R2.269 Cc1ccc(cc1)CNCc2cncc(c2)C 34a_100000174908_100000716715 [0,2,0,0,0,0|2,0,0]=4 13605 B18R2.269 Cc1ccc(cc1)CNCc2cncc(c2)C 34a_100000692839_100000210814 [0,2,0,0,0,0|2,0,0]=4 13606 B18R2.269 Cc1ccc(cc1)CNCc2cncc(c2)Cl 207a_100000174908_100000088910 [0,2,0,0,0,0|2,0,0]=4 13607 B18R2.269 Cc1ccc(cc1)CNCc2cncc(c2)Cl 207a_200020614424_100000211033 [0,2,0,0,0,0|2,0,0]=4 13608 B18R2.269 Cc1ccc(cc1)CNCc2cncc(c2)Cl 2230a_100000174908_100016992070 [0,2,0,0,0,0|2,0,0]=4 13609 B18R2.269 Cc1ccc(cc1)CNCc2cncc(c2)Cl 2230a_200020614424_100000210814 [0,2,0,0,0,0|2,0,0]=4 13610 B18R2.269 Cc1ccc(cc1)CNCc2cncc(c2)Cl 270004a_100000174908_100000088910 [0,2,0,0,0,0|2,0,0]=4 13611 B18R2.269 Cc1ccc(cc1)CNCc2cncc(c2)Cl 270004a_200020614424_100000211033 [0,2,0,0,0,0|2,0,0]=4 13612 B18R2.269 Cc1ccc(cc1)CNCc2cncc(c2)Cl 34a_100000174908_100016992070 [0,2,0,0,0,0|2,0,0]=4 13613 B18R2.269 Cc1ccc(cc1)CNCc2cncc(c2)F 207a_100000174908_100011361476 [0,2,0,0,0,0|2,0,0]=4 13614 B18R2.269 Cc1ccc(cc1)CNCc2cncc(c2)F 207a_100011962886_100000211033 [0,2,0,0,0,0|2,0,0]=4 13615 B18R2.269 Cc1ccc(cc1)CNCc2cncc(c2)F 2230a_100000174908_100000725299 [0,2,0,0,0,0|2,0,0]=4 13616 B18R2.269 Cc1ccc(cc1)CNCc2cncc(c2)F 2230a_100011962886_100000210814 [0,2,0,0,0,0|2,0,0]=4 13617 B18R2.269 Cc1ccc(cc1)CNCc2cncc(c2)F 270004a_100000174908_100011361476 [0,2,0,0,0,0|2,0,0]=4 13618 B18R2.269 Cc1ccc(cc1)CNCc2cncc(c2)F 270004a_100011962886_100000211033 [0,2,0,0,0,0|2,0,0]=4 13619 B18R2.269 Cc1ccc(cc1)CNCc2cncc(c2)F 34a_100000174908_100000725299 [0,2,0,0,0,0|2,0,0]=4 13620 B18R2.269 Cc1ccc(cc1)CNCc2cncc(c2)F 34a_100011962886_100000210814 [0,2,0,0,0,0|2,0,0]=4 13621 B18R2.269 Cc1ccc(cc1)CNCc2cncc(c2)O 207a_100000174908_100012187055 [0,2,0,0,0,0|2,0,0]=4 13622 B18R2.269 Cc1ccc(cc1)CNCc2cncc(c2)O 270004a_100000174908_100012187055 [0,2,0,0,0,0|2,0,0]=4 13623 B18R2.269 Cc1ccc(cc1)COCc2cc(ccn2)Br 34a_100011215236_100010173614 [0,2,0,0,0,0|1,0,0]=3 13624 B18R2.269 Cc1ccc(cc1)COCc2cc(ccn2)Br 7a_100011215236_100010173614 [0,2,0,0,0,0|1,0,0]=3 13625 B18R2.269 Cc1ccc(cc1)COCc2cc(ccn2)C 34a_100011215236_100000718516 [0,2,0,0,0,0|1,0,0]=3 13626 B18R2.269 Cc1ccc(cc1)COCc2cc(ccn2)C 34a_100011998357_100000210814 [0,2,0,0,0,0|1,0,0]=3 13627 B18R2.269 Cc1ccc(cc1)COCc2cc(ccn2)C 7a_100011215236_100000718516 [0,2,0,0,0,0|1,0,0]=3 13628 B18R2.269 Cc1ccc(cc1)COCc2cc(ccn2)Cl 34a_100000748867_100000210814 [0,2,0,0,0,0|1,0,0]=3 13629 B18R2.269 Cc1ccc(cc1)COCc2cc(ccn2)Cl 34a_100011215236_100016988179 [0,2,0,0,0,0|1,0,0]=3 13630 B18R2.269 Cc1ccc(cc1)COCc2cc(ccn2)Cl 7a_100011215236_100016988179 [0,2,0,0,0,0|1,0,0]=3 13631 B18R2.269 Cc1ccc(cc1)COCc2cc(ccn2)N 34a_100000692640_100000210814 [0,2,0,0,0,0|1,0,0]=3 13632 B18R2.269 Cc1ccc(cc1)COCc2cc(cnn2)C 34a_100016212594_100000210814 [0,2,0,0,0,0|2,0,0]=4 13633 B18R2.269 Cc1ccc(cc1)COCc2ccc[n+](c2)[O-] 34a_100000037817_100000210814 [0,2,0,0,0,0|1,0,0]=3 13634 B18R2.269 Cc1ccc(cc1)COCc2ccc[n+](c2)[O-] 7a_100000037817_100000210814 [0,2,0,0,0,0|1,0,0]=3 13635 B18R2.269 Cc1ccc(cc1)COCc2cccc(c2)Br 34a_100000687537_100000210814 [0,2,0,0,0,0|0,0,0]=2 13636 B18R2.269 Cc1ccc(cc1)COCc2cccc(c2)Br 34a_100011215236_100000698116 [0,2,0,0,0,0|0,0,0]=2 13637 B18R2.269 Cc1ccc(cc1)COCc2cccc(c2)Br 7a_100000687537_100000210814 [0,2,0,0,0,0|0,0,0]=2 13638 B18R2.269 Cc1ccc(cc1)COCc2cccc(c2)Br 7a_100011215236_100000211773 [0,2,0,0,0,0|0,0,0]=2 13639 B18R2.269 Cc1ccc(cc1)COCc2cccc(c2)C 34a_100011215236_100000211840 [0,2,0,0,0,0|0,0,0]=2 13640 B18R2.269 Cc1ccc(cc1)COCc2cccc(c2)C 34a_100011217746_100000210814 [0,2,0,0,0,0|0,0,0]=2 13641 B18R2.269 Cc1ccc(cc1)COCc2cccc(c2)C 7a_100011215236_100000211840 [0,2,0,0,0,0|0,0,0]=2 13642 B18R2.269 Cc1ccc(cc1)COCc2cccc(c2)C 7a_100011217746_100000210814 [0,2,0,0,0,0|0,0,0]=2 13643 B18R2.269 Cc1ccc(cc1)COCc2cccc(c2)Cl 34a_100000241301_100000210814 [0,2,0,0,0,0|0,0,0]=2 13644 B18R2.269 Cc1ccc(cc1)COCc2cccc(c2)Cl 34a_100011215236_100000187163 [0,2,0,0,0,0|0,0,0]=2 13645 B18R2.269 Cc1ccc(cc1)COCc2cccc(c2)Cl 7a_100000241301_100000210814 [0,2,0,0,0,0|0,0,0]=2 13646 B18R2.269 Cc1ccc(cc1)COCc2cccc(c2)Cl 7a_100011215236_100000187163 [0,2,0,0,0,0|0,0,0]=2 13647 B18R2.269 Cc1ccc(cc1)COCc2cccc(c2)F 34a_100000210976_100000210814 [0,2,0,0,0,0|0,0,0]=2 13648 B18R2.269 Cc1ccc(cc1)COCc2cccc(c2)F 34a_100011215236_100000187166 [0,2,0,0,0,0|0,0,0]=2 13649 B18R2.269 Cc1ccc(cc1)COCc2cccc(c2)F 7a_100000210976_100000210814 [0,2,0,0,0,0|0,0,0]=2 13650 B18R2.269 Cc1ccc(cc1)COCc2cccc(c2)F 7a_100011215236_100000230114 [0,2,0,0,0,0|0,0,0]=2 13651 B18R2.269 Cc1ccc(cc1)COCc2cccc(c2)I 34a_100011215236_100011218688 [0,2,0,0,0,0|0,0,0]=2 13652 B18R2.269 Cc1ccc(cc1)COCc2cccc(c2)I 34a_100011215336_100000210814 [0,2,0,0,0,0|0,0,0]=2 13653 B18R2.269 Cc1ccc(cc1)COCc2cccc(c2)I 7a_100011215236_100011218688 [0,2,0,0,0,0|0,0,0]=2 13654 B18R2.269 Cc1ccc(cc1)COCc2cccc(c2)I 7a_100011215336_100000210814 [0,2,0,0,0,0|0,0,0]=2 13655 B18R2.269 Cc1ccc(cc1)COCc2cccc(c2)N 34a_100000211919_100000210814 [0,2,0,0,0,0|0,0,0]=2 13656 B18R2.269 Cc1ccc(cc1)COCc2cccc(c2)O 34a_100011215236_100011660834 [0,2,0,0,0,0|0,0,0]=2 13657 B18R2.269 Cc1ccc(cc1)COCc2cccc(c2)O 7a_100011215236_100000084143 [0,2,0,0,0,0|0,0,0]=2 13658 B18R2.269 Cc1ccc(cc1)COCc2cccc(n2)Br 34a_100000694195_100000210814 [0,2,0,0,0,0|1,0,0]=3 13659 B18R2.269 Cc1ccc(cc1)COCc2cccc(n2)Br 34a_100011215236_100009889011 [0,2,0,0,0,0|1,0,0]=3 13660 B18R2.269 Cc1ccc(cc1)COCc2cccc(n2)Br 7a_100011215236_100009889011 [0,2,0,0,0,0|1,0,0]=3 13661 B18R2.269 Cc1ccc(cc1)COCc2cccc(n2)C 34a_100000690600_100000210814 [0,2,0,0,0,0|1,0,0]=3 13662 B18R2.269 Cc1ccc(cc1)COCc2cccc(n2)C 34a_100011215236_100000757606 [0,2,0,0,0,0|1,0,0]=3 13663 B18R2.269 Cc1ccc(cc1)COCc2cccc(n2)C 7a_100011215236_100000757606 [0,2,0,0,0,0|1,0,0]=3 13664 B18R2.269 Cc1ccc(cc1)COCc2cccc(n2)Cl 34a_100011215236_100000086093 [0,2,0,0,0,0|1,0,0]=3 13665 B18R2.269 Cc1ccc(cc1)COCc2cccc(n2)Cl 34a_100011998359_100000210814 [0,2,0,0,0,0|1,0,0]=3 13666 B18R2.269 Cc1ccc(cc1)COCc2cccc(n2)Cl 7a_100011215236_100000086093 [0,2,0,0,0,0|1,0,0]=3 13667 B18R2.269 Cc1ccc(cc1)COCc2cccc(n2)F 34a_100000086748_100000210814 [0,2,0,0,0,0|1,0,0]=3 13668 B18R2.269 Cc1ccc(cc1)COCc2cccc(n2)F 34a_100011215236_100009819644 [0,2,0,0,0,0|1,0,0]=3 13669 B18R2.269 Cc1ccc(cc1)COCc2cccc(n2)F 7a_100011215236_100009819644 [0,2,0,0,0,0|1,0,0]=3 13670 B18R2.269 Cc1ccc(cc1)COCc2ccnc(c2)Br 34a_100009814636_100000210814 [0,2,0,0,0,0|1,0,0]=3 13671 B18R2.269 Cc1ccc(cc1)COCc2ccnc(c2)Br 34a_100011215236_100010243470 [0,2,0,0,0,0|1,0,0]=3 13672 B18R2.269 Cc1ccc(cc1)COCc2ccnc(c2)Br 7a_100009814636_100000210814 [0,2,0,0,0,0|1,0,0]=3 13673 B18R2.269 Cc1ccc(cc1)COCc2ccnc(c2)Br 7a_100011215236_100010254460 [0,2,0,0,0,0|1,0,0]=3 13674 B18R2.269 Cc1ccc(cc1)COCc2ccnc(c2)C 34a_100011215236_200020672517 [0,2,0,0,0,0|1,0,0]=3 13675 B18R2.269 Cc1ccc(cc1)COCc2ccnc(c2)C 34a_100011998630_100000210814 [0,2,0,0,0,0|1,0,0]=3 13676 B18R2.269 Cc1ccc(cc1)COCc2ccnc(c2)C 7a_100011215236_200020672517 [0,2,0,0,0,0|1,0,0]=3 13677 B18R2.269 Cc1ccc(cc1)COCc2ccnc(c2)Cl 34a_100000748751_100000210814 [0,2,0,0,0,0|1,0,0]=3 13678 B18R2.269 Cc1ccc(cc1)COCc2ccnc(c2)Cl 34a_100011215236_100000764220 [0,2,0,0,0,0|1,0,0]=3 13679 B18R2.269 Cc1ccc(cc1)COCc2ccnc(c2)Cl 7a_100011215236_100000764220 [0,2,0,0,0,0|1,0,0]=3 13680 B18R2.269 Cc1ccc(cc1)COCc2ccnc(c2)F 34a_100000082451_100000210814 [0,2,0,0,0,0|1,0,0]=3 13681 B18R2.269 Cc1ccc(cc1)COCc2ccnc(n2)Cl 34a_100011215236_100000099655 [0,2,0,0,0,0|2,0,0]=4 13682 B18R2.269 Cc1ccc(cc1)COCc2ccnc(n2)Cl 7a_100011215236_100000099655 [0,2,0,0,0,0|2,0,0]=4 13683 B18R2.269 Cc1ccc(cc1)COCc2cncc(c2)Br 34a_100011215236_100000738771 [0,2,0,0,0,0|1,0,0]=3 13684 B18R2.269 Cc1ccc(cc1)COCc2cncc(c2)Br 34a_100011259137_100000210814 [0,2,0,0,0,0|1,0,0]=3 13685 B18R2.269 Cc1ccc(cc1)COCc2cncc(c2)Br 7a_100011215236_100000738771 [0,2,0,0,0,0|1,0,0]=3 13686 B18R2.269 Cc1ccc(cc1)COCc2cncc(c2)Br 7a_100011259137_100000210814 [0,2,0,0,0,0|1,0,0]=3 13687 B18R2.269 Cc1ccc(cc1)COCc2cncc(c2)C 34a_100011215236_100000716715 [0,2,0,0,0,0|1,0,0]=3 13688 B18R2.269 Cc1ccc(cc1)COCc2cncc(c2)C 34a_100011998709_100000210814 [0,2,0,0,0,0|1,0,0]=3 13689 B18R2.269 Cc1ccc(cc1)COCc2cncc(c2)C 7a_100011215236_100000716715 [0,2,0,0,0,0|1,0,0]=3 13690 B18R2.269 Cc1ccc(cc1)COCc2cncc(c2)C 7a_100011998709_100000210814 [0,2,0,0,0,0|1,0,0]=3 13691 B18R2.269 Cc1ccc(cc1)COCc2cncc(c2)Cl 34a_100000092867_100000210814 [0,2,0,0,0,0|1,0,0]=3 13692 B18R2.269 Cc1ccc(cc1)COCc2cncc(c2)Cl 34a_100011215236_100016992070 [0,2,0,0,0,0|1,0,0]=3 13693 B18R2.269 Cc1ccc(cc1)COCc2cncc(c2)Cl 7a_100000092867_100000210814 [0,2,0,0,0,0|1,0,0]=3 13694 B18R2.269 Cc1ccc(cc1)COCc2cncc(c2)Cl 7a_100011215236_100016992070 [0,2,0,0,0,0|1,0,0]=3 13695 B18R2.269 Cc1ccc(cc1)COCc2cncc(c2)F 34a_100011215236_100000725299 [0,2,0,0,0,0|1,0,0]=3 13696 B18R2.269 Cc1ccc(cc1)COCc2cncc(c2)F 34a_100011962875_100000210814 [0,2,0,0,0,0|1,0,0]=3 13697 B18R2.269 Cc1ccc(cc1)COCc2cncc(c2)F 7a_100011215236_100000725299 [0,2,0,0,0,0|1,0,0]=3 13698 B18R2.269 Cc1ccc(cc1)COCc2cncc(c2)F 7a_100011962875_100000210814 [0,2,0,0,0,0|1,0,0]=3 13699 B18R2.269 Cc1ccc(cc1)COCc2cncc(c2)N 34a_100000085308_100000210814 [0,2,0,0,0,0|1,0,0]=3 13700 B18R2.269 Cc1ccc(cc1)CSCc2cc(ccn2)Br 62a_100000210814_100010173614 [0,2,0,0,0,0|1,1,0]=4 13701 B18R2.269 Cc1ccc(cc1)CSCc2cc(ccn2)Br 62a_100010173614_100000210814 [0,2,0,0,0,0|1,1,0]=4 13702 B18R2.269 Cc1ccc(cc1)CSCc2cc(ccn2)C 62a_100000210814_100000718516 [0,2,0,0,0,0|1,1,0]=4 13703 B18R2.269 Cc1ccc(cc1)CSCc2cc(ccn2)C 62a_100000718516_100000210814 [0,2,0,0,0,0|1,1,0]=4 13704 B18R2.269 Cc1ccc(cc1)CSCc2cc(ccn2)Cl 62a_100000210814_100016988179 [0,2,0,0,0,0|1,1,0]=4 13705 B18R2.269 Cc1ccc(cc1)CSCc2cc(ccn2)Cl 62a_100016988179_100000210814 [0,2,0,0,0,0|1,1,0]=4 13706 B18R2.269 Cc1ccc(cc1)CSCc2cccc(c2)Br 62a_100000210814_100000211773 [0,2,0,0,0,0|0,1,0]=3 13707 B18R2.269 Cc1ccc(cc1)CSCc2cccc(c2)Br 62a_100000211773_100000210814 [0,2,0,0,0,0|0,1,0]=3 13708 B18R2.269 Cc1ccc(cc1)CSCc2cccc(c2)C 62a_100000210814_100000211840 [0,2,0,0,0,0|0,1,0]=3 13709 B18R2.269 Cc1ccc(cc1)CSCc2cccc(c2)C 62a_100000211840_100000210814 [0,2,0,0,0,0|0,1,0]=3 13710 B18R2.269 Cc1ccc(cc1)CSCc2cccc(c2)Cl 62a_100000187163_100000210814 [0,2,0,0,0,0|0,1,0]=3 13711 B18R2.269 Cc1ccc(cc1)CSCc2cccc(c2)Cl 62a_100000210814_100000187163 [0,2,0,0,0,0|0,1,0]=3 13712 B18R2.269 Cc1ccc(cc1)CSCc2cccc(c2)F 62a_100000210814_100000230114 [0,2,0,0,0,0|0,1,0]=3 13713 B18R2.269 Cc1ccc(cc1)CSCc2cccc(c2)F 62a_100000230114_100000210814 [0,2,0,0,0,0|0,1,0]=3 13714 B18R2.269 Cc1ccc(cc1)CSCc2cccc(c2)I 62a_100000210814_100011218688 [0,2,0,0,0,0|0,1,0]=3 13715 B18R2.269 Cc1ccc(cc1)CSCc2cccc(c2)I 62a_100011218688_100000210814 [0,2,0,0,0,0|0,1,0]=3 13716 B18R2.269 Cc1ccc(cc1)CSCc2cccc(c2)O 62a_100000210814_100011660834 [0,2,0,0,0,0|0,1,0]=3 13717 B18R2.269 Cc1ccc(cc1)CSCc2cccc(c2)O 62a_100011660834_100000210814 [0,2,0,0,0,0|0,1,0]=3 13718 B18R2.269 Cc1ccc(cc1)CSCc2cccc(n2)Br 62a_100000210814_100009889011 [0,2,0,0,0,0|1,1,0]=4 13719 B18R2.269 Cc1ccc(cc1)CSCc2cccc(n2)Br 62a_100009889011_100000210814 [0,2,0,0,0,0|1,1,0]=4 13720 B18R2.269 Cc1ccc(cc1)CSCc2cccc(n2)C 62a_100000210814_100000757606 [0,2,0,0,0,0|1,1,0]=4 13721 B18R2.269 Cc1ccc(cc1)CSCc2cccc(n2)C 62a_100000757606_100000210814 [0,2,0,0,0,0|1,1,0]=4 13722 B18R2.269 Cc1ccc(cc1)CSCc2cccc(n2)Cl 62a_100000086093_100000210814 [0,2,0,0,0,0|1,1,0]=4 13723 B18R2.269 Cc1ccc(cc1)CSCc2cccc(n2)Cl 62a_100000210814_100000086093 [0,2,0,0,0,0|1,1,0]=4 13724 B18R2.269 Cc1ccc(cc1)CSCc2cccc(n2)F 62a_100000210814_100009819644 [0,2,0,0,0,0|1,1,0]=4 13725 B18R2.269 Cc1ccc(cc1)CSCc2cccc(n2)F 62a_100009819644_100000210814 [0,2,0,0,0,0|1,1,0]=4 13726 B18R2.269 Cc1ccc(cc1)CSCc2ccnc(c2)Br 62a_100000210814_100010243470 [0,2,0,0,0,0|1,1,0]=4 13727 B18R2.269 Cc1ccc(cc1)CSCc2ccnc(c2)Br 62a_100010254460_100000210814 [0,2,0,0,0,0|1,1,0]=4 13728 B18R2.269 Cc1ccc(cc1)CSCc2ccnc(c2)C 62a_100000210814_200020672517 [0,2,0,0,0,0|1,1,0]=4 13729 B18R2.269 Cc1ccc(cc1)CSCc2ccnc(c2)C 62a_200020672517_100000210814 [0,2,0,0,0,0|1,1,0]=4 13730 B18R2.269 Cc1ccc(cc1)CSCc2ccnc(c2)Cl 62a_100000210814_100000764220 [0,2,0,0,0,0|1,1,0]=4 13731 B18R2.269 Cc1ccc(cc1)CSCc2ccnc(c2)Cl 62a_100000764220_100000210814 [0,2,0,0,0,0|1,1,0]=4 13732 B18R2.269 Cc1ccc(cc1)CSCc2cncc(c2)Br 62a_100000210814_100000738771 [0,2,0,0,0,0|1,1,0]=4 13733 B18R2.269 Cc1ccc(cc1)CSCc2cncc(c2)Br 62a_100000738771_100000210814 [0,2,0,0,0,0|1,1,0]=4 13734 B18R2.269 Cc1ccc(cc1)CSCc2cncc(c2)C 62a_100000210814_100000716715 [0,2,0,0,0,0|1,1,0]=4 13735 B18R2.269 Cc1ccc(cc1)CSCc2cncc(c2)C 62a_100000716715_100000210814 [0,2,0,0,0,0|1,1,0]=4 13736 B18R2.269 Cc1ccc(cc1)CSCc2cncc(c2)Cl 62a_100000210814_100016992070 [0,2,0,0,0,0|1,1,0]=4 13737 B18R2.269 Cc1ccc(cc1)CSCc2cncc(c2)Cl 62a_100016992070_100000210814 [0,2,0,0,0,0|1,1,0]=4 13738 B18R2.269 Cc1ccc(cc1)CSCc2cncc(c2)F 62a_100000210814_100000725299 [0,2,0,0,0,0|1,1,0]=4 13739 B18R2.269 Cc1ccc(cc1)CSCc2cncc(c2)F 62a_100000725299_100000210814 [0,2,0,0,0,0|1,1,0]=4 13740 B18R2.269 Cc1ccc(cc1)NCCc2cccc(c2)Br 34a_100000124888_100011740638 [0,2,0,0,0,0|2,0,0]=4 13741 B18R2.269 Cc1ccc(cc1)NCCc2cccc(c2)C 34a_100000124888_100011713685 [0,2,0,0,0,0|2,0,0]=4 13742 B18R2.269 Cc1ccc(cc1)NCCc2cccc(c2)Cl 34a_100000124888_100011713710 [0,2,0,0,0,0|2,0,0]=4 13743 B18R2.269 Cc1ccc(cc1)NCCc2cccc(c2)F 34a_100000124888_100011217235 [0,2,0,0,0,0|2,0,0]=4 13744 B18R2.269 Cc1ccc(cc1)OCCc2cccc(c2)Br 34a_100000210336_100011740638 [0,2,0,0,0,0|2,0,0]=4 13745 B18R2.269 Cc1ccc(cc1)OCCc2cccc(c2)Br 7a_100000210336_100011740638 [0,2,0,0,0,0|2,0,0]=4 13746 B18R2.269 Cc1ccc(cc1)OCCc2cccc(c2)C 34a_100000210336_100011713685 [0,2,0,0,0,0|2,0,0]=4 13747 B18R2.269 Cc1ccc(cc1)OCCc2cccc(c2)C 7a_100000210336_100011713685 [0,2,0,0,0,0|2,0,0]=4 13748 B18R2.269 Cc1ccc(cc1)OCCc2cccc(c2)Cl 34a_100000210336_100011713710 [0,2,0,0,0,0|2,0,0]=4 13749 B18R2.269 Cc1ccc(cc1)OCCc2cccc(c2)Cl 7a_100000210336_100011713710 [0,2,0,0,0,0|2,0,0]=4 13750 B18R2.269 Cc1ccc(cc1)OCCc2cccc(c2)F 34a_100000210336_100011217235 [0,2,0,0,0,0|2,0,0]=4 13751 B18R2.269 Cc1ccc(cc1)OCCc2cccc(c2)F 7a_100000210336_100011217235 [0,2,0,0,0,0|2,0,0]=4 13752 B18R2.269 Cc1ccc(cc1)SCCc2cccc(c2)Br 62a_100000186775_100011740638 [0,2,0,0,0,0|2,0,0]=4 13753 B18R2.269 Cc1ccc(cc1)SCCc2cccc(c2)Br 62a_100011740638_100000186775 [0,2,0,0,0,0|2,0,0]=4 13754 B18R2.269 Cc1ccc(cc1)SCCc2cccc(c2)C 62a_100000186775_100011713685 [0,2,0,0,0,0|2,0,0]=4 13755 B18R2.269 Cc1ccc(cc1)SCCc2cccc(c2)C 62a_100011713685_100000186775 [0,2,0,0,0,0|2,0,0]=4 13756 B18R2.269 Cc1ccc(cc1)SCCc2cccc(c2)Cl 62a_100000186775_100011713710 [0,2,0,0,0,0|2,0,0]=4 13757 B18R2.269 Cc1ccc(cc1)SCCc2cccc(c2)Cl 62a_100011713710_100000186775 [0,2,0,0,0,0|2,0,0]=4 13758 B18R2.269 Cc1ccc(cc1)SCCc2cccc(c2)F 62a_100000186775_100011217235 [0,2,0,0,0,0|2,0,0]=4 13759 B18R2.269 Cc1ccc(cc1)SCCc2cccc(c2)F 62a_100011217235_100000186775 [0,2,0,0,0,0|2,0,0]=4 13760 B18R2.269 Cc1ccc(cn1)CNCc2cccc(c2)Br 207a_100000740942_100000210085 [0,2,0,0,0,0|2,0,0]=4 13761 B18R2.269 Cc1ccc(cn1)CNCc2cccc(c2)Br 2230a_100000174977_100016987292 [0,2,0,0,0,0|2,0,0]=4 13762 B18R2.269 Cc1ccc(cn1)CNCc2cccc(c2)Br 270004a_100000174977_100000743784 [0,2,0,0,0,0|2,0,0]=4 13763 B18R2.269 Cc1ccc(cn1)CNCc2cccc(c2)Br 270004a_100000740942_100000210085 [0,2,0,0,0,0|2,0,0]=4 13764 B18R2.269 Cc1ccc(cn1)CNCc2cccc(c2)Br 34a_100000174977_100016987292 [0,2,0,0,0,0|2,0,0]=4 13765 B18R2.269 Cc1ccc(cn1)CNCc2cccc(c2)Br 34a_100000740942_100000698116 [0,2,0,0,0,0|2,0,0]=4 13766 B18R2.269 Cc1ccc(cn1)CNCc2cccc(c2)Cl 207a_100000740942_100000210801 [0,2,0,0,0,0|2,0,0]=4 13767 B18R2.269 Cc1ccc(cn1)CNCc2cccc(c2)Cl 2230a_100000174878_100016987292 [0,2,0,0,0,0|2,0,0]=4 13768 B18R2.269 Cc1ccc(cn1)CNCc2cccc(c2)Cl 270004a_100000174878_100000743784 [0,2,0,0,0,0|2,0,0]=4 13769 B18R2.269 Cc1ccc(cn1)CNCc2cccc(c2)Cl 270004a_100000740942_100000210801 [0,2,0,0,0,0|2,0,0]=4 13770 B18R2.269 Cc1ccc(cn1)CNCc2cccc(c2)Cl 34a_100000174878_100016987292 [0,2,0,0,0,0|2,0,0]=4 13771 B18R2.269 Cc1ccc(cn1)CNCc2cccc(c2)Cl 34a_100000740942_100000187163 [0,2,0,0,0,0|2,0,0]=4 13772 B18R2.269 Cc1ccc(cn1)CNCc2cccc(c2)F 207a_100000740942_100000210812 [0,2,0,0,0,0|2,0,0]=4 13773 B18R2.269 Cc1ccc(cn1)CNCc2cccc(c2)F 2230a_100000174948_100016987292 [0,2,0,0,0,0|2,0,0]=4 13774 B18R2.269 Cc1ccc(cn1)CNCc2cccc(c2)F 270004a_100000174948_100000743784 [0,2,0,0,0,0|2,0,0]=4 13775 B18R2.269 Cc1ccc(cn1)CNCc2cccc(c2)F 270004a_100000740942_100000210812 [0,2,0,0,0,0|2,0,0]=4 13776 B18R2.269 Cc1ccc(cn1)CNCc2cccc(c2)F 34a_100000174948_100016987292 [0,2,0,0,0,0|2,0,0]=4 13777 B18R2.269 Cc1ccc(cn1)CNCc2cccc(c2)F 34a_100000740942_100000187166 [0,2,0,0,0,0|2,0,0]=4 13778 B18R2.269 Cc1ccc(cn1)CNCc2cccc(c2)I 207a_100000740942_100000014684 [0,2,0,0,0,0|2,0,0]=4 13779 B18R2.269 Cc1ccc(cn1)CNCc2cccc(c2)I 2230a_100000106179_100016987292 [0,2,0,0,0,0|2,0,0]=4 13780 B18R2.269 Cc1ccc(cn1)CNCc2cccc(c2)I 270004a_100000106179_100000743784 [0,2,0,0,0,0|2,0,0]=4 13781 B18R2.269 Cc1ccc(cn1)CNCc2cccc(c2)I 270004a_100000740942_100000014684 [0,2,0,0,0,0|2,0,0]=4 13782 B18R2.269 Cc1ccc(cn1)CNCc2cccc(c2)I 34a_100000106179_100016987292 [0,2,0,0,0,0|2,0,0]=4 13783 B18R2.269 Cc1ccc(cn1)CNCc2cccc(c2)I 34a_100000740942_100011218688 [0,2,0,0,0,0|2,0,0]=4 13784 B18R2.269 Cc1ccc(cn1)CNCc2cccc(c2)O 207a_100000740942_100000188321 [0,2,0,0,0,0|2,0,0]=4 13785 B18R2.269 Cc1ccc(cn1)CNCc2cccc(c2)O 2230a_100000743036_100016987292 [0,2,0,0,0,0|2,0,0]=4 13786 B18R2.269 Cc1ccc(cn1)CNCc2cccc(c2)O 270004a_100000740942_100000188321 [0,2,0,0,0,0|2,0,0]=4 13787 B18R2.269 Cc1ccc(cn1)CNCc2cccc(c2)O 270004a_100000743036_100000743784 [0,2,0,0,0,0|2,0,0]=4 13788 B18R2.269 Cc1ccc(cn1)CNCc2cccc(c2)O 34a_100000740942_100011660834 [0,2,0,0,0,0|2,0,0]=4 13789 B18R2.269 Cc1ccc(cn1)CNCc2cccc(c2)O 34a_100000743036_100016987292 [0,2,0,0,0,0|2,0,0]=4 13790 B18R2.269 Cc1ccc(cn1)COCc2cc(ccn2)Br 34a_100011248133_100010173614 [0,2,0,0,0,0|2,0,0]=4 13791 B18R2.269 Cc1ccc(cn1)COCc2cc(ccn2)Cl 34a_100000748867_100016987292 [0,2,0,0,0,0|2,0,0]=4 13792 B18R2.269 Cc1ccc(cn1)COCc2cc(ccn2)Cl 34a_100011248133_100016988179 [0,2,0,0,0,0|2,0,0]=4 13793 B18R2.269 Cc1ccc(cn1)COCc2cc(ccn2)N 34a_100000692640_100016987292 [0,2,0,0,0,0|2,0,0]=4 13794 B18R2.269 Cc1ccc(cn1)COCc2ccc[n+](c2)[O-] 34a_100000037817_100016987292 [0,2,0,0,0,0|2,0,0]=4 13795 B18R2.269 Cc1ccc(cn1)COCc2ccc[n+](c2)[O-] 7a_100000037817_100016987292 [0,2,0,0,0,0|2,0,0]=4 13796 B18R2.269 Cc1ccc(cn1)COCc2cccc(c2)Br 34a_100000687537_100016987292 [0,2,0,0,0,0|1,0,0]=3 13797 B18R2.269 Cc1ccc(cn1)COCc2cccc(c2)Br 34a_100011248133_100000698116 [0,2,0,0,0,0|1,0,0]=3 13798 B18R2.269 Cc1ccc(cn1)COCc2cccc(c2)Br 7a_100000687537_100016987292 [0,2,0,0,0,0|1,0,0]=3 13799 B18R2.269 Cc1ccc(cn1)COCc2cccc(c2)Cl 34a_100000241301_100016987292 [0,2,0,0,0,0|1,0,0]=3 13800 B18R2.269 Cc1ccc(cn1)COCc2cccc(c2)Cl 34a_100011248133_100000187163 [0,2,0,0,0,0|1,0,0]=3 13801 B18R2.269 Cc1ccc(cn1)COCc2cccc(c2)Cl 7a_100000241301_100016987292 [0,2,0,0,0,0|1,0,0]=3 13802 B18R2.269 Cc1ccc(cn1)COCc2cccc(c2)F 34a_100000210976_100016987292 [0,2,0,0,0,0|1,0,0]=3 13803 B18R2.269 Cc1ccc(cn1)COCc2cccc(c2)F 34a_100011248133_100000187166 [0,2,0,0,0,0|1,0,0]=3 13804 B18R2.269 Cc1ccc(cn1)COCc2cccc(c2)F 7a_100000210976_100016987292 [0,2,0,0,0,0|1,0,0]=3 13805 B18R2.269 Cc1ccc(cn1)COCc2cccc(c2)I 34a_100011215336_100016987292 [0,2,0,0,0,0|1,0,0]=3 13806 B18R2.269 Cc1ccc(cn1)COCc2cccc(c2)I 34a_100011248133_100011218688 [0,2,0,0,0,0|1,0,0]=3 13807 B18R2.269 Cc1ccc(cn1)COCc2cccc(c2)I 7a_100011215336_100016987292 [0,2,0,0,0,0|1,0,0]=3 13808 B18R2.269 Cc1ccc(cn1)COCc2cccc(c2)N 34a_100000211919_100016987292 [0,2,0,0,0,0|1,0,0]=3 13809 B18R2.269 Cc1ccc(cn1)COCc2cccc(c2)O 34a_100011248133_100011660834 [0,2,0,0,0,0|1,0,0]=3 13810 B18R2.269 Cc1ccc(cn1)COCc2cccc(n2)Br 34a_100000694195_100016987292 [0,2,0,0,0,0|2,0,0]=4 13811 B18R2.269 Cc1ccc(cn1)COCc2cccc(n2)Br 34a_100011248133_100009889011 [0,2,0,0,0,0|2,0,0]=4 13812 B18R2.269 Cc1ccc(cn1)COCc2cccc(n2)C 34a_100000690600_100016987292 [0,2,0,0,0,0|2,0,0]=4 13813 B18R2.269 Cc1ccc(cn1)COCc2cccc(n2)C 34a_100011248133_100000757606 [0,2,0,0,0,0|2,0,0]=4 13814 B18R2.269 Cc1ccc(cn1)COCc2cccc(n2)Cl 34a_100011248133_100000086093 [0,2,0,0,0,0|2,0,0]=4 13815 B18R2.269 Cc1ccc(cn1)COCc2cccc(n2)Cl 34a_100011998359_100016987292 [0,2,0,0,0,0|2,0,0]=4 13816 B18R2.269 Cc1ccc(cn1)COCc2cccc(n2)F 34a_100000086748_100016987292 [0,2,0,0,0,0|2,0,0]=4 13817 B18R2.269 Cc1ccc(cn1)COCc2cccc(n2)F 34a_100011248133_100009819644 [0,2,0,0,0,0|2,0,0]=4 13818 B18R2.269 Cc1ccc(cn1)COCc2ccnc(c2)Br 34a_100009814636_100016987292 [0,2,0,0,0,0|2,0,0]=4 13819 B18R2.269 Cc1ccc(cn1)COCc2ccnc(c2)Br 34a_100011248133_100010243470 [0,2,0,0,0,0|2,0,0]=4 13820 B18R2.269 Cc1ccc(cn1)COCc2ccnc(c2)Br 7a_100009814636_100016987292 [0,2,0,0,0,0|2,0,0]=4 13821 B18R2.269 Cc1ccc(cn1)COCc2ccnc(c2)C 34a_100011248133_200020672517 [0,2,0,0,0,0|2,0,0]=4 13822 B18R2.269 Cc1ccc(cn1)COCc2ccnc(c2)C 34a_100011998630_100016987292 [0,2,0,0,0,0|2,0,0]=4 13823 B18R2.269 Cc1ccc(cn1)COCc2ccnc(c2)Cl 34a_100000748751_100016987292 [0,2,0,0,0,0|2,0,0]=4 13824 B18R2.269 Cc1ccc(cn1)COCc2ccnc(c2)Cl 34a_100011248133_100000764220 [0,2,0,0,0,0|2,0,0]=4 13825 B18R2.269 Cc1ccc(cn1)COCc2ccnc(c2)F 34a_100000082451_100016987292 [0,2,0,0,0,0|2,0,0]=4 13826 B18R2.269 Cc1ccc(cn1)COCc2cncc(c2)Br 34a_100011248133_100000738771 [0,2,0,0,0,0|2,0,0]=4 13827 B18R2.269 Cc1ccc(cn1)COCc2cncc(c2)Br 34a_100011259137_100016987292 [0,2,0,0,0,0|2,0,0]=4 13828 B18R2.269 Cc1ccc(cn1)COCc2cncc(c2)Br 7a_100011259137_100016987292 [0,2,0,0,0,0|2,0,0]=4 13829 B18R2.269 Cc1ccc(cn1)COCc2cncc(c2)Cl 34a_100000092867_100016987292 [0,2,0,0,0,0|2,0,0]=4 13830 B18R2.269 Cc1ccc(cn1)COCc2cncc(c2)Cl 34a_100011248133_100016992070 [0,2,0,0,0,0|2,0,0]=4 13831 B18R2.269 Cc1ccc(cn1)COCc2cncc(c2)Cl 7a_100000092867_100016987292 [0,2,0,0,0,0|2,0,0]=4 13832 B18R2.269 Cc1ccc(cn1)COCc2cncc(c2)F 34a_100011248133_100000725299 [0,2,0,0,0,0|2,0,0]=4 13833 B18R2.269 Cc1ccc(cn1)COCc2cncc(c2)F 34a_100011962875_100016987292 [0,2,0,0,0,0|2,0,0]=4 13834 B18R2.269 Cc1ccc(cn1)COCc2cncc(c2)F 7a_100011962875_100016987292 [0,2,0,0,0,0|2,0,0]=4 13835 B18R2.269 Cc1ccc(cn1)COCc2cncc(c2)N 34a_100000085308_100016987292 [0,2,0,0,0,0|2,0,0]=4 13836 B18R2.269 Cc1ccc(cn1)CSCc2cccc(c2)Br 62a_100000211773_100016987292 [0,2,0,0,0,0|1,1,0]=4 13837 B18R2.269 Cc1ccc(cn1)CSCc2cccc(c2)Br 62a_100016987292_100000211773 [0,2,0,0,0,0|1,1,0]=4 13838 B18R2.269 Cc1ccc(cn1)CSCc2cccc(c2)Cl 62a_100000187163_100016987292 [0,2,0,0,0,0|1,1,0]=4 13839 B18R2.269 Cc1ccc(cn1)CSCc2cccc(c2)Cl 62a_100016987292_100000187163 [0,2,0,0,0,0|1,1,0]=4 13840 B18R2.269 Cc1ccc(cn1)CSCc2cccc(c2)F 62a_100000230114_100016987292 [0,2,0,0,0,0|1,1,0]=4 13841 B18R2.269 Cc1ccc(cn1)CSCc2cccc(c2)F 62a_100016987292_100000230114 [0,2,0,0,0,0|1,1,0]=4 13842 B18R2.269 Cc1ccc(cn1)CSCc2cccc(c2)I 62a_100011218688_100016987292 [0,2,0,0,0,0|1,1,0]=4 13843 B18R2.269 Cc1ccc(cn1)CSCc2cccc(c2)I 62a_100016987292_100011218688 [0,2,0,0,0,0|1,1,0]=4 13844 B18R2.269 Cc1ccc(cn1)CSCc2cccc(c2)O 62a_100011660834_100016987292 [0,2,0,0,0,0|1,1,0]=4 13845 B18R2.269 Cc1ccc(cn1)CSCc2cccc(c2)O 62a_100016987292_100011660834 [0,2,0,0,0,0|1,1,0]=4 13846 B18R2.269 Cc1ccc(nc1)CNCc2cccc(c2)Br 207a_100000174977_100000050478 [0,2,0,0,0,0|2,0,0]=4 13847 B18R2.269 Cc1ccc(nc1)CNCc2cccc(c2)Br 2230a_100000174977_100000691093 [0,2,0,0,0,0|2,0,0]=4 13848 B18R2.269 Cc1ccc(nc1)CNCc2cccc(c2)Br 270004a_100000174977_100000050478 [0,2,0,0,0,0|2,0,0]=4 13849 B18R2.269 Cc1ccc(nc1)CNCc2cccc(c2)Br 34a_100000174977_100000691093 [0,2,0,0,0,0|2,0,0]=4 13850 B18R2.269 Cc1ccc(nc1)CNCc2cccc(c2)Br 34a_100015187455_100000698116 [0,2,0,0,0,0|2,0,0]=4 13851 B18R2.269 Cc1ccc(nc1)CNCc2cccc(c2)C 207a_100000185548_100000050478 [0,2,0,0,0,0|2,0,0]=4 13852 B18R2.269 Cc1ccc(nc1)CNCc2cccc(c2)C 2230a_100000185548_100000691093 [0,2,0,0,0,0|2,0,0]=4 13853 B18R2.269 Cc1ccc(nc1)CNCc2cccc(c2)C 270004a_100000185548_100000050478 [0,2,0,0,0,0|2,0,0]=4 13854 B18R2.269 Cc1ccc(nc1)CNCc2cccc(c2)C 34a_100000185548_100000691093 [0,2,0,0,0,0|2,0,0]=4 13855 B18R2.269 Cc1ccc(nc1)CNCc2cccc(c2)C 34a_100015187455_100000211840 [0,2,0,0,0,0|2,0,0]=4 13856 B18R2.269 Cc1ccc(nc1)CNCc2cccc(c2)Cl 207a_100000174878_100000050478 [0,2,0,0,0,0|2,0,0]=4 13857 B18R2.269 Cc1ccc(nc1)CNCc2cccc(c2)Cl 2230a_100000174878_100000691093 [0,2,0,0,0,0|2,0,0]=4 13858 B18R2.269 Cc1ccc(nc1)CNCc2cccc(c2)Cl 270004a_100000174878_100000050478 [0,2,0,0,0,0|2,0,0]=4 13859 B18R2.269 Cc1ccc(nc1)CNCc2cccc(c2)Cl 34a_100000174878_100000691093 [0,2,0,0,0,0|2,0,0]=4 13860 B18R2.269 Cc1ccc(nc1)CNCc2cccc(c2)Cl 34a_100015187455_100000187163 [0,2,0,0,0,0|2,0,0]=4 13861 B18R2.269 Cc1ccc(nc1)CNCc2cccc(c2)F 207a_100000174948_100000050478 [0,2,0,0,0,0|2,0,0]=4 13862 B18R2.269 Cc1ccc(nc1)CNCc2cccc(c2)F 2230a_100000174948_100000691093 [0,2,0,0,0,0|2,0,0]=4 13863 B18R2.269 Cc1ccc(nc1)CNCc2cccc(c2)F 270004a_100000174948_100000050478 [0,2,0,0,0,0|2,0,0]=4 13864 B18R2.269 Cc1ccc(nc1)CNCc2cccc(c2)F 34a_100000174948_100000691093 [0,2,0,0,0,0|2,0,0]=4 13865 B18R2.269 Cc1ccc(nc1)CNCc2cccc(c2)F 34a_100015187455_100000187166 [0,2,0,0,0,0|2,0,0]=4 13866 B18R2.269 Cc1ccc(nc1)CNCc2cccc(c2)I 207a_100000106179_100000050478 [0,2,0,0,0,0|2,0,0]=4 13867 B18R2.269 Cc1ccc(nc1)CNCc2cccc(c2)I 2230a_100000106179_100000691093 [0,2,0,0,0,0|2,0,0]=4 13868 B18R2.269 Cc1ccc(nc1)CNCc2cccc(c2)I 270004a_100000106179_100000050478 [0,2,0,0,0,0|2,0,0]=4 13869 B18R2.269 Cc1ccc(nc1)CNCc2cccc(c2)I 34a_100000106179_100000691093 [0,2,0,0,0,0|2,0,0]=4 13870 B18R2.269 Cc1ccc(nc1)CNCc2cccc(c2)I 34a_100015187455_100011218688 [0,2,0,0,0,0|2,0,0]=4 13871 B18R2.269 Cc1ccc(nc1)CNCc2cccc(c2)O 207a_100000743036_100000050478 [0,2,0,0,0,0|2,0,0]=4 13872 B18R2.269 Cc1ccc(nc1)CNCc2cccc(c2)O 2230a_100000743036_100000691093 [0,2,0,0,0,0|2,0,0]=4 13873 B18R2.269 Cc1ccc(nc1)CNCc2cccc(c2)O 270004a_100000743036_100000050478 [0,2,0,0,0,0|2,0,0]=4 13874 B18R2.269 Cc1ccc(nc1)CNCc2cccc(c2)O 34a_100000743036_100000691093 [0,2,0,0,0,0|2,0,0]=4 13875 B18R2.269 Cc1ccc(nc1)CNCc2cccc(c2)O 34a_100015187455_100011660834 [0,2,0,0,0,0|2,0,0]=4 13876 B18R2.269 Cc1ccc(nc1)COCc2cc(ccn2)Br 34a_100012001401_100010173614 [0,2,0,0,0,0|2,0,0]=4 13877 B18R2.269 Cc1ccc(nc1)COCc2cc(ccn2)C 34a_100011998357_100000691093 [0,2,0,0,0,0|2,0,0]=4 13878 B18R2.269 Cc1ccc(nc1)COCc2cc(ccn2)C 34a_100012001401_100000718516 [0,2,0,0,0,0|2,0,0]=4 13879 B18R2.269 Cc1ccc(nc1)COCc2cc(ccn2)Cl 34a_100000748867_100000691093 [0,2,0,0,0,0|2,0,0]=4 13880 B18R2.269 Cc1ccc(nc1)COCc2cc(ccn2)Cl 34a_100012001401_100016988179 [0,2,0,0,0,0|2,0,0]=4 13881 B18R2.269 Cc1ccc(nc1)COCc2cc(ccn2)N 34a_100000692640_100000691093 [0,2,0,0,0,0|2,0,0]=4 13882 B18R2.269 Cc1ccc(nc1)COCc2ccc[n+](c2)[O-] 34a_100000037817_100000691093 [0,2,0,0,0,0|2,0,0]=4 13883 B18R2.269 Cc1ccc(nc1)COCc2ccc[n+](c2)[O-] 7a_100000037817_100000691093 [0,2,0,0,0,0|2,0,0]=4 13884 B18R2.269 Cc1ccc(nc1)COCc2cccc(c2)Br 34a_100000687537_100000691093 [0,2,0,0,0,0|1,0,0]=3 13885 B18R2.269 Cc1ccc(nc1)COCc2cccc(c2)Br 34a_100012001401_100000698116 [0,2,0,0,0,0|1,0,0]=3 13886 B18R2.269 Cc1ccc(nc1)COCc2cccc(c2)Br 7a_100000687537_100000691093 [0,2,0,0,0,0|1,0,0]=3 13887 B18R2.269 Cc1ccc(nc1)COCc2cccc(c2)C 34a_100011217746_100000691093 [0,2,0,0,0,0|1,0,0]=3 13888 B18R2.269 Cc1ccc(nc1)COCc2cccc(c2)C 34a_100012001401_100000211840 [0,2,0,0,0,0|1,0,0]=3 13889 B18R2.269 Cc1ccc(nc1)COCc2cccc(c2)C 7a_100011217746_100000691093 [0,2,0,0,0,0|1,0,0]=3 13890 B18R2.269 Cc1ccc(nc1)COCc2cccc(c2)Cl 34a_100000241301_100000691093 [0,2,0,0,0,0|1,0,0]=3 13891 B18R2.269 Cc1ccc(nc1)COCc2cccc(c2)Cl 34a_100012001401_100000187163 [0,2,0,0,0,0|1,0,0]=3 13892 B18R2.269 Cc1ccc(nc1)COCc2cccc(c2)Cl 7a_100000241301_100000691093 [0,2,0,0,0,0|1,0,0]=3 13893 B18R2.269 Cc1ccc(nc1)COCc2cccc(c2)F 34a_100000210976_100000691093 [0,2,0,0,0,0|1,0,0]=3 13894 B18R2.269 Cc1ccc(nc1)COCc2cccc(c2)F 34a_100012001401_100000187166 [0,2,0,0,0,0|1,0,0]=3 13895 B18R2.269 Cc1ccc(nc1)COCc2cccc(c2)F 7a_100000210976_100000691093 [0,2,0,0,0,0|1,0,0]=3 13896 B18R2.269 Cc1ccc(nc1)COCc2cccc(c2)I 34a_100011215336_100000691093 [0,2,0,0,0,0|1,0,0]=3 13897 B18R2.269 Cc1ccc(nc1)COCc2cccc(c2)I 34a_100012001401_100011218688 [0,2,0,0,0,0|1,0,0]=3 13898 B18R2.269 Cc1ccc(nc1)COCc2cccc(c2)I 7a_100011215336_100000691093 [0,2,0,0,0,0|1,0,0]=3 13899 B18R2.269 Cc1ccc(nc1)COCc2cccc(c2)N 34a_100000211919_100000691093 [0,2,0,0,0,0|1,0,0]=3 13900 B18R2.269 Cc1ccc(nc1)COCc2cccc(c2)O 34a_100012001401_100011660834 [0,2,0,0,0,0|1,0,0]=3 13901 B18R2.269 Cc1ccc(nc1)COCc2cccc(n2)Br 34a_100000694195_100000691093 [0,2,0,0,0,0|2,0,0]=4 13902 B18R2.269 Cc1ccc(nc1)COCc2cccc(n2)Br 34a_100012001401_100009889011 [0,2,0,0,0,0|2,0,0]=4 13903 B18R2.269 Cc1ccc(nc1)COCc2cccc(n2)C 34a_100000690600_100000691093 [0,2,0,0,0,0|2,0,0]=4 13904 B18R2.269 Cc1ccc(nc1)COCc2cccc(n2)C 34a_100012001401_100000757606 [0,2,0,0,0,0|2,0,0]=4 13905 B18R2.269 Cc1ccc(nc1)COCc2cccc(n2)Cl 34a_100011998359_100000691093 [0,2,0,0,0,0|2,0,0]=4 13906 B18R2.269 Cc1ccc(nc1)COCc2cccc(n2)Cl 34a_100012001401_100000086093 [0,2,0,0,0,0|2,0,0]=4 13907 B18R2.269 Cc1ccc(nc1)COCc2cccc(n2)F 34a_100000086748_100000691093 [0,2,0,0,0,0|2,0,0]=4 13908 B18R2.269 Cc1ccc(nc1)COCc2cccc(n2)F 34a_100012001401_100009819644 [0,2,0,0,0,0|2,0,0]=4 13909 B18R2.269 Cc1ccc(nc1)COCc2ccnc(c2)Br 34a_100009814636_100000691093 [0,2,0,0,0,0|2,0,0]=4 13910 B18R2.269 Cc1ccc(nc1)COCc2ccnc(c2)Br 34a_100012001401_100010243470 [0,2,0,0,0,0|2,0,0]=4 13911 B18R2.269 Cc1ccc(nc1)COCc2ccnc(c2)Br 7a_100009814636_100000691093 [0,2,0,0,0,0|2,0,0]=4 13912 B18R2.269 Cc1ccc(nc1)COCc2ccnc(c2)C 34a_100011998630_100000691093 [0,2,0,0,0,0|2,0,0]=4 13913 B18R2.269 Cc1ccc(nc1)COCc2ccnc(c2)C 34a_100012001401_200020672517 [0,2,0,0,0,0|2,0,0]=4 13914 B18R2.269 Cc1ccc(nc1)COCc2ccnc(c2)Cl 34a_100000748751_100000691093 [0,2,0,0,0,0|2,0,0]=4 13915 B18R2.269 Cc1ccc(nc1)COCc2ccnc(c2)Cl 34a_100012001401_100000764220 [0,2,0,0,0,0|2,0,0]=4 13916 B18R2.269 Cc1ccc(nc1)COCc2ccnc(c2)F 34a_100000082451_100000691093 [0,2,0,0,0,0|2,0,0]=4 13917 B18R2.269 Cc1ccc(nc1)COCc2cncc(c2)Br 34a_100011259137_100000691093 [0,2,0,0,0,0|2,0,0]=4 13918 B18R2.269 Cc1ccc(nc1)COCc2cncc(c2)Br 34a_100012001401_100000738771 [0,2,0,0,0,0|2,0,0]=4 13919 B18R2.269 Cc1ccc(nc1)COCc2cncc(c2)Br 7a_100011259137_100000691093 [0,2,0,0,0,0|2,0,0]=4 13920 B18R2.269 Cc1ccc(nc1)COCc2cncc(c2)C 34a_100011998709_100000691093 [0,2,0,0,0,0|2,0,0]=4 13921 B18R2.269 Cc1ccc(nc1)COCc2cncc(c2)C 34a_100012001401_100000716715 [0,2,0,0,0,0|2,0,0]=4 13922 B18R2.269 Cc1ccc(nc1)COCc2cncc(c2)C 7a_100011998709_100000691093 [0,2,0,0,0,0|2,0,0]=4 13923 B18R2.269 Cc1ccc(nc1)COCc2cncc(c2)Cl 34a_100000092867_100000691093 [0,2,0,0,0,0|2,0,0]=4 13924 B18R2.269 Cc1ccc(nc1)COCc2cncc(c2)Cl 34a_100012001401_100016992070 [0,2,0,0,0,0|2,0,0]=4 13925 B18R2.269 Cc1ccc(nc1)COCc2cncc(c2)Cl 7a_100000092867_100000691093 [0,2,0,0,0,0|2,0,0]=4 13926 B18R2.269 Cc1ccc(nc1)COCc2cncc(c2)F 34a_100011962875_100000691093 [0,2,0,0,0,0|2,0,0]=4 13927 B18R2.269 Cc1ccc(nc1)COCc2cncc(c2)F 34a_100012001401_100000725299 [0,2,0,0,0,0|2,0,0]=4 13928 B18R2.269 Cc1ccc(nc1)COCc2cncc(c2)F 7a_100011962875_100000691093 [0,2,0,0,0,0|2,0,0]=4 13929 B18R2.269 Cc1ccc(nc1)COCc2cncc(c2)N 34a_100000085308_100000691093 [0,2,0,0,0,0|2,0,0]=4 13930 B18R2.269 Cc1ccc(nc1)CSCc2cccc(c2)Br 62a_100000211773_100000691093 [0,2,0,0,0,0|1,1,0]=4 13931 B18R2.269 Cc1ccc(nc1)CSCc2cccc(c2)Br 62a_100000691093_100000211773 [0,2,0,0,0,0|1,1,0]=4 13932 B18R2.269 Cc1ccc(nc1)CSCc2cccc(c2)C 62a_100000211840_100000691093 [0,2,0,0,0,0|1,1,0]=4 13933 B18R2.269 Cc1ccc(nc1)CSCc2cccc(c2)C 62a_100000691093_100000211840 [0,2,0,0,0,0|1,1,0]=4 13934 B18R2.269 Cc1ccc(nc1)CSCc2cccc(c2)Cl 62a_100000187163_100000691093 [0,2,0,0,0,0|1,1,0]=4 13935 B18R2.269 Cc1ccc(nc1)CSCc2cccc(c2)Cl 62a_100000691093_100000187163 [0,2,0,0,0,0|1,1,0]=4 13936 B18R2.269 Cc1ccc(nc1)CSCc2cccc(c2)F 62a_100000230114_100000691093 [0,2,0,0,0,0|1,1,0]=4 13937 B18R2.269 Cc1ccc(nc1)CSCc2cccc(c2)F 62a_100000691093_100000230114 [0,2,0,0,0,0|1,1,0]=4 13938 B18R2.269 Cc1ccc(nc1)CSCc2cccc(c2)I 62a_100000691093_100011218688 [0,2,0,0,0,0|1,1,0]=4 13939 B18R2.269 Cc1ccc(nc1)CSCc2cccc(c2)I 62a_100011218688_100000691093 [0,2,0,0,0,0|1,1,0]=4 13940 B18R2.269 Cc1ccc(nc1)CSCc2cccc(c2)O 62a_100000691093_100011660834 [0,2,0,0,0,0|1,1,0]=4 13941 B18R2.269 Cc1ccc(nc1)CSCc2cccc(c2)O 62a_100011660834_100000691093 [0,2,0,0,0,0|1,1,0]=4 13942 B18R2.269 Cc1cccc(c1)CCNc2ccc(cc2)Br 2230a_100000210018_100011713685 [0,2,0,0,0,0|2,0,0]=4 13943 B18R2.269 Cc1cccc(c1)CCNc2ccc(cc2)Br 34a_100000210018_100011713685 [0,2,0,0,0,0|2,0,0]=4 13944 B18R2.269 Cc1cccc(c1)CCNc2ccc(cc2)Cl 2230a_100000210052_100011713685 [0,2,0,0,0,0|2,0,0]=4 13945 B18R2.269 Cc1cccc(c1)CCNc2ccc(cc2)Cl 34a_100000210052_100011713685 [0,2,0,0,0,0|2,0,0]=4 13946 B18R2.269 Cc1cccc(c1)CCNc2ccc(cc2)F 34a_100000185862_100011713685 [0,2,0,0,0,0|2,0,0]=4 13947 B18R2.269 Cc1cccc(c1)CCNc2ccc(cc2)I 34a_100000185761_100011713685 [0,2,0,0,0,0|2,0,0]=4 13948 B18R2.269 Cc1cccc(c1)CCNc2ccc(cc2)O 34a_100000185829_100011713685 [0,2,0,0,0,0|2,0,0]=4 13949 B18R2.269 Cc1cccc(c1)CCOc2ccc(cc2)Br 34a_100000185759_100011713685 [0,2,0,0,0,0|2,0,0]=4 13950 B18R2.269 Cc1cccc(c1)CCOc2ccc(cc2)Br 7a_100000185759_100011713685 [0,2,0,0,0,0|2,0,0]=4 13951 B18R2.269 Cc1cccc(c1)CCOc2ccc(cc2)Cl 34a_100000210216_100011713685 [0,2,0,0,0,0|2,0,0]=4 13952 B18R2.269 Cc1cccc(c1)CCOc2ccc(cc2)Cl 7a_100000210216_100011713685 [0,2,0,0,0,0|2,0,0]=4 13953 B18R2.269 Cc1cccc(c1)CCOc2ccc(cc2)F 34a_100000210339_100011713685 [0,2,0,0,0,0|2,0,0]=4 13954 B18R2.269 Cc1cccc(c1)CCOc2ccc(cc2)I 34a_100000212066_100011713685 [0,2,0,0,0,0|2,0,0]=4 13955 B18R2.269 Cc1cccc(c1)CCOc2ccc(cc2)I 7a_100000212066_100011713685 [0,2,0,0,0,0|2,0,0]=4 13956 B18R2.269 Cc1cccc(c1)CCOc2ccc(cc2)N 34a_100000185829_100011713685 [0,2,0,0,0,0|2,0,0]=4 13957 B18R2.269 Cc1cccc(c1)CCSc2ccc(cc2)Br 62a_100000752885_100011713685 [0,2,0,0,0,0|2,0,0]=4 13958 B18R2.269 Cc1cccc(c1)CCSc2ccc(cc2)Br 62a_100011713685_100000752885 [0,2,0,0,0,0|2,0,0]=4 13959 B18R2.269 Cc1cccc(c1)CCSc2ccc(cc2)Cl 62a_100000755918_100011713685 [0,2,0,0,0,0|2,0,0]=4 13960 B18R2.269 Cc1cccc(c1)CCSc2ccc(cc2)Cl 62a_100011713685_100000755918 [0,2,0,0,0,0|2,0,0]=4 13961 B18R2.269 Cc1cccc(c1)CCSc2ccc(cc2)F 62a_100000211213_100011713685 [0,2,0,0,0,0|2,0,0]=4 13962 B18R2.269 Cc1cccc(c1)CCSc2ccc(cc2)F 62a_100011713685_100000211213 [0,2,0,0,0,0|2,0,0]=4 13963 B18R2.269 Cc1cccc(c1)CCSc2ccc(cc2)N 62a_100000185761_100011713685 [0,2,0,0,0,0|2,0,0]=4 13964 B18R2.269 Cc1cccc(c1)CCSc2ccc(cc2)N 62a_100011713685_100000185761 [0,2,0,0,0,0|2,0,0]=4 13965 B18R2.269 Cc1cccc(c1)CCSc2ccc(cc2)O 62a_100011713685_100000185759 [0,2,0,0,0,0|2,0,0]=4 13966 B18R2.269 Cc1cccc(c1)CNCc2ccc(cc2)Br 207a_100000174875_100000211157 [0,2,0,0,0,0|1,0,0]=3 13967 B18R2.269 Cc1cccc(c1)CNCc2ccc(cc2)Br 207a_100000185548_100000186029 [0,2,0,0,0,0|1,0,0]=3 13968 B18R2.269 Cc1cccc(c1)CNCc2ccc(cc2)Br 2230a_100000174875_100000211840 [0,2,0,0,0,0|1,0,0]=3 13969 B18R2.269 Cc1cccc(c1)CNCc2ccc(cc2)Br 2230a_100000185548_100011217064 [0,2,0,0,0,0|1,0,0]=3 13970 B18R2.269 Cc1cccc(c1)CNCc2ccc(cc2)Br 270004a_100000174875_100000211157 [0,2,0,0,0,0|1,0,0]=3 13971 B18R2.269 Cc1cccc(c1)CNCc2ccc(cc2)Br 270004a_100000185548_100000186029 [0,2,0,0,0,0|1,0,0]=3 13972 B18R2.269 Cc1cccc(c1)CNCc2ccc(cc2)Br 34a_100000174875_100000211840 [0,2,0,0,0,0|1,0,0]=3 13973 B18R2.269 Cc1cccc(c1)CNCc2ccc(cc2)Br 34a_100000185548_100000189115 [0,2,0,0,0,0|1,0,0]=3 13974 B18R2.269 Cc1cccc(c1)CNCc2ccc(cc2)Cl 207a_100000174871_100000211157 [0,2,0,0,0,0|1,0,0]=3 13975 B18R2.269 Cc1cccc(c1)CNCc2ccc(cc2)Cl 207a_100000185548_100000189385 [0,2,0,0,0,0|1,0,0]=3 13976 B18R2.269 Cc1cccc(c1)CNCc2ccc(cc2)Cl 2230a_100000174871_100000211840 [0,2,0,0,0,0|1,0,0]=3 13977 B18R2.269 Cc1cccc(c1)CNCc2ccc(cc2)Cl 2230a_100000185548_100000694040 [0,2,0,0,0,0|1,0,0]=3 13978 B18R2.269 Cc1cccc(c1)CNCc2ccc(cc2)Cl 270004a_100000174871_100000211157 [0,2,0,0,0,0|1,0,0]=3 13979 B18R2.269 Cc1cccc(c1)CNCc2ccc(cc2)Cl 270004a_100000185548_100000189385 [0,2,0,0,0,0|1,0,0]=3 13980 B18R2.269 Cc1cccc(c1)CNCc2ccc(cc2)Cl 34a_100000174871_100000211840 [0,2,0,0,0,0|1,0,0]=3 13981 B18R2.269 Cc1cccc(c1)CNCc2ccc(cc2)Cl 34a_100000185548_100000694040 [0,2,0,0,0,0|1,0,0]=3 13982 B18R2.269 Cc1cccc(c1)CNCc2ccc(cc2)F 207a_100000174882_100000211157 [0,2,0,0,0,0|1,0,0]=3 13983 B18R2.269 Cc1cccc(c1)CNCc2ccc(cc2)F 207a_100000185548_100000210084 [0,2,0,0,0,0|1,0,0]=3 13984 B18R2.269 Cc1cccc(c1)CNCc2ccc(cc2)F 2230a_100000174882_100000211840 [0,2,0,0,0,0|1,0,0]=3 13985 B18R2.269 Cc1cccc(c1)CNCc2ccc(cc2)F 2230a_100000185548_100000198546 [0,2,0,0,0,0|1,0,0]=3 13986 B18R2.269 Cc1cccc(c1)CNCc2ccc(cc2)F 270004a_100000174882_100000211157 [0,2,0,0,0,0|1,0,0]=3 13987 B18R2.269 Cc1cccc(c1)CNCc2ccc(cc2)F 270004a_100000185548_100000210084 [0,2,0,0,0,0|1,0,0]=3 13988 B18R2.269 Cc1cccc(c1)CNCc2ccc(cc2)F 34a_100000174882_100000211840 [0,2,0,0,0,0|1,0,0]=3 13989 B18R2.269 Cc1cccc(c1)CNCc2ccc(cc2)F 34a_100000185548_100000198546 [0,2,0,0,0,0|1,0,0]=3 13990 B18R2.269 Cc1cccc(c1)CNCc2ccc(cc2)I 207a_100000185548_100000188517 [0,2,0,0,0,0|1,0,0]=3 13991 B18R2.269 Cc1cccc(c1)CNCc2ccc(cc2)I 207a_100016989417_100000211157 [0,2,0,0,0,0|1,0,0]=3 13992 B18R2.269 Cc1cccc(c1)CNCc2ccc(cc2)I 2230a_100000185548_100000189116 [0,2,0,0,0,0|1,0,0]=3 13993 B18R2.269 Cc1cccc(c1)CNCc2ccc(cc2)I 2230a_100016989417_100000211840 [0,2,0,0,0,0|1,0,0]=3 13994 B18R2.269 Cc1cccc(c1)CNCc2ccc(cc2)I 270004a_100016989417_100000211157 [0,2,0,0,0,0|1,0,0]=3 13995 B18R2.269 Cc1cccc(c1)CNCc2ccc(cc2)I 34a_100000185548_100000189116 [0,2,0,0,0,0|1,0,0]=3 13996 B18R2.269 Cc1cccc(c1)CNCc2ccc(cc2)I 34a_100016989417_100000211840 [0,2,0,0,0,0|1,0,0]=3 13997 B18R2.269 Cc1cccc(c1)CNCc2ccc(cc2)O 34a_100000185549_100000211840 [0,2,0,0,0,0|1,0,0]=3 13998 B18R2.269 Cc1cccc(c1)CNCc2ccc(cn2)Br 207a_100000185548_100000754260 [0,2,0,0,0,0|2,0,0]=4 13999 B18R2.269 Cc1cccc(c1)CNCc2ccc(cn2)Br 2230a_100000185548_100000702658 [0,2,0,0,0,0|2,0,0]=4 14000 B18R2.269 Cc1cccc(c1)CNCc2ccc(cn2)Br 270004a_100000185548_100000754260 [0,2,0,0,0,0|2,0,0]=4 14001 B18R2.269 Cc1cccc(c1)CNCc2ccc(cn2)Br 34a_100000185548_100000702658 [0,2,0,0,0,0|2,0,0]=4 14002 B18R2.269 Cc1cccc(c1)CNCc2ccc(cn2)Br 34a_100015188789_100000211840 [0,2,0,0,0,0|2,0,0]=4 14003 B18R2.269 Cc1cccc(c1)CNCc2ccc(cn2)Cl 207a_100000185548_100011361569 [0,2,0,0,0,0|2,0,0]=4 14004 B18R2.269 Cc1cccc(c1)CNCc2ccc(cn2)Cl 2230a_100000185548_100012066911 [0,2,0,0,0,0|2,0,0]=4 14005 B18R2.269 Cc1cccc(c1)CNCc2ccc(cn2)Cl 270004a_100000185548_100011361569 [0,2,0,0,0,0|2,0,0]=4 14006 B18R2.269 Cc1cccc(c1)CNCc2ccc(cn2)Cl 270004a_100000697193_100000211157 [0,2,0,0,0,0|2,0,0]=4 14007 B18R2.269 Cc1cccc(c1)CNCc2ccc(cn2)Cl 34a_100000185548_100012066911 [0,2,0,0,0,0|2,0,0]=4 14008 B18R2.269 Cc1cccc(c1)CNCc2ccc(cn2)Cl 34a_100000697193_100000211840 [0,2,0,0,0,0|2,0,0]=4 14009 B18R2.269 Cc1cccc(c1)CNCc2ccc(cn2)F 207a_100000185548_100011934744 [0,2,0,0,0,0|2,0,0]=4 14010 B18R2.269 Cc1cccc(c1)CNCc2ccc(cn2)F 2230a_100000185548_100000703193 [0,2,0,0,0,0|2,0,0]=4 14011 B18R2.269 Cc1cccc(c1)CNCc2ccc(cn2)F 270004a_100000185548_100011934744 [0,2,0,0,0,0|2,0,0]=4 14012 B18R2.269 Cc1cccc(c1)CNCc2ccc(cn2)F 34a_100000185548_100000703193 [0,2,0,0,0,0|2,0,0]=4 14013 B18R2.269 Cc1cccc(c1)CNCc2ccc(cn2)F 34a_100020620131_100000211840 [0,2,0,0,0,0|2,0,0]=4 14014 B18R2.269 Cc1cccc(c1)CNCc2ccc(nc2)Br 207a_100009817727_100000211157 [0,2,0,0,0,0|2,0,0]=4 14015 B18R2.269 Cc1cccc(c1)CNCc2ccc(nc2)Br 2230a_100000185548_100009831999 [0,2,0,0,0,0|2,0,0]=4 14016 B18R2.269 Cc1cccc(c1)CNCc2ccc(nc2)Br 2230a_100009817727_100000211840 [0,2,0,0,0,0|2,0,0]=4 14017 B18R2.269 Cc1cccc(c1)CNCc2ccc(nc2)Br 270004a_100009817727_100000211157 [0,2,0,0,0,0|2,0,0]=4 14018 B18R2.269 Cc1cccc(c1)CNCc2ccc(nc2)Br 34a_100000185548_100009831999 [0,2,0,0,0,0|2,0,0]=4 14019 B18R2.269 Cc1cccc(c1)CNCc2ccc(nc2)Br 34a_100009817727_100000211840 [0,2,0,0,0,0|2,0,0]=4 14020 B18R2.269 Cc1cccc(c1)CNCc2ccc(nc2)C 207a_100000740942_100000211157 [0,2,0,0,0,0|2,0,0]=4 14021 B18R2.269 Cc1cccc(c1)CNCc2ccc(nc2)C 2230a_100000185548_100016987292 [0,2,0,0,0,0|2,0,0]=4 14022 B18R2.269 Cc1cccc(c1)CNCc2ccc(nc2)C 270004a_100000185548_100000743784 [0,2,0,0,0,0|2,0,0]=4 14023 B18R2.269 Cc1cccc(c1)CNCc2ccc(nc2)C 270004a_100000740942_100000211157 [0,2,0,0,0,0|2,0,0]=4 14024 B18R2.269 Cc1cccc(c1)CNCc2ccc(nc2)C 34a_100000185548_100016987292 [0,2,0,0,0,0|2,0,0]=4 14025 B18R2.269 Cc1cccc(c1)CNCc2ccc(nc2)C 34a_100000740942_100000211840 [0,2,0,0,0,0|2,0,0]=4 14026 B18R2.269 Cc1cccc(c1)CNCc2ccc(nc2)Cl 207a_100000735879_100000211157 [0,2,0,0,0,0|2,0,0]=4 14027 B18R2.269 Cc1cccc(c1)CNCc2ccc(nc2)Cl 2230a_100000185548_100000735431 [0,2,0,0,0,0|2,0,0]=4 14028 B18R2.269 Cc1cccc(c1)CNCc2ccc(nc2)Cl 2230a_100000735879_100000211840 [0,2,0,0,0,0|2,0,0]=4 14029 B18R2.269 Cc1cccc(c1)CNCc2ccc(nc2)Cl 270004a_100000735879_100000211157 [0,2,0,0,0,0|2,0,0]=4 14030 B18R2.269 Cc1cccc(c1)CNCc2ccc(nc2)Cl 34a_100000185548_100000735431 [0,2,0,0,0,0|2,0,0]=4 14031 B18R2.269 Cc1cccc(c1)CNCc2ccc(nc2)Cl 34a_100000735879_100000211840 [0,2,0,0,0,0|2,0,0]=4 14032 B18R2.269 Cc1cccc(c1)CNCc2ccc(nc2)F 2230a_100000101913_100000211840 [0,2,0,0,0,0|2,0,0]=4 14033 B18R2.269 Cc1cccc(c1)CNCc2ccc(nc2)F 2230a_100000185548_100009820150 [0,2,0,0,0,0|2,0,0]=4 14034 B18R2.269 Cc1cccc(c1)CNCc2ccc(nc2)F 270004a_100000101913_100000211157 [0,2,0,0,0,0|2,0,0]=4 14035 B18R2.269 Cc1cccc(c1)CNCc2ccc(nc2)F 34a_100000101913_100000211840 [0,2,0,0,0,0|2,0,0]=4 14036 B18R2.269 Cc1cccc(c1)CNCc2ccc(nc2)F 34a_100000185548_100000099788 [0,2,0,0,0,0|2,0,0]=4 14037 B18R2.269 Cc1cccc(c1)CNCc2ccc(nc2)O 207a_100000185548_100011361521 [0,2,0,0,0,0|2,0,0]=4 14038 B18R2.269 Cc1cccc(c1)CNCc2ccc(nc2)O 2230a_100000757128_100000211840 [0,2,0,0,0,0|2,0,0]=4 14039 B18R2.269 Cc1cccc(c1)COCc2cc[n+](cc2)C 34a_100009831711_100000211840 [0,2,0,0,0,0|1,0,0]=3 14040 B18R2.269 Cc1cccc(c1)COCc2cc[n+](cc2)[O-] 34a_100000031831_100000211840 [0,2,0,0,0,0|1,0,0]=3 14041 B18R2.269 Cc1cccc(c1)COCc2cc[n+](cc2)[O-] 7a_100000031831_100000211840 [0,2,0,0,0,0|1,0,0]=3 14042 B18R2.269 Cc1cccc(c1)COCc2ccc(=O)[nH]c2 34a_100011999846_100000211840 [0,2,0,0,0,0|1,0,0]=3 14043 B18R2.269 Cc1cccc(c1)COCc2ccc(cc2)Br 34a_100000695286_100000211840 [0,2,0,0,0,0|0,0,0]=2 14044 B18R2.269 Cc1cccc(c1)COCc2ccc(cc2)Br 34a_100011217746_100000189115 [0,2,0,0,0,0|0,0,0]=2 14045 B18R2.269 Cc1cccc(c1)COCc2ccc(cc2)Br 7a_100011217746_100011217064 [0,2,0,0,0,0|0,0,0]=2 14046 B18R2.269 Cc1cccc(c1)COCc2ccc(cc2)Cl 34a_100000211118_100000211840 [0,2,0,0,0,0|0,0,0]=2 14047 B18R2.269 Cc1cccc(c1)COCc2ccc(cc2)Cl 34a_100011217746_100000694040 [0,2,0,0,0,0|0,0,0]=2 14048 B18R2.269 Cc1cccc(c1)COCc2ccc(cc2)Cl 7a_100000211118_100000211840 [0,2,0,0,0,0|0,0,0]=2 14049 B18R2.269 Cc1cccc(c1)COCc2ccc(cc2)Cl 7a_100011217746_100000187161 [0,2,0,0,0,0|0,0,0]=2 14050 B18R2.269 Cc1cccc(c1)COCc2ccc(cc2)F 34a_100000210977_100000211840 [0,2,0,0,0,0|0,0,0]=2 14051 B18R2.269 Cc1cccc(c1)COCc2ccc(cc2)F 34a_100011217746_100000198546 [0,2,0,0,0,0|0,0,0]=2 14052 B18R2.269 Cc1cccc(c1)COCc2ccc(cc2)F 7a_100000210977_100000211840 [0,2,0,0,0,0|0,0,0]=2 14053 B18R2.269 Cc1cccc(c1)COCc2ccc(cc2)F 7a_100011217746_100000198546 [0,2,0,0,0,0|0,0,0]=2 14054 B18R2.269 Cc1cccc(c1)COCc2ccc(cc2)I 34a_100000690907_100000211840 [0,2,0,0,0,0|0,0,0]=2 14055 B18R2.269 Cc1cccc(c1)COCc2ccc(cc2)I 34a_100011217746_100000189116 [0,2,0,0,0,0|0,0,0]=2 14056 B18R2.269 Cc1cccc(c1)COCc2ccc(cc2)I 7a_100000690907_100000211840 [0,2,0,0,0,0|0,0,0]=2 14057 B18R2.269 Cc1cccc(c1)COCc2ccc(cc2)I 7a_100011217746_100000189116 [0,2,0,0,0,0|0,0,0]=2 14058 B18R2.269 Cc1cccc(c1)COCc2ccc(cc2)N 34a_100011215238_100000211840 [0,2,0,0,0,0|0,0,0]=2 14059 B18R2.269 Cc1cccc(c1)COCc2ccc(cn2)Br 34a_100000754261_100000211840 [0,2,0,0,0,0|1,0,0]=3 14060 B18R2.269 Cc1cccc(c1)COCc2ccc(cn2)Br 34a_100011217746_100000702658 [0,2,0,0,0,0|1,0,0]=3 14061 B18R2.269 Cc1cccc(c1)COCc2ccc(cn2)Br 7a_100011217746_100000702658 [0,2,0,0,0,0|1,0,0]=3 14062 B18R2.269 Cc1cccc(c1)COCc2ccc(cn2)Cl 34a_100000703999_100000211840 [0,2,0,0,0,0|1,0,0]=3 14063 B18R2.269 Cc1cccc(c1)COCc2ccc(cn2)Cl 34a_100011217746_100012066911 [0,2,0,0,0,0|1,0,0]=3 14064 B18R2.269 Cc1cccc(c1)COCc2ccc(cn2)Cl 7a_100011217746_100012066911 [0,2,0,0,0,0|1,0,0]=3 14065 B18R2.269 Cc1cccc(c1)COCc2ccc(cn2)F 34a_100011217746_100000703193 [0,2,0,0,0,0|1,0,0]=3 14066 B18R2.269 Cc1cccc(c1)COCc2ccc(cn2)F 34a_100011999454_100000211840 [0,2,0,0,0,0|1,0,0]=3 14067 B18R2.269 Cc1cccc(c1)COCc2ccc(cn2)F 7a_100011217746_100000703193 [0,2,0,0,0,0|1,0,0]=3 14068 B18R2.269 Cc1cccc(c1)COCc2ccc(cn2)N 34a_100011998161_100000211840 [0,2,0,0,0,0|1,0,0]=3 14069 B18R2.269 Cc1cccc(c1)COCc2ccc(nc2)Br 34a_100009816760_100000211840 [0,2,0,0,0,0|1,0,0]=3 14070 B18R2.269 Cc1cccc(c1)COCc2ccc(nc2)Br 34a_100011217746_100009831999 [0,2,0,0,0,0|1,0,0]=3 14071 B18R2.269 Cc1cccc(c1)COCc2ccc(nc2)Br 7a_100009816760_100000211840 [0,2,0,0,0,0|1,0,0]=3 14072 B18R2.269 Cc1cccc(c1)COCc2ccc(nc2)Br 7a_100011217746_100009831999 [0,2,0,0,0,0|1,0,0]=3 14073 B18R2.269 Cc1cccc(c1)COCc2ccc(nc2)C 34a_100011217746_100016987292 [0,2,0,0,0,0|1,0,0]=3 14074 B18R2.269 Cc1cccc(c1)COCc2ccc(nc2)C 34a_100011248133_100000211840 [0,2,0,0,0,0|1,0,0]=3 14075 B18R2.269 Cc1cccc(c1)COCc2ccc(nc2)C 7a_100011217746_100016987292 [0,2,0,0,0,0|1,0,0]=3 14076 B18R2.269 Cc1cccc(c1)COCc2ccc(nc2)Cl 34a_100000755211_100000211840 [0,2,0,0,0,0|1,0,0]=3 14077 B18R2.269 Cc1cccc(c1)COCc2ccc(nc2)Cl 34a_100011217746_100000735431 [0,2,0,0,0,0|1,0,0]=3 14078 B18R2.269 Cc1cccc(c1)COCc2ccc(nc2)Cl 7a_100000755211_100000211840 [0,2,0,0,0,0|1,0,0]=3 14079 B18R2.269 Cc1cccc(c1)COCc2ccc(nc2)Cl 7a_100011217746_100000735431 [0,2,0,0,0,0|1,0,0]=3 14080 B18R2.269 Cc1cccc(c1)COCc2ccc(nc2)F 34a_100000079959_100000211840 [0,2,0,0,0,0|1,0,0]=3 14081 B18R2.269 Cc1cccc(c1)COCc2ccc(nc2)F 34a_100011217746_100000099788 [0,2,0,0,0,0|1,0,0]=3 14082 B18R2.269 Cc1cccc(c1)COCc2ccc(nc2)F 7a_100011217746_100009820150 [0,2,0,0,0,0|1,0,0]=3 14083 B18R2.269 Cc1cccc(c1)COCc2ccc(nc2)N 34a_100000704267_100000211840 [0,2,0,0,0,0|1,0,0]=3 14084 B18R2.269 Cc1cccc(c1)COCc2ccc(nn2)Cl 34a_100011217746_100016992710 [0,2,0,0,0,0|2,0,0]=4 14085 B18R2.269 Cc1cccc(c1)COCc2ccc(nn2)Cl 7a_100011217746_100016992710 [0,2,0,0,0,0|2,0,0]=4 14086 B18R2.269 Cc1cccc(c1)COCc2cnc(cn2)C 34a_100011273949_100000211840 [0,2,0,0,0,0|2,0,0]=4 14087 B18R2.269 Cc1cccc(c1)COCc2cnc(cn2)C 7a_100011217746_100000752025 [0,2,0,0,0,0|2,0,0]=4 14088 B18R2.269 Cc1cccc(c1)COCc2cnc(cn2)Cl 34a_100012002382_100000211840 [0,2,0,0,0,0|2,0,0]=4 14089 B18R2.269 Cc1cccc(c1)COCc2cnc(nc2)C 34a_100011746891_100000211840 [0,2,0,0,0,0|2,0,0]=4 14090 B18R2.269 Cc1cccc(c1)COCc2cnc(nc2)Cl 34a_100009855073_100000211840 [0,2,0,0,0,0|2,0,0]=4 14091 B18R2.269 Cc1cccc(c1)COCc2cnc(nc2)Cl 7a_100009855073_100000211840 [0,2,0,0,0,0|2,0,0]=4 14092 B18R2.269 Cc1cccc(c1)COCc2ncc(cn2)Br 34a_100011217746_100010064664 [0,2,0,0,0,0|2,0,0]=4 14093 B18R2.269 Cc1cccc(c1)COCc2ncc(cn2)Br 7a_100011217746_100010064664 [0,2,0,0,0,0|2,0,0]=4 14094 B18R2.269 Cc1cccc(c1)CSCc2ccc(cc2)Br 62a_100000189115_100000211840 [0,2,0,0,0,0|0,1,0]=3 14095 B18R2.269 Cc1cccc(c1)CSCc2ccc(cc2)Br 62a_100000211840_100000189115 [0,2,0,0,0,0|0,1,0]=3 14096 B18R2.269 Cc1cccc(c1)CSCc2ccc(cc2)Cl 62a_100000187161_100000211840 [0,2,0,0,0,0|0,1,0]=3 14097 B18R2.269 Cc1cccc(c1)CSCc2ccc(cc2)Cl 62a_100000211840_100000187161 [0,2,0,0,0,0|0,1,0]=3 14098 B18R2.269 Cc1cccc(c1)CSCc2ccc(cc2)F 62a_100000198546_100000211840 [0,2,0,0,0,0|0,1,0]=3 14099 B18R2.269 Cc1cccc(c1)CSCc2ccc(cc2)F 62a_100000211840_100000187164 [0,2,0,0,0,0|0,1,0]=3 14100 B18R2.269 Cc1cccc(c1)CSCc2ccc(cc2)I 62a_100000189116_100000211840 [0,2,0,0,0,0|0,1,0]=3 14101 B18R2.269 Cc1cccc(c1)CSCc2ccc(cc2)I 62a_100000211840_100000189116 [0,2,0,0,0,0|0,1,0]=3 14102 B18R2.269 Cc1cccc(c1)CSCc2ccc(cn2)Br 62a_100000211840_100000702658 [0,2,0,0,0,0|1,1,0]=4 14103 B18R2.269 Cc1cccc(c1)CSCc2ccc(cn2)Br 62a_100000702658_100000211840 [0,2,0,0,0,0|1,1,0]=4 14104 B18R2.269 Cc1cccc(c1)CSCc2ccc(cn2)Cl 62a_100000211840_100000697101 [0,2,0,0,0,0|1,1,0]=4 14105 B18R2.269 Cc1cccc(c1)CSCc2ccc(cn2)Cl 62a_100012066911_100000211840 [0,2,0,0,0,0|1,1,0]=4 14106 B18R2.269 Cc1cccc(c1)CSCc2ccc(cn2)F 62a_100000211840_100000703193 [0,2,0,0,0,0|1,1,0]=4 14107 B18R2.269 Cc1cccc(c1)CSCc2ccc(cn2)F 62a_100000703193_100000211840 [0,2,0,0,0,0|1,1,0]=4 14108 B18R2.269 Cc1cccc(c1)CSCc2ccc(nc2)Br 62a_100000211840_100009831999 [0,2,0,0,0,0|1,1,0]=4 14109 B18R2.269 Cc1cccc(c1)CSCc2ccc(nc2)Br 62a_100009831999_100000211840 [0,2,0,0,0,0|1,1,0]=4 14110 B18R2.269 Cc1cccc(c1)CSCc2ccc(nc2)C 62a_100000211840_100016987292 [0,2,0,0,0,0|1,1,0]=4 14111 B18R2.269 Cc1cccc(c1)CSCc2ccc(nc2)C 62a_100016987292_100000211840 [0,2,0,0,0,0|1,1,0]=4 14112 B18R2.269 Cc1cccc(c1)CSCc2ccc(nc2)Cl 62a_100000211840_100000735431 [0,2,0,0,0,0|1,1,0]=4 14113 B18R2.269 Cc1cccc(c1)CSCc2ccc(nc2)Cl 62a_100000735431_100000211840 [0,2,0,0,0,0|1,1,0]=4 14114 B18R2.269 Cc1cccc(c1)CSCc2ccc(nc2)F 62a_100000211840_100000099788 [0,2,0,0,0,0|1,1,0]=4 14115 B18R2.269 Cc1cccc(c1)CSCc2ccc(nc2)F 62a_100009820150_100000211840 [0,2,0,0,0,0|1,1,0]=4 14116 B18R2.269 Cc1cccc(c1)NCCc2ccc(cc2)Br 2230a_100000188690_100011740612 [0,2,0,0,0,0|2,0,0]=4 14117 B18R2.269 Cc1cccc(c1)NCCc2ccc(cc2)Br 34a_100000188690_100011740612 [0,2,0,0,0,0|2,0,0]=4 14118 B18R2.269 Cc1cccc(c1)NCCc2ccc(cc2)Cl 2230a_100000188690_100011713675 [0,2,0,0,0,0|2,0,0]=4 14119 B18R2.269 Cc1cccc(c1)NCCc2ccc(cc2)Cl 34a_100000188690_100011713675 [0,2,0,0,0,0|2,0,0]=4 14120 B18R2.269 Cc1cccc(c1)NCCc2ccc(cc2)F 2230a_100000188690_100011217392 [0,2,0,0,0,0|2,0,0]=4 14121 B18R2.269 Cc1cccc(c1)NCCc2ccc(cc2)F 34a_100000188690_100011217392 [0,2,0,0,0,0|2,0,0]=4 14122 B18R2.269 Cc1cccc(c1)NCCc2ccc(cc2)O 2230a_100000188690_100009816426 [0,2,0,0,0,0|2,0,0]=4 14123 B18R2.269 Cc1cccc(c1)OCCc2ccc(cc2)Br 34a_100000210337_100011740612 [0,2,0,0,0,0|2,0,0]=4 14124 B18R2.269 Cc1cccc(c1)OCCc2ccc(cc2)Br 7a_100000210337_100011740612 [0,2,0,0,0,0|2,0,0]=4 14125 B18R2.269 Cc1cccc(c1)OCCc2ccc(cc2)Cl 34a_100000210337_100011713675 [0,2,0,0,0,0|2,0,0]=4 14126 B18R2.269 Cc1cccc(c1)OCCc2ccc(cc2)Cl 7a_100000210337_100011713675 [0,2,0,0,0,0|2,0,0]=4 14127 B18R2.269 Cc1cccc(c1)OCCc2ccc(cc2)F 34a_100000210337_100011217392 [0,2,0,0,0,0|2,0,0]=4 14128 B18R2.269 Cc1cccc(c1)OCCc2ccc(cc2)F 7a_100000210337_100011217392 [0,2,0,0,0,0|2,0,0]=4 14129 B18R2.269 Cc1cccc(c1)OCCc2ccc(cc2)O 7a_100000210337_100009816426 [0,2,0,0,0,0|2,0,0]=4 14130 B18R2.269 Cc1cccc(c1)SCCc2ccc(cc2)Br 62a_100011215228_100011740612 [0,2,0,0,0,0|2,0,0]=4 14131 B18R2.269 Cc1cccc(c1)SCCc2ccc(cc2)Br 62a_100011740612_100011215228 [0,2,0,0,0,0|2,0,0]=4 14132 B18R2.269 Cc1cccc(c1)SCCc2ccc(cc2)Cl 62a_100011215228_100011713675 [0,2,0,0,0,0|2,0,0]=4 14133 B18R2.269 Cc1cccc(c1)SCCc2ccc(cc2)Cl 62a_100011713675_100011215228 [0,2,0,0,0,0|2,0,0]=4 14134 B18R2.269 Cc1cccc(c1)SCCc2ccc(cc2)F 62a_100011215228_100011217392 [0,2,0,0,0,0|2,0,0]=4 14135 B18R2.269 Cc1cccc(c1)SCCc2ccc(cc2)F 62a_100011217392_100011215228 [0,2,0,0,0,0|2,0,0]=4 14136 B18R2.269 Cc1cccc(c1)SCCc2ccc(cc2)O 62a_100009816426_100011215228 [0,2,0,0,0,0|2,0,0]=4 14137 B18R2.269 Cc1cccc(c1)SCCc2ccc(cc2)O 62a_100011215228_100009816426 [0,2,0,0,0,0|2,0,0]=4 14138 B18R2.269 Cc1cccc(n1)CNCc2ccc(cc2)Br 207a_100000174875_100011215050 [0,2,0,0,0,0|2,0,0]=4 14139 B18R2.269 Cc1cccc(n1)CNCc2ccc(cc2)Br 2230a_100000174875_100000757606 [0,2,0,0,0,0|2,0,0]=4 14140 B18R2.269 Cc1cccc(n1)CNCc2ccc(cc2)Br 270004a_100000174875_100011215050 [0,2,0,0,0,0|2,0,0]=4 14141 B18R2.269 Cc1cccc(n1)CNCc2ccc(cc2)Br 34a_100000174875_100000757606 [0,2,0,0,0,0|2,0,0]=4 14142 B18R2.269 Cc1cccc(n1)CNCc2ccc(cc2)Br 34a_100000701342_100000189115 [0,2,0,0,0,0|2,0,0]=4 14143 B18R2.269 Cc1cccc(n1)CNCc2ccc(cc2)Cl 207a_100000174871_100011215050 [0,2,0,0,0,0|2,0,0]=4 14144 B18R2.269 Cc1cccc(n1)CNCc2ccc(cc2)Cl 2230a_100000174871_100000757606 [0,2,0,0,0,0|2,0,0]=4 14145 B18R2.269 Cc1cccc(n1)CNCc2ccc(cc2)Cl 270004a_100000174871_100011215050 [0,2,0,0,0,0|2,0,0]=4 14146 B18R2.269 Cc1cccc(n1)CNCc2ccc(cc2)Cl 34a_100000174871_100000757606 [0,2,0,0,0,0|2,0,0]=4 14147 B18R2.269 Cc1cccc(n1)CNCc2ccc(cc2)Cl 34a_100000701342_100000694040 [0,2,0,0,0,0|2,0,0]=4 14148 B18R2.269 Cc1cccc(n1)CNCc2ccc(cc2)F 207a_100000174882_100011215050 [0,2,0,0,0,0|2,0,0]=4 14149 B18R2.269 Cc1cccc(n1)CNCc2ccc(cc2)F 2230a_100000174882_100000757606 [0,2,0,0,0,0|2,0,0]=4 14150 B18R2.269 Cc1cccc(n1)CNCc2ccc(cc2)F 270004a_100000174882_100011215050 [0,2,0,0,0,0|2,0,0]=4 14151 B18R2.269 Cc1cccc(n1)CNCc2ccc(cc2)F 34a_100000174882_100000757606 [0,2,0,0,0,0|2,0,0]=4 14152 B18R2.269 Cc1cccc(n1)CNCc2ccc(cc2)F 34a_100000701342_100000198546 [0,2,0,0,0,0|2,0,0]=4 14153 B18R2.269 Cc1cccc(n1)CNCc2ccc(cc2)I 207a_100016989417_100011215050 [0,2,0,0,0,0|2,0,0]=4 14154 B18R2.269 Cc1cccc(n1)CNCc2ccc(cc2)I 2230a_100016989417_100000757606 [0,2,0,0,0,0|2,0,0]=4 14155 B18R2.269 Cc1cccc(n1)CNCc2ccc(cc2)I 270004a_100016989417_100011215050 [0,2,0,0,0,0|2,0,0]=4 14156 B18R2.269 Cc1cccc(n1)CNCc2ccc(cc2)I 34a_100000701342_100000189116 [0,2,0,0,0,0|2,0,0]=4 14157 B18R2.269 Cc1cccc(n1)CNCc2ccc(cc2)I 34a_100016989417_100000757606 [0,2,0,0,0,0|2,0,0]=4 14158 B18R2.269 Cc1cccc(n1)CNCc2ccc(cc2)O 34a_100000185549_100000757606 [0,2,0,0,0,0|2,0,0]=4 14159 B18R2.269 Cc1cccc(n1)COCc2cc[n+](cc2)C 34a_100009831711_100000757606 [0,2,0,0,0,0|2,0,0]=4 14160 B18R2.269 Cc1cccc(n1)COCc2cc[n+](cc2)[O-] 34a_100000031831_100000757606 [0,2,0,0,0,0|2,0,0]=4 14161 B18R2.269 Cc1cccc(n1)COCc2cc[n+](cc2)[O-] 7a_100000031831_100000757606 [0,2,0,0,0,0|2,0,0]=4 14162 B18R2.269 Cc1cccc(n1)COCc2ccc(=O)[nH]c2 34a_100011999846_100000757606 [0,2,0,0,0,0|2,0,0]=4 14163 B18R2.269 Cc1cccc(n1)COCc2ccc(cc2)Br 34a_100000690600_100000189115 [0,2,0,0,0,0|1,0,0]=3 14164 B18R2.269 Cc1cccc(n1)COCc2ccc(cc2)Br 34a_100000695286_100000757606 [0,2,0,0,0,0|1,0,0]=3 14165 B18R2.269 Cc1cccc(n1)COCc2ccc(cc2)Cl 34a_100000211118_100000757606 [0,2,0,0,0,0|1,0,0]=3 14166 B18R2.269 Cc1cccc(n1)COCc2ccc(cc2)Cl 34a_100000690600_100000694040 [0,2,0,0,0,0|1,0,0]=3 14167 B18R2.269 Cc1cccc(n1)COCc2ccc(cc2)Cl 7a_100000211118_100000757606 [0,2,0,0,0,0|1,0,0]=3 14168 B18R2.269 Cc1cccc(n1)COCc2ccc(cc2)F 34a_100000210977_100000757606 [0,2,0,0,0,0|1,0,0]=3 14169 B18R2.269 Cc1cccc(n1)COCc2ccc(cc2)F 34a_100000690600_100000198546 [0,2,0,0,0,0|1,0,0]=3 14170 B18R2.269 Cc1cccc(n1)COCc2ccc(cc2)F 7a_100000210977_100000757606 [0,2,0,0,0,0|1,0,0]=3 14171 B18R2.269 Cc1cccc(n1)COCc2ccc(cc2)I 34a_100000690600_100000189116 [0,2,0,0,0,0|1,0,0]=3 14172 B18R2.269 Cc1cccc(n1)COCc2ccc(cc2)I 34a_100000690907_100000757606 [0,2,0,0,0,0|1,0,0]=3 14173 B18R2.269 Cc1cccc(n1)COCc2ccc(cc2)I 7a_100000690907_100000757606 [0,2,0,0,0,0|1,0,0]=3 14174 B18R2.269 Cc1cccc(n1)COCc2ccc(cc2)N 34a_100011215238_100000757606 [0,2,0,0,0,0|1,0,0]=3 14175 B18R2.269 Cc1cccc(n1)COCc2ccc(cn2)Br 34a_100000690600_100000702658 [0,2,0,0,0,0|2,0,0]=4 14176 B18R2.269 Cc1cccc(n1)COCc2ccc(cn2)Br 34a_100000754261_100000757606 [0,2,0,0,0,0|2,0,0]=4 14177 B18R2.269 Cc1cccc(n1)COCc2ccc(cn2)Cl 34a_100000690600_100012066911 [0,2,0,0,0,0|2,0,0]=4 14178 B18R2.269 Cc1cccc(n1)COCc2ccc(cn2)Cl 34a_100000703999_100000757606 [0,2,0,0,0,0|2,0,0]=4 14179 B18R2.269 Cc1cccc(n1)COCc2ccc(cn2)F 34a_100000690600_100000703193 [0,2,0,0,0,0|2,0,0]=4 14180 B18R2.269 Cc1cccc(n1)COCc2ccc(cn2)F 34a_100011999454_100000757606 [0,2,0,0,0,0|2,0,0]=4 14181 B18R2.269 Cc1cccc(n1)COCc2ccc(cn2)N 34a_100011998161_100000757606 [0,2,0,0,0,0|2,0,0]=4 14182 B18R2.269 Cc1cccc(n1)COCc2ccc(nc2)Br 34a_100000690600_100009831999 [0,2,0,0,0,0|2,0,0]=4 14183 B18R2.269 Cc1cccc(n1)COCc2ccc(nc2)Br 34a_100009816760_100000757606 [0,2,0,0,0,0|2,0,0]=4 14184 B18R2.269 Cc1cccc(n1)COCc2ccc(nc2)Br 7a_100009816760_100000757606 [0,2,0,0,0,0|2,0,0]=4 14185 B18R2.269 Cc1cccc(n1)COCc2ccc(nc2)Cl 34a_100000690600_100000735431 [0,2,0,0,0,0|2,0,0]=4 14186 B18R2.269 Cc1cccc(n1)COCc2ccc(nc2)Cl 34a_100000755211_100000757606 [0,2,0,0,0,0|2,0,0]=4 14187 B18R2.269 Cc1cccc(n1)COCc2ccc(nc2)Cl 7a_100000755211_100000757606 [0,2,0,0,0,0|2,0,0]=4 14188 B18R2.269 Cc1cccc(n1)COCc2ccc(nc2)F 34a_100000079959_100000757606 [0,2,0,0,0,0|2,0,0]=4 14189 B18R2.269 Cc1cccc(n1)COCc2ccc(nc2)F 34a_100000690600_100000099788 [0,2,0,0,0,0|2,0,0]=4 14190 B18R2.269 Cc1cccc(n1)COCc2ccc(nc2)N 34a_100000704267_100000757606 [0,2,0,0,0,0|2,0,0]=4 14191 B18R2.269 Cc1cccc(n1)CSCc2ccc(cc2)Br 62a_100000189115_100000757606 [0,2,0,0,0,0|1,1,0]=4 14192 B18R2.269 Cc1cccc(n1)CSCc2ccc(cc2)Br 62a_100000757606_100000189115 [0,2,0,0,0,0|1,1,0]=4 14193 B18R2.269 Cc1cccc(n1)CSCc2ccc(cc2)Cl 62a_100000187161_100000757606 [0,2,0,0,0,0|1,1,0]=4 14194 B18R2.269 Cc1cccc(n1)CSCc2ccc(cc2)Cl 62a_100000757606_100000187161 [0,2,0,0,0,0|1,1,0]=4 14195 B18R2.269 Cc1cccc(n1)CSCc2ccc(cc2)F 62a_100000198546_100000757606 [0,2,0,0,0,0|1,1,0]=4 14196 B18R2.269 Cc1cccc(n1)CSCc2ccc(cc2)F 62a_100000757606_100000187164 [0,2,0,0,0,0|1,1,0]=4 14197 B18R2.269 Cc1cccc(n1)CSCc2ccc(cc2)I 62a_100000189116_100000757606 [0,2,0,0,0,0|1,1,0]=4 14198 B18R2.269 Cc1cccc(n1)CSCc2ccc(cc2)I 62a_100000757606_100000189116 [0,2,0,0,0,0|1,1,0]=4 14199 B18R2.269 Cc1ccnc(c1)CNCc2ccc(cc2)Br 207a_100000174875_100011361488 [0,2,0,0,0,0|2,0,0]=4 14200 B18R2.269 Cc1ccnc(c1)CNCc2ccc(cc2)Br 2230a_100000174875_100000718516 [0,2,0,0,0,0|2,0,0]=4 14201 B18R2.269 Cc1ccnc(c1)CNCc2ccc(cc2)Br 270004a_100000174875_100011361488 [0,2,0,0,0,0|2,0,0]=4 14202 B18R2.269 Cc1ccnc(c1)CNCc2ccc(cc2)Br 34a_100000174875_100000718516 [0,2,0,0,0,0|2,0,0]=4 14203 B18R2.269 Cc1ccnc(c1)CNCc2ccc(cc2)Cl 207a_100000174871_100011361488 [0,2,0,0,0,0|2,0,0]=4 14204 B18R2.269 Cc1ccnc(c1)CNCc2ccc(cc2)Cl 2230a_100000174871_100000718516 [0,2,0,0,0,0|2,0,0]=4 14205 B18R2.269 Cc1ccnc(c1)CNCc2ccc(cc2)Cl 270004a_100000174871_100011361488 [0,2,0,0,0,0|2,0,0]=4 14206 B18R2.269 Cc1ccnc(c1)CNCc2ccc(cc2)Cl 34a_100000174871_100000718516 [0,2,0,0,0,0|2,0,0]=4 14207 B18R2.269 Cc1ccnc(c1)CNCc2ccc(cc2)F 207a_100000174882_100011361488 [0,2,0,0,0,0|2,0,0]=4 14208 B18R2.269 Cc1ccnc(c1)CNCc2ccc(cc2)F 2230a_100000174882_100000718516 [0,2,0,0,0,0|2,0,0]=4 14209 B18R2.269 Cc1ccnc(c1)CNCc2ccc(cc2)F 270004a_100000174882_100011361488 [0,2,0,0,0,0|2,0,0]=4 14210 B18R2.269 Cc1ccnc(c1)CNCc2ccc(cc2)F 34a_100000174882_100000718516 [0,2,0,0,0,0|2,0,0]=4 14211 B18R2.269 Cc1ccnc(c1)CNCc2ccc(cc2)I 207a_100016989417_100011361488 [0,2,0,0,0,0|2,0,0]=4 14212 B18R2.269 Cc1ccnc(c1)CNCc2ccc(cc2)I 2230a_100016989417_100000718516 [0,2,0,0,0,0|2,0,0]=4 14213 B18R2.269 Cc1ccnc(c1)CNCc2ccc(cc2)I 270004a_100016989417_100011361488 [0,2,0,0,0,0|2,0,0]=4 14214 B18R2.269 Cc1ccnc(c1)CNCc2ccc(cc2)I 34a_100016989417_100000718516 [0,2,0,0,0,0|2,0,0]=4 14215 B18R2.269 Cc1ccnc(c1)CNCc2ccc(cc2)O 34a_100000185549_100000718516 [0,2,0,0,0,0|2,0,0]=4 14216 B18R2.269 Cc1ccnc(c1)COCc2cc[n+](cc2)C 34a_100009831711_100000718516 [0,2,0,0,0,0|2,0,0]=4 14217 B18R2.269 Cc1ccnc(c1)COCc2cc[n+](cc2)[O-] 34a_100000031831_100000718516 [0,2,0,0,0,0|2,0,0]=4 14218 B18R2.269 Cc1ccnc(c1)COCc2cc[n+](cc2)[O-] 7a_100000031831_100000718516 [0,2,0,0,0,0|2,0,0]=4 14219 B18R2.269 Cc1ccnc(c1)COCc2ccc(=O)[nH]c2 34a_100011999846_100000718516 [0,2,0,0,0,0|2,0,0]=4 14220 B18R2.269 Cc1ccnc(c1)COCc2ccc(cc2)Br 34a_100000695286_100000718516 [0,2,0,0,0,0|1,0,0]=3 14221 B18R2.269 Cc1ccnc(c1)COCc2ccc(cc2)Br 34a_100011998357_100000189115 [0,2,0,0,0,0|1,0,0]=3 14222 B18R2.269 Cc1ccnc(c1)COCc2ccc(cc2)Cl 34a_100000211118_100000718516 [0,2,0,0,0,0|1,0,0]=3 14223 B18R2.269 Cc1ccnc(c1)COCc2ccc(cc2)Cl 34a_100011998357_100000694040 [0,2,0,0,0,0|1,0,0]=3 14224 B18R2.269 Cc1ccnc(c1)COCc2ccc(cc2)Cl 7a_100000211118_100000718516 [0,2,0,0,0,0|1,0,0]=3 14225 B18R2.269 Cc1ccnc(c1)COCc2ccc(cc2)F 34a_100000210977_100000718516 [0,2,0,0,0,0|1,0,0]=3 14226 B18R2.269 Cc1ccnc(c1)COCc2ccc(cc2)F 34a_100011998357_100000198546 [0,2,0,0,0,0|1,0,0]=3 14227 B18R2.269 Cc1ccnc(c1)COCc2ccc(cc2)F 7a_100000210977_100000718516 [0,2,0,0,0,0|1,0,0]=3 14228 B18R2.269 Cc1ccnc(c1)COCc2ccc(cc2)I 34a_100000690907_100000718516 [0,2,0,0,0,0|1,0,0]=3 14229 B18R2.269 Cc1ccnc(c1)COCc2ccc(cc2)I 34a_100011998357_100000189116 [0,2,0,0,0,0|1,0,0]=3 14230 B18R2.269 Cc1ccnc(c1)COCc2ccc(cc2)I 7a_100000690907_100000718516 [0,2,0,0,0,0|1,0,0]=3 14231 B18R2.269 Cc1ccnc(c1)COCc2ccc(cc2)N 34a_100011215238_100000718516 [0,2,0,0,0,0|1,0,0]=3 14232 B18R2.269 Cc1ccnc(c1)COCc2ccc(cn2)Br 34a_100000754261_100000718516 [0,2,0,0,0,0|2,0,0]=4 14233 B18R2.269 Cc1ccnc(c1)COCc2ccc(cn2)Br 34a_100011998357_100000702658 [0,2,0,0,0,0|2,0,0]=4 14234 B18R2.269 Cc1ccnc(c1)COCc2ccc(cn2)Cl 34a_100000703999_100000718516 [0,2,0,0,0,0|2,0,0]=4 14235 B18R2.269 Cc1ccnc(c1)COCc2ccc(cn2)Cl 34a_100011998357_100012066911 [0,2,0,0,0,0|2,0,0]=4 14236 B18R2.269 Cc1ccnc(c1)COCc2ccc(cn2)F 34a_100011998357_100000703193 [0,2,0,0,0,0|2,0,0]=4 14237 B18R2.269 Cc1ccnc(c1)COCc2ccc(cn2)F 34a_100011999454_100000718516 [0,2,0,0,0,0|2,0,0]=4 14238 B18R2.269 Cc1ccnc(c1)COCc2ccc(cn2)N 34a_100011998161_100000718516 [0,2,0,0,0,0|2,0,0]=4 14239 B18R2.269 Cc1ccnc(c1)COCc2ccc(nc2)Br 34a_100009816760_100000718516 [0,2,0,0,0,0|2,0,0]=4 14240 B18R2.269 Cc1ccnc(c1)COCc2ccc(nc2)Br 34a_100011998357_100009831999 [0,2,0,0,0,0|2,0,0]=4 14241 B18R2.269 Cc1ccnc(c1)COCc2ccc(nc2)Br 7a_100009816760_100000718516 [0,2,0,0,0,0|2,0,0]=4 14242 B18R2.269 Cc1ccnc(c1)COCc2ccc(nc2)C 34a_100011248133_100000718516 [0,2,0,0,0,0|2,0,0]=4 14243 B18R2.269 Cc1ccnc(c1)COCc2ccc(nc2)C 34a_100011998357_100016987292 [0,2,0,0,0,0|2,0,0]=4 14244 B18R2.269 Cc1ccnc(c1)COCc2ccc(nc2)Cl 34a_100000755211_100000718516 [0,2,0,0,0,0|2,0,0]=4 14245 B18R2.269 Cc1ccnc(c1)COCc2ccc(nc2)Cl 34a_100011998357_100000735431 [0,2,0,0,0,0|2,0,0]=4 14246 B18R2.269 Cc1ccnc(c1)COCc2ccc(nc2)Cl 7a_100000755211_100000718516 [0,2,0,0,0,0|2,0,0]=4 14247 B18R2.269 Cc1ccnc(c1)COCc2ccc(nc2)F 34a_100000079959_100000718516 [0,2,0,0,0,0|2,0,0]=4 14248 B18R2.269 Cc1ccnc(c1)COCc2ccc(nc2)F 34a_100011998357_100000099788 [0,2,0,0,0,0|2,0,0]=4 14249 B18R2.269 Cc1ccnc(c1)COCc2ccc(nc2)N 34a_100000704267_100000718516 [0,2,0,0,0,0|2,0,0]=4 14250 B18R2.269 Cc1ccnc(c1)CSCc2ccc(cc2)Br 62a_100000189115_100000718516 [0,2,0,0,0,0|1,1,0]=4 14251 B18R2.269 Cc1ccnc(c1)CSCc2ccc(cc2)Br 62a_100000718516_100000189115 [0,2,0,0,0,0|1,1,0]=4 14252 B18R2.269 Cc1ccnc(c1)CSCc2ccc(cc2)Cl 62a_100000187161_100000718516 [0,2,0,0,0,0|1,1,0]=4 14253 B18R2.269 Cc1ccnc(c1)CSCc2ccc(cc2)Cl 62a_100000718516_100000187161 [0,2,0,0,0,0|1,1,0]=4 14254 B18R2.269 Cc1ccnc(c1)CSCc2ccc(cc2)F 62a_100000198546_100000718516 [0,2,0,0,0,0|1,1,0]=4 14255 B18R2.269 Cc1ccnc(c1)CSCc2ccc(cc2)F 62a_100000718516_100000187164 [0,2,0,0,0,0|1,1,0]=4 14256 B18R2.269 Cc1ccnc(c1)CSCc2ccc(cc2)I 62a_100000189116_100000718516 [0,2,0,0,0,0|1,1,0]=4 14257 B18R2.269 Cc1ccnc(c1)CSCc2ccc(cc2)I 62a_100000718516_100000189116 [0,2,0,0,0,0|1,1,0]=4 14258 B18R2.269 Cc1cnc(cn1)COCc2cccc(c2)Br 34a_100011273949_100000698116 [0,2,0,0,0,0|2,0,0]=4 14259 B18R2.269 Cc1cnc(cn1)COCc2cccc(c2)Br 7a_100000687537_100000752025 [0,2,0,0,0,0|2,0,0]=4 14260 B18R2.269 Cc1cnc(cn1)COCc2cccc(c2)Cl 34a_100011273949_100000187163 [0,2,0,0,0,0|2,0,0]=4 14261 B18R2.269 Cc1cnc(cn1)COCc2cccc(c2)Cl 7a_100000241301_100000752025 [0,2,0,0,0,0|2,0,0]=4 14262 B18R2.269 Cc1cnc(cn1)COCc2cccc(c2)F 34a_100011273949_100000187166 [0,2,0,0,0,0|2,0,0]=4 14263 B18R2.269 Cc1cnc(cn1)COCc2cccc(c2)F 7a_100000210976_100000752025 [0,2,0,0,0,0|2,0,0]=4 14264 B18R2.269 Cc1cnc(cn1)COCc2cccc(c2)I 34a_100011273949_100011218688 [0,2,0,0,0,0|2,0,0]=4 14265 B18R2.269 Cc1cnc(cn1)COCc2cccc(c2)I 7a_100011215336_100000752025 [0,2,0,0,0,0|2,0,0]=4 14266 B18R2.269 Cc1cnc(cn1)COCc2cccc(c2)O 34a_100011273949_100011660834 [0,2,0,0,0,0|2,0,0]=4 14267 B18R2.269 Cc1cnc(nc1)COCc2cccc(c2)Br 34a_100000687537_100000685645 [0,2,0,0,0,0|2,0,0]=4 14268 B18R2.269 Cc1cnc(nc1)COCc2cccc(c2)Br 7a_100000687537_100000685645 [0,2,0,0,0,0|2,0,0]=4 14269 B18R2.269 Cc1cnc(nc1)COCc2cccc(c2)C 34a_100011217746_100000685645 [0,2,0,0,0,0|2,0,0]=4 14270 B18R2.269 Cc1cnc(nc1)COCc2cccc(c2)C 7a_100011217746_100000685645 [0,2,0,0,0,0|2,0,0]=4 14271 B18R2.269 Cc1cnc(nc1)COCc2cccc(c2)Cl 34a_100000241301_100000685645 [0,2,0,0,0,0|2,0,0]=4 14272 B18R2.269 Cc1cnc(nc1)COCc2cccc(c2)Cl 7a_100000241301_100000685645 [0,2,0,0,0,0|2,0,0]=4 14273 B18R2.269 Cc1cnc(nc1)COCc2cccc(c2)F 34a_100000210976_100000685645 [0,2,0,0,0,0|2,0,0]=4 14274 B18R2.269 Cc1cnc(nc1)COCc2cccc(c2)F 7a_100000210976_100000685645 [0,2,0,0,0,0|2,0,0]=4 14275 B18R2.269 Cc1cnc(nc1)COCc2cccc(c2)I 34a_100011215336_100000685645 [0,2,0,0,0,0|2,0,0]=4 14276 B18R2.269 Cc1cnc(nc1)COCc2cccc(c2)I 7a_100011215336_100000685645 [0,2,0,0,0,0|2,0,0]=4 14277 B18R2.269 Cc1cnc(nc1)COCc2cccc(c2)N 34a_100000211919_100000685645 [0,2,0,0,0,0|2,0,0]=4 14278 B18R2.269 Cc1cncc(c1)CNCc2ccc(cc2)Br 207a_100000174875_100011998712 [0,2,0,0,0,0|2,0,0]=4 14279 B18R2.269 Cc1cncc(c1)CNCc2ccc(cc2)Br 207a_100000692839_100000186029 [0,2,0,0,0,0|2,0,0]=4 14280 B18R2.269 Cc1cncc(c1)CNCc2ccc(cc2)Br 2230a_100000174875_100000716715 [0,2,0,0,0,0|2,0,0]=4 14281 B18R2.269 Cc1cncc(c1)CNCc2ccc(cc2)Br 2230a_100000692839_100011217064 [0,2,0,0,0,0|2,0,0]=4 14282 B18R2.269 Cc1cncc(c1)CNCc2ccc(cc2)Br 270004a_100000174875_100011998712 [0,2,0,0,0,0|2,0,0]=4 14283 B18R2.269 Cc1cncc(c1)CNCc2ccc(cc2)Br 270004a_100000692839_100000186029 [0,2,0,0,0,0|2,0,0]=4 14284 B18R2.269 Cc1cncc(c1)CNCc2ccc(cc2)Br 34a_100000174875_100000716715 [0,2,0,0,0,0|2,0,0]=4 14285 B18R2.269 Cc1cncc(c1)CNCc2ccc(cc2)Br 34a_100000692839_100000189115 [0,2,0,0,0,0|2,0,0]=4 14286 B18R2.269 Cc1cncc(c1)CNCc2ccc(cc2)Cl 207a_100000174871_100011998712 [0,2,0,0,0,0|2,0,0]=4 14287 B18R2.269 Cc1cncc(c1)CNCc2ccc(cc2)Cl 207a_100000692839_100000189385 [0,2,0,0,0,0|2,0,0]=4 14288 B18R2.269 Cc1cncc(c1)CNCc2ccc(cc2)Cl 2230a_100000174871_100000716715 [0,2,0,0,0,0|2,0,0]=4 14289 B18R2.269 Cc1cncc(c1)CNCc2ccc(cc2)Cl 2230a_100000692839_100000694040 [0,2,0,0,0,0|2,0,0]=4 14290 B18R2.269 Cc1cncc(c1)CNCc2ccc(cc2)Cl 270004a_100000174871_100011998712 [0,2,0,0,0,0|2,0,0]=4 14291 B18R2.269 Cc1cncc(c1)CNCc2ccc(cc2)Cl 270004a_100000692839_100000189385 [0,2,0,0,0,0|2,0,0]=4 14292 B18R2.269 Cc1cncc(c1)CNCc2ccc(cc2)Cl 34a_100000174871_100000716715 [0,2,0,0,0,0|2,0,0]=4 14293 B18R2.269 Cc1cncc(c1)CNCc2ccc(cc2)Cl 34a_100000692839_100000694040 [0,2,0,0,0,0|2,0,0]=4 14294 B18R2.269 Cc1cncc(c1)CNCc2ccc(cc2)F 207a_100000174882_100011998712 [0,2,0,0,0,0|2,0,0]=4 14295 B18R2.269 Cc1cncc(c1)CNCc2ccc(cc2)F 207a_100000692839_100000210084 [0,2,0,0,0,0|2,0,0]=4 14296 B18R2.269 Cc1cncc(c1)CNCc2ccc(cc2)F 2230a_100000174882_100000716715 [0,2,0,0,0,0|2,0,0]=4 14297 B18R2.269 Cc1cncc(c1)CNCc2ccc(cc2)F 2230a_100000692839_100000198546 [0,2,0,0,0,0|2,0,0]=4 14298 B18R2.269 Cc1cncc(c1)CNCc2ccc(cc2)F 270004a_100000174882_100011998712 [0,2,0,0,0,0|2,0,0]=4 14299 B18R2.269 Cc1cncc(c1)CNCc2ccc(cc2)F 270004a_100000692839_100000210084 [0,2,0,0,0,0|2,0,0]=4 14300 B18R2.269 Cc1cncc(c1)CNCc2ccc(cc2)F 34a_100000174882_100000716715 [0,2,0,0,0,0|2,0,0]=4 14301 B18R2.269 Cc1cncc(c1)CNCc2ccc(cc2)F 34a_100000692839_100000198546 [0,2,0,0,0,0|2,0,0]=4 14302 B18R2.269 Cc1cncc(c1)CNCc2ccc(cc2)I 207a_100000692839_100000188517 [0,2,0,0,0,0|2,0,0]=4 14303 B18R2.269 Cc1cncc(c1)CNCc2ccc(cc2)I 207a_100016989417_100011998712 [0,2,0,0,0,0|2,0,0]=4 14304 B18R2.269 Cc1cncc(c1)CNCc2ccc(cc2)I 2230a_100000692839_100000189116 [0,2,0,0,0,0|2,0,0]=4 14305 B18R2.269 Cc1cncc(c1)CNCc2ccc(cc2)I 2230a_100016989417_100000716715 [0,2,0,0,0,0|2,0,0]=4 14306 B18R2.269 Cc1cncc(c1)CNCc2ccc(cc2)I 270004a_100016989417_100011998712 [0,2,0,0,0,0|2,0,0]=4 14307 B18R2.269 Cc1cncc(c1)CNCc2ccc(cc2)I 34a_100000692839_100000189116 [0,2,0,0,0,0|2,0,0]=4 14308 B18R2.269 Cc1cncc(c1)CNCc2ccc(cc2)I 34a_100016989417_100000716715 [0,2,0,0,0,0|2,0,0]=4 14309 B18R2.269 Cc1cncc(c1)CNCc2ccc(cc2)O 34a_100000185549_100000716715 [0,2,0,0,0,0|2,0,0]=4 14310 B18R2.269 Cc1cncc(c1)COCc2cc[n+](cc2)C 34a_100009831711_100000716715 [0,2,0,0,0,0|2,0,0]=4 14311 B18R2.269 Cc1cncc(c1)COCc2cc[n+](cc2)[O-] 34a_100000031831_100000716715 [0,2,0,0,0,0|2,0,0]=4 14312 B18R2.269 Cc1cncc(c1)COCc2cc[n+](cc2)[O-] 7a_100000031831_100000716715 [0,2,0,0,0,0|2,0,0]=4 14313 B18R2.269 Cc1cncc(c1)COCc2ccc(=O)[nH]c2 34a_100011999846_100000716715 [0,2,0,0,0,0|2,0,0]=4 14314 B18R2.269 Cc1cncc(c1)COCc2ccc(cc2)Br 34a_100000695286_100000716715 [0,2,0,0,0,0|1,0,0]=3 14315 B18R2.269 Cc1cncc(c1)COCc2ccc(cc2)Br 34a_100011998709_100000189115 [0,2,0,0,0,0|1,0,0]=3 14316 B18R2.269 Cc1cncc(c1)COCc2ccc(cc2)Br 7a_100011998709_100011217064 [0,2,0,0,0,0|1,0,0]=3 14317 B18R2.269 Cc1cncc(c1)COCc2ccc(cc2)Cl 34a_100000211118_100000716715 [0,2,0,0,0,0|1,0,0]=3 14318 B18R2.269 Cc1cncc(c1)COCc2ccc(cc2)Cl 34a_100011998709_100000694040 [0,2,0,0,0,0|1,0,0]=3 14319 B18R2.269 Cc1cncc(c1)COCc2ccc(cc2)Cl 7a_100000211118_100000716715 [0,2,0,0,0,0|1,0,0]=3 14320 B18R2.269 Cc1cncc(c1)COCc2ccc(cc2)Cl 7a_100011998709_100000187161 [0,2,0,0,0,0|1,0,0]=3 14321 B18R2.269 Cc1cncc(c1)COCc2ccc(cc2)F 34a_100000210977_100000716715 [0,2,0,0,0,0|1,0,0]=3 14322 B18R2.269 Cc1cncc(c1)COCc2ccc(cc2)F 34a_100011998709_100000198546 [0,2,0,0,0,0|1,0,0]=3 14323 B18R2.269 Cc1cncc(c1)COCc2ccc(cc2)F 7a_100000210977_100000716715 [0,2,0,0,0,0|1,0,0]=3 14324 B18R2.269 Cc1cncc(c1)COCc2ccc(cc2)F 7a_100011998709_100000198546 [0,2,0,0,0,0|1,0,0]=3 14325 B18R2.269 Cc1cncc(c1)COCc2ccc(cc2)I 34a_100000690907_100000716715 [0,2,0,0,0,0|1,0,0]=3 14326 B18R2.269 Cc1cncc(c1)COCc2ccc(cc2)I 34a_100011998709_100000189116 [0,2,0,0,0,0|1,0,0]=3 14327 B18R2.269 Cc1cncc(c1)COCc2ccc(cc2)I 7a_100000690907_100000716715 [0,2,0,0,0,0|1,0,0]=3 14328 B18R2.269 Cc1cncc(c1)COCc2ccc(cc2)I 7a_100011998709_100000189116 [0,2,0,0,0,0|1,0,0]=3 14329 B18R2.269 Cc1cncc(c1)COCc2ccc(cc2)N 34a_100011215238_100000716715 [0,2,0,0,0,0|1,0,0]=3 14330 B18R2.269 Cc1cncc(c1)COCc2ccc(cn2)Br 34a_100000754261_100000716715 [0,2,0,0,0,0|2,0,0]=4 14331 B18R2.269 Cc1cncc(c1)COCc2ccc(cn2)Br 34a_100011998709_100000702658 [0,2,0,0,0,0|2,0,0]=4 14332 B18R2.269 Cc1cncc(c1)COCc2ccc(cn2)Br 7a_100011998709_100000702658 [0,2,0,0,0,0|2,0,0]=4 14333 B18R2.269 Cc1cncc(c1)COCc2ccc(cn2)Cl 34a_100000703999_100000716715 [0,2,0,0,0,0|2,0,0]=4 14334 B18R2.269 Cc1cncc(c1)COCc2ccc(cn2)Cl 34a_100011998709_100012066911 [0,2,0,0,0,0|2,0,0]=4 14335 B18R2.269 Cc1cncc(c1)COCc2ccc(cn2)Cl 7a_100011998709_100012066911 [0,2,0,0,0,0|2,0,0]=4 14336 B18R2.269 Cc1cncc(c1)COCc2ccc(cn2)F 34a_100011998709_100000703193 [0,2,0,0,0,0|2,0,0]=4 14337 B18R2.269 Cc1cncc(c1)COCc2ccc(cn2)F 34a_100011999454_100000716715 [0,2,0,0,0,0|2,0,0]=4 14338 B18R2.269 Cc1cncc(c1)COCc2ccc(cn2)F 7a_100011998709_100000703193 [0,2,0,0,0,0|2,0,0]=4 14339 B18R2.269 Cc1cncc(c1)COCc2ccc(cn2)N 34a_100011998161_100000716715 [0,2,0,0,0,0|2,0,0]=4 14340 B18R2.269 Cc1cncc(c1)COCc2ccc(nc2)Br 34a_100009816760_100000716715 [0,2,0,0,0,0|2,0,0]=4 14341 B18R2.269 Cc1cncc(c1)COCc2ccc(nc2)Br 34a_100011998709_100009831999 [0,2,0,0,0,0|2,0,0]=4 14342 B18R2.269 Cc1cncc(c1)COCc2ccc(nc2)Br 7a_100009816760_100000716715 [0,2,0,0,0,0|2,0,0]=4 14343 B18R2.269 Cc1cncc(c1)COCc2ccc(nc2)Br 7a_100011998709_100009831999 [0,2,0,0,0,0|2,0,0]=4 14344 B18R2.269 Cc1cncc(c1)COCc2ccc(nc2)C 34a_100011248133_100000716715 [0,2,0,0,0,0|2,0,0]=4 14345 B18R2.269 Cc1cncc(c1)COCc2ccc(nc2)C 34a_100011998709_100016987292 [0,2,0,0,0,0|2,0,0]=4 14346 B18R2.269 Cc1cncc(c1)COCc2ccc(nc2)C 7a_100011998709_100016987292 [0,2,0,0,0,0|2,0,0]=4 14347 B18R2.269 Cc1cncc(c1)COCc2ccc(nc2)Cl 34a_100000755211_100000716715 [0,2,0,0,0,0|2,0,0]=4 14348 B18R2.269 Cc1cncc(c1)COCc2ccc(nc2)Cl 34a_100011998709_100000735431 [0,2,0,0,0,0|2,0,0]=4 14349 B18R2.269 Cc1cncc(c1)COCc2ccc(nc2)Cl 7a_100000755211_100000716715 [0,2,0,0,0,0|2,0,0]=4 14350 B18R2.269 Cc1cncc(c1)COCc2ccc(nc2)Cl 7a_100011998709_100000735431 [0,2,0,0,0,0|2,0,0]=4 14351 B18R2.269 Cc1cncc(c1)COCc2ccc(nc2)F 34a_100000079959_100000716715 [0,2,0,0,0,0|2,0,0]=4 14352 B18R2.269 Cc1cncc(c1)COCc2ccc(nc2)F 34a_100011998709_100000099788 [0,2,0,0,0,0|2,0,0]=4 14353 B18R2.269 Cc1cncc(c1)COCc2ccc(nc2)F 7a_100011998709_100009820150 [0,2,0,0,0,0|2,0,0]=4 14354 B18R2.269 Cc1cncc(c1)COCc2ccc(nc2)N 34a_100000704267_100000716715 [0,2,0,0,0,0|2,0,0]=4 14355 B18R2.269 Cc1cncc(c1)CSCc2ccc(cc2)Br 62a_100000189115_100000716715 [0,2,0,0,0,0|1,1,0]=4 14356 B18R2.269 Cc1cncc(c1)CSCc2ccc(cc2)Br 62a_100000716715_100000189115 [0,2,0,0,0,0|1,1,0]=4 14357 B18R2.269 Cc1cncc(c1)CSCc2ccc(cc2)Cl 62a_100000187161_100000716715 [0,2,0,0,0,0|1,1,0]=4 14358 B18R2.269 Cc1cncc(c1)CSCc2ccc(cc2)Cl 62a_100000716715_100000187161 [0,2,0,0,0,0|1,1,0]=4 14359 B18R2.269 Cc1cncc(c1)CSCc2ccc(cc2)F 62a_100000198546_100000716715 [0,2,0,0,0,0|1,1,0]=4 14360 B18R2.269 Cc1cncc(c1)CSCc2ccc(cc2)F 62a_100000716715_100000187164 [0,2,0,0,0,0|1,1,0]=4 14361 B18R2.269 Cc1cncc(c1)CSCc2ccc(cc2)I 62a_100000189116_100000716715 [0,2,0,0,0,0|1,1,0]=4 14362 B18R2.269 Cc1cncc(c1)CSCc2ccc(cc2)I 62a_100000716715_100000189116 [0,2,0,0,0,0|1,1,0]=4 14363 B18R2.269 Cc1cnnc(c1)COCc2ccc(cc2)Br 34a_100016212594_100000189115 [0,2,0,0,0,0|2,0,0]=4 14364 B18R2.269 Cc1cnnc(c1)COCc2ccc(cc2)Cl 34a_100016212594_100000694040 [0,2,0,0,0,0|2,0,0]=4 14365 B18R2.269 Cc1cnnc(c1)COCc2ccc(cc2)F 34a_100016212594_100000198546 [0,2,0,0,0,0|2,0,0]=4 14366 B18R2.269 Cc1cnnc(c1)COCc2ccc(cc2)I 34a_100016212594_100000189116 [0,2,0,0,0,0|2,0,0]=4 14367 B18R2.269 Cc1ncc(cn1)COCc2cccc(c2)Br 34a_100011746891_100000698116 [0,2,0,0,0,0|2,0,0]=4 14368 B18R2.269 Cc1ncc(cn1)COCc2cccc(c2)Cl 34a_100011746891_100000187163 [0,2,0,0,0,0|2,0,0]=4 14369 B18R2.269 Cc1ncc(cn1)COCc2cccc(c2)F 34a_100011746891_100000187166 [0,2,0,0,0,0|2,0,0]=4 14370 B18R2.269 Cc1ncc(cn1)COCc2cccc(c2)I 34a_100011746891_100011218688 [0,2,0,0,0,0|2,0,0]=4 14371 B18R2.269 Cc1ncc(cn1)COCc2cccc(c2)O 34a_100011746891_100011660834 [0,2,0,0,0,0|2,0,0]=4 14372 B18R2.269 Clc1cc(ccn1)CNCc2ccc(cc2)Br 2230a_100000174875_100000764220 [0,2,0,0,0,0|2,0,0]=4 14373 B18R2.269 Clc1cc(ccn1)CNCc2ccc(cc2)Br 2230a_100015205668_100011217064 [0,2,0,0,0,0|2,0,0]=4 14374 B18R2.269 Clc1cc(ccn1)CNCc2ccc(cc2)Br 26a_100015205668_100000185759 [0,2,0,0,0,0|2,0,0]=4 14375 B18R2.269 Clc1cc(ccn1)CNCc2ccc(cc2)Br 270004a_100000174875_100011290808 [0,2,0,0,0,0|2,0,0]=4 14376 B18R2.269 Clc1cc(ccn1)CNCc2ccc(cc2)Br 270004a_100015205668_100000186029 [0,2,0,0,0,0|2,0,0]=4 14377 B18R2.269 Clc1cc(ccn1)CNCc2ccc(cc2)Br 34a_100000174875_100000764220 [0,2,0,0,0,0|2,0,0]=4 14378 B18R2.269 Clc1cc(ccn1)CNCc2ccc(cc2)Br 34a_100015205668_100000189115 [0,2,0,0,0,0|2,0,0]=4 14379 B18R2.269 Clc1cc(ccn1)CNCc2ccc(cc2)I 2230a_100015205668_100000189116 [0,2,0,0,0,0|2,0,0]=4 14380 B18R2.269 Clc1cc(ccn1)CNCc2ccc(cc2)I 2230a_100016989417_100000764220 [0,2,0,0,0,0|2,0,0]=4 14381 B18R2.269 Clc1cc(ccn1)CNCc2ccc(cc2)I 270004a_100016989417_100011290808 [0,2,0,0,0,0|2,0,0]=4 14382 B18R2.269 Clc1cc(ccn1)CNCc2ccc(cc2)I 34a_100015205668_100000189116 [0,2,0,0,0,0|2,0,0]=4 14383 B18R2.269 Clc1cc(ccn1)CNCc2ccc(cc2)I 34a_100016989417_100000764220 [0,2,0,0,0,0|2,0,0]=4 14384 B18R2.269 Clc1cc(ccn1)COCc2ccc(cc2)Br 34a_100000695286_100000764220 [0,2,0,0,0,0|1,0,0]=3 14385 B18R2.269 Clc1cc(ccn1)COCc2ccc(cc2)Br 34a_100000748751_100000189115 [0,2,0,0,0,0|1,0,0]=3 14386 B18R2.269 Clc1cc(ccn1)COCc2ccc(cc2)I 34a_100000690907_100000764220 [0,2,0,0,0,0|1,0,0]=3 14387 B18R2.269 Clc1cc(ccn1)COCc2ccc(cc2)I 34a_100000748751_100000189116 [0,2,0,0,0,0|1,0,0]=3 14388 B18R2.269 Clc1cc(ccn1)COCc2ccc(cc2)I 7a_100000690907_100000764220 [0,2,0,0,0,0|1,0,0]=3 14389 B18R2.269 Clc1cc(ccn1)COCc2ccc(cn2)Br 34a_100000748751_100000702658 [0,2,0,0,0,0|2,0,0]=4 14390 B18R2.269 Clc1cc(ccn1)COCc2ccc(cn2)Br 34a_100000754261_100000764220 [0,2,0,0,0,0|2,0,0]=4 14391 B18R2.269 Clc1cc(ccn1)COCc2ccc(nc2)Br 34a_100000748751_100009831999 [0,2,0,0,0,0|2,0,0]=4 14392 B18R2.269 Clc1cc(ccn1)COCc2ccc(nc2)Br 34a_100009816760_100000764220 [0,2,0,0,0,0|2,0,0]=4 14393 B18R2.269 Clc1cc(ccn1)COCc2ccc(nc2)Br 7a_100009816760_100000764220 [0,2,0,0,0,0|2,0,0]=4 14394 B18R2.269 Clc1cc(ccn1)CSCc2ccc(cc2)Br 62a_100000189115_100000764220 [0,2,0,0,0,0|1,1,0]=4 14395 B18R2.269 Clc1cc(ccn1)CSCc2ccc(cc2)Br 62a_100000764220_100000189115 [0,2,0,0,0,0|1,1,0]=4 14396 B18R2.269 Clc1cc(ccn1)CSCc2ccc(cc2)I 62a_100000189116_100000764220 [0,2,0,0,0,0|1,1,0]=4 14397 B18R2.269 Clc1cc(ccn1)CSCc2ccc(cc2)I 62a_100000764220_100000189116 [0,2,0,0,0,0|1,1,0]=4 14398 B18R2.269 Clc1ccc(cc1)CCNc2cccc(c2)Br 34a_100000210019_100011713675 [0,2,0,0,0,0|2,0,0]=4 14399 B18R2.269 Clc1ccc(cc1)CCNc2cccc(c2)Cl 34a_100000185859_100011713675 [0,2,0,0,0,0|2,0,0]=4 14400 B18R2.269 Clc1ccc(cc1)CCNc2cccc(c2)I 34a_100000211102_100011713675 [0,2,0,0,0,0|2,0,0]=4 14401 B18R2.269 Clc1ccc(cc1)CCOc2cccc(c2)Br 34a_100000210342_100011713675 [0,2,0,0,0,0|2,0,0]=4 14402 B18R2.269 Clc1ccc(cc1)CCOc2cccc(c2)Br 7a_100000210342_100011713675 [0,2,0,0,0,0|2,0,0]=4 14403 B18R2.269 Clc1ccc(cc1)CCOc2cccc(c2)Cl 34a_100000210295_100011713675 [0,2,0,0,0,0|2,0,0]=4 14404 B18R2.269 Clc1ccc(cc1)CCOc2cccc(c2)Cl 7a_100000210295_100011713675 [0,2,0,0,0,0|2,0,0]=4 14405 B18R2.269 Clc1ccc(cc1)CCOc2cccc(c2)I 34a_100000211634_100011713675 [0,2,0,0,0,0|2,0,0]=4 14406 B18R2.269 Clc1ccc(cc1)CCOc2cccc(c2)I 7a_100000211634_100011713675 [0,2,0,0,0,0|2,0,0]=4 14407 B18R2.269 Clc1ccc(cc1)CCSc2cccc(c2)Br 62a_100000691529_100011713675 [0,2,0,0,0,0|2,0,0]=4 14408 B18R2.269 Clc1ccc(cc1)CCSc2cccc(c2)Br 62a_100011713675_100000691529 [0,2,0,0,0,0|2,0,0]=4 14409 B18R2.269 Clc1ccc(cc1)CCSc2cccc(c2)Cl 62a_100000699651_100011713675 [0,2,0,0,0,0|2,0,0]=4 14410 B18R2.269 Clc1ccc(cc1)CCSc2cccc(c2)Cl 62a_100011713675_100000699651 [0,2,0,0,0,0|2,0,0]=4 14411 B18R2.269 Clc1ccc(cc1)CNCc2cc(ccn2)Br 2230a_100000174871_100010173614 [0,2,0,0,0,0|2,0,0]=4 14412 B18R2.269 Clc1ccc(cc1)CNCc2cc(ccn2)Br 270004a_100000174871_100009818557 [0,2,0,0,0,0|2,0,0]=4 14413 B18R2.269 Clc1ccc(cc1)CNCc2cc(ccn2)Br 34a_100000174871_100010173614 [0,2,0,0,0,0|2,0,0]=4 14414 B18R2.269 Clc1ccc(cc1)CNCc2cc(ccn2)Cl 2230a_100000174871_100016988179 [0,2,0,0,0,0|2,0,0]=4 14415 B18R2.269 Clc1ccc(cc1)CNCc2cc(ccn2)Cl 270004a_100000174871_100011998288 [0,2,0,0,0,0|2,0,0]=4 14416 B18R2.269 Clc1ccc(cc1)CNCc2cc(ccn2)Cl 34a_100000174871_100016988179 [0,2,0,0,0,0|2,0,0]=4 14417 B18R2.269 Clc1ccc(cc1)CNCc2cccc(c2)Br 207a_100000174871_100000210085 [0,2,0,0,0,0|1,0,0]=3 14418 B18R2.269 Clc1ccc(cc1)CNCc2cccc(c2)Br 207a_100000174977_100000189385 [0,2,0,0,0,0|1,0,0]=3 14419 B18R2.269 Clc1ccc(cc1)CNCc2cccc(c2)Br 2230a_100000174871_100000698116 [0,2,0,0,0,0|1,0,0]=3 14420 B18R2.269 Clc1ccc(cc1)CNCc2cccc(c2)Br 2230a_100000174977_100000694040 [0,2,0,0,0,0|1,0,0]=3 14421 B18R2.269 Clc1ccc(cc1)CNCc2cccc(c2)Br 26a_100000174871_100000210342 [0,2,0,0,0,0|1,0,0]=3 14422 B18R2.269 Clc1ccc(cc1)CNCc2cccc(c2)Br 270004a_100000174871_100000210085 [0,2,0,0,0,0|1,0,0]=3 14423 B18R2.269 Clc1ccc(cc1)CNCc2cccc(c2)Br 270004a_100000174977_100000189385 [0,2,0,0,0,0|1,0,0]=3 14424 B18R2.269 Clc1ccc(cc1)CNCc2cccc(c2)Br 34a_100000174871_100000698116 [0,2,0,0,0,0|1,0,0]=3 14425 B18R2.269 Clc1ccc(cc1)CNCc2cccc(c2)Br 34a_100000174977_100000694040 [0,2,0,0,0,0|1,0,0]=3 14426 B18R2.269 Clc1ccc(cc1)CNCc2cccc(c2)Cl 207a_100000174871_100000210801 [0,2,0,0,0,0|1,0,0]=3 14427 B18R2.269 Clc1ccc(cc1)CNCc2cccc(c2)Cl 207a_100000174878_100000189385 [0,2,0,0,0,0|1,0,0]=3 14428 B18R2.269 Clc1ccc(cc1)CNCc2cccc(c2)Cl 2230a_100000174871_100000181238 [0,2,0,0,0,0|1,0,0]=3 14429 B18R2.269 Clc1ccc(cc1)CNCc2cccc(c2)Cl 2230a_100000174878_100000694040 [0,2,0,0,0,0|1,0,0]=3 14430 B18R2.269 Clc1ccc(cc1)CNCc2cccc(c2)Cl 270004a_100000174871_100000210801 [0,2,0,0,0,0|1,0,0]=3 14431 B18R2.269 Clc1ccc(cc1)CNCc2cccc(c2)Cl 270004a_100000174878_100000189385 [0,2,0,0,0,0|1,0,0]=3 14432 B18R2.269 Clc1ccc(cc1)CNCc2cccc(c2)Cl 34a_100000174871_100000187163 [0,2,0,0,0,0|1,0,0]=3 14433 B18R2.269 Clc1ccc(cc1)CNCc2cccc(c2)Cl 34a_100000174878_100000694040 [0,2,0,0,0,0|1,0,0]=3 14434 B18R2.269 Clc1ccc(cc1)CNCc2cccc(c2)I 207a_100000106179_100000189385 [0,2,0,0,0,0|1,0,0]=3 14435 B18R2.269 Clc1ccc(cc1)CNCc2cccc(c2)I 207a_100000174871_100000014684 [0,2,0,0,0,0|1,0,0]=3 14436 B18R2.269 Clc1ccc(cc1)CNCc2cccc(c2)I 2230a_100000106179_100000694040 [0,2,0,0,0,0|1,0,0]=3 14437 B18R2.269 Clc1ccc(cc1)CNCc2cccc(c2)I 2230a_100000174871_100011218688 [0,2,0,0,0,0|1,0,0]=3 14438 B18R2.269 Clc1ccc(cc1)CNCc2cccc(c2)I 270004a_100000106179_100000189385 [0,2,0,0,0,0|1,0,0]=3 14439 B18R2.269 Clc1ccc(cc1)CNCc2cccc(c2)I 270004a_100000174871_100000014684 [0,2,0,0,0,0|1,0,0]=3 14440 B18R2.269 Clc1ccc(cc1)CNCc2cccc(c2)I 34a_100000106179_100000694040 [0,2,0,0,0,0|1,0,0]=3 14441 B18R2.269 Clc1ccc(cc1)CNCc2cccc(c2)I 34a_100000174871_100011218688 [0,2,0,0,0,0|1,0,0]=3 14442 B18R2.269 Clc1ccc(cc1)CNCc2cccc(n2)Br 2230a_100000174871_100009889011 [0,2,0,0,0,0|2,0,0]=4 14443 B18R2.269 Clc1ccc(cc1)CNCc2cccc(n2)Br 2230a_100016987751_100000694040 [0,2,0,0,0,0|2,0,0]=4 14444 B18R2.269 Clc1ccc(cc1)CNCc2cccc(n2)Br 270004a_100000174871_100000688028 [0,2,0,0,0,0|2,0,0]=4 14445 B18R2.269 Clc1ccc(cc1)CNCc2cccc(n2)Br 34a_100000174871_100009889011 [0,2,0,0,0,0|2,0,0]=4 14446 B18R2.269 Clc1ccc(cc1)CNCc2cccc(n2)Cl 2230a_100000174871_100000086093 [0,2,0,0,0,0|2,0,0]=4 14447 B18R2.269 Clc1ccc(cc1)CNCc2cccc(n2)Cl 2230a_100016990191_100000694040 [0,2,0,0,0,0|2,0,0]=4 14448 B18R2.269 Clc1ccc(cc1)CNCc2cccc(n2)Cl 270004a_100000174871_100011361687 [0,2,0,0,0,0|2,0,0]=4 14449 B18R2.269 Clc1ccc(cc1)CNCc2cccc(n2)Cl 34a_100000174871_100000086093 [0,2,0,0,0,0|2,0,0]=4 14450 B18R2.269 Clc1ccc(cc1)CNCc2ccnc(c2)Br 2230a_100000174871_100010243470 [0,2,0,0,0,0|2,0,0]=4 14451 B18R2.269 Clc1ccc(cc1)CNCc2ccnc(c2)Br 2230a_100025757509_100000694040 [0,2,0,0,0,0|2,0,0]=4 14452 B18R2.269 Clc1ccc(cc1)CNCc2ccnc(c2)Br 270004a_100000174871_100009814634 [0,2,0,0,0,0|2,0,0]=4 14453 B18R2.269 Clc1ccc(cc1)CNCc2ccnc(c2)Br 270004a_100025757509_100000189385 [0,2,0,0,0,0|2,0,0]=4 14454 B18R2.269 Clc1ccc(cc1)CNCc2ccnc(c2)Br 34a_100000174871_100010243470 [0,2,0,0,0,0|2,0,0]=4 14455 B18R2.269 Clc1ccc(cc1)CNCc2ccnc(c2)Br 34a_100025757509_100000694040 [0,2,0,0,0,0|2,0,0]=4 14456 B18R2.269 Clc1ccc(cc1)CNCc2ccnc(c2)Cl 2230a_100000174871_100000764220 [0,2,0,0,0,0|2,0,0]=4 14457 B18R2.269 Clc1ccc(cc1)CNCc2ccnc(c2)Cl 2230a_100015205668_100000694040 [0,2,0,0,0,0|2,0,0]=4 14458 B18R2.269 Clc1ccc(cc1)CNCc2ccnc(c2)Cl 270004a_100000174871_100011290808 [0,2,0,0,0,0|2,0,0]=4 14459 B18R2.269 Clc1ccc(cc1)CNCc2ccnc(c2)Cl 270004a_100015205668_100000189385 [0,2,0,0,0,0|2,0,0]=4 14460 B18R2.269 Clc1ccc(cc1)CNCc2ccnc(c2)Cl 34a_100000174871_100000764220 [0,2,0,0,0,0|2,0,0]=4 14461 B18R2.269 Clc1ccc(cc1)CNCc2ccnc(c2)Cl 34a_100015205668_100000694040 [0,2,0,0,0,0|2,0,0]=4 14462 B18R2.269 Clc1ccc(cc1)CNCc2cncc(c2)Br 207a_100000174871_100000687066 [0,2,0,0,0,0|2,0,0]=4 14463 B18R2.269 Clc1ccc(cc1)CNCc2cncc(c2)Br 207a_100011249555_100000189385 [0,2,0,0,0,0|2,0,0]=4 14464 B18R2.269 Clc1ccc(cc1)CNCc2cncc(c2)Br 2230a_100000174871_100000738771 [0,2,0,0,0,0|2,0,0]=4 14465 B18R2.269 Clc1ccc(cc1)CNCc2cncc(c2)Br 270004a_100000174871_100000687066 [0,2,0,0,0,0|2,0,0]=4 14466 B18R2.269 Clc1ccc(cc1)CNCc2cncc(c2)Br 270004a_100011249555_100000189385 [0,2,0,0,0,0|2,0,0]=4 14467 B18R2.269 Clc1ccc(cc1)CNCc2cncc(c2)Br 34a_100000174871_100000738771 [0,2,0,0,0,0|2,0,0]=4 14468 B18R2.269 Clc1ccc(cc1)CNCc2cncc(c2)Cl 207a_100000174871_100000088910 [0,2,0,0,0,0|2,0,0]=4 14469 B18R2.269 Clc1ccc(cc1)CNCc2cncc(c2)Cl 207a_200020614424_100000189385 [0,2,0,0,0,0|2,0,0]=4 14470 B18R2.269 Clc1ccc(cc1)CNCc2cncc(c2)Cl 2230a_100000174871_100016992070 [0,2,0,0,0,0|2,0,0]=4 14471 B18R2.269 Clc1ccc(cc1)CNCc2cncc(c2)Cl 2230a_200020614424_100000694040 [0,2,0,0,0,0|2,0,0]=4 14472 B18R2.269 Clc1ccc(cc1)CNCc2cncc(c2)Cl 270004a_100000174871_100000088910 [0,2,0,0,0,0|2,0,0]=4 14473 B18R2.269 Clc1ccc(cc1)CNCc2cncc(c2)Cl 270004a_200020614424_100000189385 [0,2,0,0,0,0|2,0,0]=4 14474 B18R2.269 Clc1ccc(cc1)CNCc2cncc(c2)Cl 34a_100000174871_100016992070 [0,2,0,0,0,0|2,0,0]=4 14475 B18R2.269 Clc1ccc(cc1)COCc2cc(ccn2)Br 34a_100000211118_100010173614 [0,2,0,0,0,0|1,0,0]=3 14476 B18R2.269 Clc1ccc(cc1)COCc2cc(ccn2)Br 7a_100000211118_100010173614 [0,2,0,0,0,0|1,0,0]=3 14477 B18R2.269 Clc1ccc(cc1)COCc2cc(ccn2)Cl 34a_100000211118_100016988179 [0,2,0,0,0,0|1,0,0]=3 14478 B18R2.269 Clc1ccc(cc1)COCc2cc(ccn2)Cl 34a_100000748867_100000694040 [0,2,0,0,0,0|1,0,0]=3 14479 B18R2.269 Clc1ccc(cc1)COCc2cc(ccn2)Cl 7a_100000211118_100016988179 [0,2,0,0,0,0|1,0,0]=3 14480 B18R2.269 Clc1ccc(cc1)COCc2cccc(c2)Br 34a_100000211118_100000698116 [0,2,0,0,0,0|0,0,0]=2 14481 B18R2.269 Clc1ccc(cc1)COCc2cccc(c2)Br 34a_100000687537_100000694040 [0,2,0,0,0,0|0,0,0]=2 14482 B18R2.269 Clc1ccc(cc1)COCc2cccc(c2)Br 7a_100000211118_100000211773 [0,2,0,0,0,0|0,0,0]=2 14483 B18R2.269 Clc1ccc(cc1)COCc2cccc(c2)Br 7a_100000687537_100000187161 [0,2,0,0,0,0|0,0,0]=2 14484 B18R2.269 Clc1ccc(cc1)COCc2cccc(c2)Cl 34a_100000211118_100000187163 [0,2,0,0,0,0|0,0,0]=2 14485 B18R2.269 Clc1ccc(cc1)COCc2cccc(c2)Cl 34a_100000241301_100000694040 [0,2,0,0,0,0|0,0,0]=2 14486 B18R2.269 Clc1ccc(cc1)COCc2cccc(c2)Cl 7a_100000211118_100000187163 [0,2,0,0,0,0|0,0,0]=2 14487 B18R2.269 Clc1ccc(cc1)COCc2cccc(c2)Cl 7a_100000241301_100000187161 [0,2,0,0,0,0|0,0,0]=2 14488 B18R2.269 Clc1ccc(cc1)COCc2cccc(c2)I 34a_100000211118_100011218688 [0,2,0,0,0,0|0,0,0]=2 14489 B18R2.269 Clc1ccc(cc1)COCc2cccc(c2)I 34a_100011215336_100000694040 [0,2,0,0,0,0|0,0,0]=2 14490 B18R2.269 Clc1ccc(cc1)COCc2cccc(c2)I 7a_100000211118_100011218688 [0,2,0,0,0,0|0,0,0]=2 14491 B18R2.269 Clc1ccc(cc1)COCc2cccc(c2)I 7a_100011215336_100000187161 [0,2,0,0,0,0|0,0,0]=2 14492 B18R2.269 Clc1ccc(cc1)COCc2cccc(n2)Br 34a_100000211118_100009889011 [0,2,0,0,0,0|1,0,0]=3 14493 B18R2.269 Clc1ccc(cc1)COCc2cccc(n2)Br 34a_100000694195_100000694040 [0,2,0,0,0,0|1,0,0]=3 14494 B18R2.269 Clc1ccc(cc1)COCc2cccc(n2)Br 7a_100000211118_100009889011 [0,2,0,0,0,0|1,0,0]=3 14495 B18R2.269 Clc1ccc(cc1)COCc2cccc(n2)Cl 34a_100000211118_100000086093 [0,2,0,0,0,0|1,0,0]=3 14496 B18R2.269 Clc1ccc(cc1)COCc2cccc(n2)Cl 34a_100011998359_100000694040 [0,2,0,0,0,0|1,0,0]=3 14497 B18R2.269 Clc1ccc(cc1)COCc2cccc(n2)Cl 7a_100000211118_100000086093 [0,2,0,0,0,0|1,0,0]=3 14498 B18R2.269 Clc1ccc(cc1)COCc2ccnc(c2)Br 34a_100000211118_100010243470 [0,2,0,0,0,0|1,0,0]=3 14499 B18R2.269 Clc1ccc(cc1)COCc2ccnc(c2)Br 34a_100009814636_100000694040 [0,2,0,0,0,0|1,0,0]=3 14500 B18R2.269 Clc1ccc(cc1)COCc2ccnc(c2)Br 7a_100000211118_100010254460 [0,2,0,0,0,0|1,0,0]=3 14501 B18R2.269 Clc1ccc(cc1)COCc2ccnc(c2)Br 7a_100009814636_100000187161 [0,2,0,0,0,0|1,0,0]=3 14502 B18R2.269 Clc1ccc(cc1)COCc2ccnc(c2)Cl 34a_100000211118_100000764220 [0,2,0,0,0,0|1,0,0]=3 14503 B18R2.269 Clc1ccc(cc1)COCc2ccnc(c2)Cl 34a_100000748751_100000694040 [0,2,0,0,0,0|1,0,0]=3 14504 B18R2.269 Clc1ccc(cc1)COCc2ccnc(c2)Cl 7a_100000211118_100000764220 [0,2,0,0,0,0|1,0,0]=3 14505 B18R2.269 Clc1ccc(cc1)COCc2ccnc(n2)Cl 34a_100000211118_100000099655 [0,2,0,0,0,0|2,0,0]=4 14506 B18R2.269 Clc1ccc(cc1)COCc2ccnc(n2)Cl 7a_100000211118_100000099655 [0,2,0,0,0,0|2,0,0]=4 14507 B18R2.269 Clc1ccc(cc1)COCc2cncc(c2)Br 34a_100000211118_100000738771 [0,2,0,0,0,0|1,0,0]=3 14508 B18R2.269 Clc1ccc(cc1)COCc2cncc(c2)Br 34a_100011259137_100000694040 [0,2,0,0,0,0|1,0,0]=3 14509 B18R2.269 Clc1ccc(cc1)COCc2cncc(c2)Br 7a_100000211118_100000738771 [0,2,0,0,0,0|1,0,0]=3 14510 B18R2.269 Clc1ccc(cc1)COCc2cncc(c2)Br 7a_100011259137_100000187161 [0,2,0,0,0,0|1,0,0]=3 14511 B18R2.269 Clc1ccc(cc1)COCc2cncc(c2)Cl 34a_100000092867_100000694040 [0,2,0,0,0,0|1,0,0]=3 14512 B18R2.269 Clc1ccc(cc1)COCc2cncc(c2)Cl 34a_100000211118_100016992070 [0,2,0,0,0,0|1,0,0]=3 14513 B18R2.269 Clc1ccc(cc1)COCc2cncc(c2)Cl 7a_100000092867_100000187161 [0,2,0,0,0,0|1,0,0]=3 14514 B18R2.269 Clc1ccc(cc1)COCc2cncc(c2)Cl 7a_100000211118_100016992070 [0,2,0,0,0,0|1,0,0]=3 14515 B18R2.269 Clc1ccc(cc1)CSCc2cc(ccn2)Br 62a_100000187161_100010173614 [0,2,0,0,0,0|1,1,0]=4 14516 B18R2.269 Clc1ccc(cc1)CSCc2cc(ccn2)Br 62a_100010173614_100000187161 [0,2,0,0,0,0|1,1,0]=4 14517 B18R2.269 Clc1ccc(cc1)CSCc2cc(ccn2)Cl 62a_100000187161_100016988179 [0,2,0,0,0,0|1,1,0]=4 14518 B18R2.269 Clc1ccc(cc1)CSCc2cc(ccn2)Cl 62a_100016988179_100000187161 [0,2,0,0,0,0|1,1,0]=4 14519 B18R2.269 Clc1ccc(cc1)CSCc2cccc(c2)Br 62a_100000187161_100000211773 [0,2,0,0,0,0|0,1,0]=3 14520 B18R2.269 Clc1ccc(cc1)CSCc2cccc(c2)Br 62a_100000211773_100000187161 [0,2,0,0,0,0|0,1,0]=3 14521 B18R2.269 Clc1ccc(cc1)CSCc2cccc(c2)Cl 62a_100000187161_100000187163 [0,2,0,0,0,0|0,1,0]=3 14522 B18R2.269 Clc1ccc(cc1)CSCc2cccc(c2)Cl 62a_100000187163_100000187161 [0,2,0,0,0,0|0,1,0]=3 14523 B18R2.269 Clc1ccc(cc1)CSCc2cccc(c2)I 62a_100000187161_100011218688 [0,2,0,0,0,0|0,1,0]=3 14524 B18R2.269 Clc1ccc(cc1)CSCc2cccc(c2)I 62a_100011218688_100000187161 [0,2,0,0,0,0|0,1,0]=3 14525 B18R2.269 Clc1ccc(cc1)CSCc2cccc(n2)Br 62a_100000187161_100009889011 [0,2,0,0,0,0|1,1,0]=4 14526 B18R2.269 Clc1ccc(cc1)CSCc2cccc(n2)Br 62a_100009889011_100000187161 [0,2,0,0,0,0|1,1,0]=4 14527 B18R2.269 Clc1ccc(cc1)CSCc2cccc(n2)Cl 62a_100000086093_100000187161 [0,2,0,0,0,0|1,1,0]=4 14528 B18R2.269 Clc1ccc(cc1)CSCc2cccc(n2)Cl 62a_100000187161_100000086093 [0,2,0,0,0,0|1,1,0]=4 14529 B18R2.269 Clc1ccc(cc1)CSCc2ccnc(c2)Br 62a_100000187161_100010243470 [0,2,0,0,0,0|1,1,0]=4 14530 B18R2.269 Clc1ccc(cc1)CSCc2ccnc(c2)Br 62a_100010254460_100000187161 [0,2,0,0,0,0|1,1,0]=4 14531 B18R2.269 Clc1ccc(cc1)CSCc2ccnc(c2)Cl 62a_100000187161_100000764220 [0,2,0,0,0,0|1,1,0]=4 14532 B18R2.269 Clc1ccc(cc1)CSCc2ccnc(c2)Cl 62a_100000764220_100000187161 [0,2,0,0,0,0|1,1,0]=4 14533 B18R2.269 Clc1ccc(cc1)CSCc2cncc(c2)Br 62a_100000187161_100000738771 [0,2,0,0,0,0|1,1,0]=4 14534 B18R2.269 Clc1ccc(cc1)CSCc2cncc(c2)Br 62a_100000738771_100000187161 [0,2,0,0,0,0|1,1,0]=4 14535 B18R2.269 Clc1ccc(cc1)CSCc2cncc(c2)Cl 62a_100000187161_100016992070 [0,2,0,0,0,0|1,1,0]=4 14536 B18R2.269 Clc1ccc(cc1)CSCc2cncc(c2)Cl 62a_100016992070_100000187161 [0,2,0,0,0,0|1,1,0]=4 14537 B18R2.269 Clc1ccc(cc1)NCCc2cccc(c2)Br 2230a_100000210052_100011740638 [0,2,0,0,0,0|2,0,0]=4 14538 B18R2.269 Clc1ccc(cc1)NCCc2cccc(c2)Br 34a_100000210052_100011740638 [0,2,0,0,0,0|2,0,0]=4 14539 B18R2.269 Clc1ccc(cc1)NCCc2cccc(c2)Cl 2230a_100000210052_100011713710 [0,2,0,0,0,0|2,0,0]=4 14540 B18R2.269 Clc1ccc(cc1)NCCc2cccc(c2)Cl 34a_100000210052_100011713710 [0,2,0,0,0,0|2,0,0]=4 14541 B18R2.269 Clc1ccc(cc1)OCCc2cccc(c2)Br 34a_100000210216_100011740638 [0,2,0,0,0,0|2,0,0]=4 14542 B18R2.269 Clc1ccc(cc1)OCCc2cccc(c2)Br 7a_100000210216_100011740638 [0,2,0,0,0,0|2,0,0]=4 14543 B18R2.269 Clc1ccc(cc1)OCCc2cccc(c2)Cl 34a_100000210216_100011713710 [0,2,0,0,0,0|2,0,0]=4 14544 B18R2.269 Clc1ccc(cc1)OCCc2cccc(c2)Cl 7a_100000210216_100011713710 [0,2,0,0,0,0|2,0,0]=4 14545 B18R2.269 Clc1ccc(cc1)SCCc2cccc(c2)Br 62a_100000755918_100011740638 [0,2,0,0,0,0|2,0,0]=4 14546 B18R2.269 Clc1ccc(cc1)SCCc2cccc(c2)Br 62a_100011740638_100000755918 [0,2,0,0,0,0|2,0,0]=4 14547 B18R2.269 Clc1ccc(cc1)SCCc2cccc(c2)Cl 62a_100000755918_100011713710 [0,2,0,0,0,0|2,0,0]=4 14548 B18R2.269 Clc1ccc(cc1)SCCc2cccc(c2)Cl 62a_100011713710_100000755918 [0,2,0,0,0,0|2,0,0]=4 14549 B18R2.269 Clc1ccc(cn1)CNCc2cccc(c2)Br 207a_100000735879_100000210085 [0,2,0,0,0,0|2,0,0]=4 14550 B18R2.269 Clc1ccc(cn1)CNCc2cccc(c2)Br 2230a_100000174977_100000735431 [0,2,0,0,0,0|2,0,0]=4 14551 B18R2.269 Clc1ccc(cn1)CNCc2cccc(c2)Br 2230a_100000735879_100000698116 [0,2,0,0,0,0|2,0,0]=4 14552 B18R2.269 Clc1ccc(cn1)CNCc2cccc(c2)Br 270004a_100000735879_100000210085 [0,2,0,0,0,0|2,0,0]=4 14553 B18R2.269 Clc1ccc(cn1)CNCc2cccc(c2)Br 34a_100000174977_100000735431 [0,2,0,0,0,0|2,0,0]=4 14554 B18R2.269 Clc1ccc(cn1)CNCc2cccc(c2)Br 34a_100000735879_100000698116 [0,2,0,0,0,0|2,0,0]=4 14555 B18R2.269 Clc1ccc(cn1)CNCc2cccc(c2)I 207a_100000735879_100000014684 [0,2,0,0,0,0|2,0,0]=4 14556 B18R2.269 Clc1ccc(cn1)CNCc2cccc(c2)I 2230a_100000106179_100000735431 [0,2,0,0,0,0|2,0,0]=4 14557 B18R2.269 Clc1ccc(cn1)CNCc2cccc(c2)I 2230a_100000735879_100011218688 [0,2,0,0,0,0|2,0,0]=4 14558 B18R2.269 Clc1ccc(cn1)CNCc2cccc(c2)I 270004a_100000735879_100000014684 [0,2,0,0,0,0|2,0,0]=4 14559 B18R2.269 Clc1ccc(cn1)CNCc2cccc(c2)I 34a_100000106179_100000735431 [0,2,0,0,0,0|2,0,0]=4 14560 B18R2.269 Clc1ccc(cn1)CNCc2cccc(c2)I 34a_100000735879_100011218688 [0,2,0,0,0,0|2,0,0]=4 14561 B18R2.269 Clc1ccc(cn1)COCc2cc(ccn2)Br 34a_100000755211_100010173614 [0,2,0,0,0,0|2,0,0]=4 14562 B18R2.269 Clc1ccc(cn1)COCc2cc(ccn2)Br 7a_100000755211_100010173614 [0,2,0,0,0,0|2,0,0]=4 14563 B18R2.269 Clc1ccc(cn1)COCc2cccc(c2)Br 34a_100000687537_100000735431 [0,2,0,0,0,0|1,0,0]=3 14564 B18R2.269 Clc1ccc(cn1)COCc2cccc(c2)Br 34a_100000755211_100000698116 [0,2,0,0,0,0|1,0,0]=3 14565 B18R2.269 Clc1ccc(cn1)COCc2cccc(c2)Br 7a_100000687537_100000735431 [0,2,0,0,0,0|1,0,0]=3 14566 B18R2.269 Clc1ccc(cn1)COCc2cccc(c2)Br 7a_100000755211_100000211773 [0,2,0,0,0,0|1,0,0]=3 14567 B18R2.269 Clc1ccc(cn1)COCc2cccc(c2)I 34a_100000755211_100011218688 [0,2,0,0,0,0|1,0,0]=3 14568 B18R2.269 Clc1ccc(cn1)COCc2cccc(c2)I 34a_100011215336_100000735431 [0,2,0,0,0,0|1,0,0]=3 14569 B18R2.269 Clc1ccc(cn1)COCc2cccc(c2)I 7a_100000755211_100011218688 [0,2,0,0,0,0|1,0,0]=3 14570 B18R2.269 Clc1ccc(cn1)COCc2cccc(c2)I 7a_100011215336_100000735431 [0,2,0,0,0,0|1,0,0]=3 14571 B18R2.269 Clc1ccc(cn1)COCc2cccc(n2)Br 34a_100000694195_100000735431 [0,2,0,0,0,0|2,0,0]=4 14572 B18R2.269 Clc1ccc(cn1)COCc2cccc(n2)Br 34a_100000755211_100009889011 [0,2,0,0,0,0|2,0,0]=4 14573 B18R2.269 Clc1ccc(cn1)COCc2cccc(n2)Br 7a_100000755211_100009889011 [0,2,0,0,0,0|2,0,0]=4 14574 B18R2.269 Clc1ccc(cn1)COCc2cccc(n2)Cl 34a_100000755211_100000086093 [0,2,0,0,0,0|2,0,0]=4 14575 B18R2.269 Clc1ccc(cn1)COCc2cccc(n2)Cl 34a_100011998359_100000735431 [0,2,0,0,0,0|2,0,0]=4 14576 B18R2.269 Clc1ccc(cn1)COCc2cccc(n2)Cl 7a_100000755211_100000086093 [0,2,0,0,0,0|2,0,0]=4 14577 B18R2.269 Clc1ccc(cn1)COCc2ccnc(c2)Br 34a_100000755211_100010243470 [0,2,0,0,0,0|2,0,0]=4 14578 B18R2.269 Clc1ccc(cn1)COCc2ccnc(c2)Br 34a_100009814636_100000735431 [0,2,0,0,0,0|2,0,0]=4 14579 B18R2.269 Clc1ccc(cn1)COCc2ccnc(c2)Br 7a_100000755211_100010254460 [0,2,0,0,0,0|2,0,0]=4 14580 B18R2.269 Clc1ccc(cn1)COCc2ccnc(c2)Br 7a_100009814636_100000735431 [0,2,0,0,0,0|2,0,0]=4 14581 B18R2.269 Clc1ccc(cn1)COCc2ccnc(c2)Cl 34a_100000748751_100000735431 [0,2,0,0,0,0|2,0,0]=4 14582 B18R2.269 Clc1ccc(cn1)COCc2ccnc(c2)Cl 34a_100000755211_100000764220 [0,2,0,0,0,0|2,0,0]=4 14583 B18R2.269 Clc1ccc(cn1)COCc2ccnc(c2)Cl 7a_100000755211_100000764220 [0,2,0,0,0,0|2,0,0]=4 14584 B18R2.269 Clc1ccc(cn1)COCc2cncc(c2)Br 34a_100000755211_100000738771 [0,2,0,0,0,0|2,0,0]=4 14585 B18R2.269 Clc1ccc(cn1)COCc2cncc(c2)Br 34a_100011259137_100000735431 [0,2,0,0,0,0|2,0,0]=4 14586 B18R2.269 Clc1ccc(cn1)COCc2cncc(c2)Br 7a_100000755211_100000738771 [0,2,0,0,0,0|2,0,0]=4 14587 B18R2.269 Clc1ccc(cn1)COCc2cncc(c2)Br 7a_100011259137_100000735431 [0,2,0,0,0,0|2,0,0]=4 14588 B18R2.269 Clc1ccc(cn1)CSCc2cccc(c2)Br 62a_100000211773_100000735431 [0,2,0,0,0,0|1,1,0]=4 14589 B18R2.269 Clc1ccc(cn1)CSCc2cccc(c2)Br 62a_100000735431_100000211773 [0,2,0,0,0,0|1,1,0]=4 14590 B18R2.269 Clc1ccc(cn1)CSCc2cccc(c2)I 62a_100000735431_100011218688 [0,2,0,0,0,0|1,1,0]=4 14591 B18R2.269 Clc1ccc(cn1)CSCc2cccc(c2)I 62a_100011218688_100000735431 [0,2,0,0,0,0|1,1,0]=4 14592 B18R2.269 Clc1ccc(nc1)CNCc2cccc(c2)Br 207a_100000174977_100011361569 [0,2,0,0,0,0|2,0,0]=4 14593 B18R2.269 Clc1ccc(nc1)CNCc2cccc(c2)Br 2230a_100000174977_100012066911 [0,2,0,0,0,0|2,0,0]=4 14594 B18R2.269 Clc1ccc(nc1)CNCc2cccc(c2)Br 270004a_100000174977_100011361569 [0,2,0,0,0,0|2,0,0]=4 14595 B18R2.269 Clc1ccc(nc1)CNCc2cccc(c2)Br 270004a_100000697193_100000210085 [0,2,0,0,0,0|2,0,0]=4 14596 B18R2.269 Clc1ccc(nc1)CNCc2cccc(c2)Br 34a_100000174977_100012066911 [0,2,0,0,0,0|2,0,0]=4 14597 B18R2.269 Clc1ccc(nc1)CNCc2cccc(c2)Br 34a_100000697193_100000698116 [0,2,0,0,0,0|2,0,0]=4 14598 B18R2.269 Clc1ccc(nc1)CNCc2cccc(c2)Cl 207a_100000174878_100011361569 [0,2,0,0,0,0|2,0,0]=4 14599 B18R2.269 Clc1ccc(nc1)CNCc2cccc(c2)Cl 2230a_100000174878_100012066911 [0,2,0,0,0,0|2,0,0]=4 14600 B18R2.269 Clc1ccc(nc1)CNCc2cccc(c2)Cl 270004a_100000174878_100011361569 [0,2,0,0,0,0|2,0,0]=4 14601 B18R2.269 Clc1ccc(nc1)CNCc2cccc(c2)Cl 270004a_100000697193_100000210801 [0,2,0,0,0,0|2,0,0]=4 14602 B18R2.269 Clc1ccc(nc1)CNCc2cccc(c2)Cl 34a_100000174878_100012066911 [0,2,0,0,0,0|2,0,0]=4 14603 B18R2.269 Clc1ccc(nc1)CNCc2cccc(c2)Cl 34a_100000697193_100000187163 [0,2,0,0,0,0|2,0,0]=4 14604 B18R2.269 Clc1ccc(nc1)CNCc2cccc(c2)I 207a_100000106179_100011361569 [0,2,0,0,0,0|2,0,0]=4 14605 B18R2.269 Clc1ccc(nc1)CNCc2cccc(c2)I 2230a_100000106179_100012066911 [0,2,0,0,0,0|2,0,0]=4 14606 B18R2.269 Clc1ccc(nc1)CNCc2cccc(c2)I 270004a_100000106179_100011361569 [0,2,0,0,0,0|2,0,0]=4 14607 B18R2.269 Clc1ccc(nc1)CNCc2cccc(c2)I 270004a_100000697193_100000014684 [0,2,0,0,0,0|2,0,0]=4 14608 B18R2.269 Clc1ccc(nc1)CNCc2cccc(c2)I 34a_100000106179_100012066911 [0,2,0,0,0,0|2,0,0]=4 14609 B18R2.269 Clc1ccc(nc1)CNCc2cccc(c2)I 34a_100000697193_100011218688 [0,2,0,0,0,0|2,0,0]=4 14610 B18R2.269 Clc1ccc(nc1)COCc2cc(ccn2)Br 34a_100000703999_100010173614 [0,2,0,0,0,0|2,0,0]=4 14611 B18R2.269 Clc1ccc(nc1)COCc2cc(ccn2)Cl 34a_100000703999_100016988179 [0,2,0,0,0,0|2,0,0]=4 14612 B18R2.269 Clc1ccc(nc1)COCc2cc(ccn2)Cl 34a_100000748867_100012066911 [0,2,0,0,0,0|2,0,0]=4 14613 B18R2.269 Clc1ccc(nc1)COCc2cccc(c2)Br 34a_100000687537_100012066911 [0,2,0,0,0,0|1,0,0]=3 14614 B18R2.269 Clc1ccc(nc1)COCc2cccc(c2)Br 34a_100000703999_100000698116 [0,2,0,0,0,0|1,0,0]=3 14615 B18R2.269 Clc1ccc(nc1)COCc2cccc(c2)Br 7a_100000687537_100012066911 [0,2,0,0,0,0|1,0,0]=3 14616 B18R2.269 Clc1ccc(nc1)COCc2cccc(c2)Cl 34a_100000241301_100012066911 [0,2,0,0,0,0|1,0,0]=3 14617 B18R2.269 Clc1ccc(nc1)COCc2cccc(c2)Cl 34a_100000703999_100000187163 [0,2,0,0,0,0|1,0,0]=3 14618 B18R2.269 Clc1ccc(nc1)COCc2cccc(c2)Cl 7a_100000241301_100012066911 [0,2,0,0,0,0|1,0,0]=3 14619 B18R2.269 Clc1ccc(nc1)COCc2cccc(c2)I 34a_100000703999_100011218688 [0,2,0,0,0,0|1,0,0]=3 14620 B18R2.269 Clc1ccc(nc1)COCc2cccc(c2)I 34a_100011215336_100012066911 [0,2,0,0,0,0|1,0,0]=3 14621 B18R2.269 Clc1ccc(nc1)COCc2cccc(c2)I 7a_100011215336_100012066911 [0,2,0,0,0,0|1,0,0]=3 14622 B18R2.269 Clc1ccc(nc1)COCc2cccc(n2)Br 34a_100000694195_100012066911 [0,2,0,0,0,0|2,0,0]=4 14623 B18R2.269 Clc1ccc(nc1)COCc2cccc(n2)Br 34a_100000703999_100009889011 [0,2,0,0,0,0|2,0,0]=4 14624 B18R2.269 Clc1ccc(nc1)COCc2cccc(n2)Cl 34a_100000703999_100000086093 [0,2,0,0,0,0|2,0,0]=4 14625 B18R2.269 Clc1ccc(nc1)COCc2cccc(n2)Cl 34a_100011998359_100012066911 [0,2,0,0,0,0|2,0,0]=4 14626 B18R2.269 Clc1ccc(nc1)COCc2ccnc(c2)Br 34a_100000703999_100010243470 [0,2,0,0,0,0|2,0,0]=4 14627 B18R2.269 Clc1ccc(nc1)COCc2ccnc(c2)Br 34a_100009814636_100012066911 [0,2,0,0,0,0|2,0,0]=4 14628 B18R2.269 Clc1ccc(nc1)COCc2ccnc(c2)Br 7a_100009814636_100012066911 [0,2,0,0,0,0|2,0,0]=4 14629 B18R2.269 Clc1ccc(nc1)COCc2ccnc(c2)Cl 34a_100000703999_100000764220 [0,2,0,0,0,0|2,0,0]=4 14630 B18R2.269 Clc1ccc(nc1)COCc2ccnc(c2)Cl 34a_100000748751_100012066911 [0,2,0,0,0,0|2,0,0]=4 14631 B18R2.269 Clc1ccc(nc1)COCc2cncc(c2)Br 34a_100000703999_100000738771 [0,2,0,0,0,0|2,0,0]=4 14632 B18R2.269 Clc1ccc(nc1)COCc2cncc(c2)Br 34a_100011259137_100012066911 [0,2,0,0,0,0|2,0,0]=4 14633 B18R2.269 Clc1ccc(nc1)COCc2cncc(c2)Br 7a_100011259137_100012066911 [0,2,0,0,0,0|2,0,0]=4 14634 B18R2.269 Clc1ccc(nc1)COCc2cncc(c2)Cl 34a_100000092867_100012066911 [0,2,0,0,0,0|2,0,0]=4 14635 B18R2.269 Clc1ccc(nc1)COCc2cncc(c2)Cl 34a_100000703999_100016992070 [0,2,0,0,0,0|2,0,0]=4 14636 B18R2.269 Clc1ccc(nc1)COCc2cncc(c2)Cl 7a_100000092867_100012066911 [0,2,0,0,0,0|2,0,0]=4 14637 B18R2.269 Clc1ccc(nc1)CSCc2cccc(c2)Br 62a_100000211773_100000697101 [0,2,0,0,0,0|1,1,0]=4 14638 B18R2.269 Clc1ccc(nc1)CSCc2cccc(c2)Br 62a_100012066911_100000211773 [0,2,0,0,0,0|1,1,0]=4 14639 B18R2.269 Clc1ccc(nc1)CSCc2cccc(c2)Cl 62a_100000187163_100000697101 [0,2,0,0,0,0|1,1,0]=4 14640 B18R2.269 Clc1ccc(nc1)CSCc2cccc(c2)Cl 62a_100012066911_100000187163 [0,2,0,0,0,0|1,1,0]=4 14641 B18R2.269 Clc1ccc(nc1)CSCc2cccc(c2)I 62a_100011218688_100000697101 [0,2,0,0,0,0|1,1,0]=4 14642 B18R2.269 Clc1ccc(nc1)CSCc2cccc(c2)I 62a_100012066911_100011218688 [0,2,0,0,0,0|1,1,0]=4 14643 B18R2.269 Clc1ccc(nn1)COCc2cccc(c2)Br 34a_100000687537_100016992710 [0,2,0,0,0,0|2,0,0]=4 14644 B18R2.269 Clc1ccc(nn1)COCc2cccc(c2)Br 7a_100000687537_100016992710 [0,2,0,0,0,0|2,0,0]=4 14645 B18R2.269 Clc1ccc(nn1)COCc2cccc(c2)I 34a_100011215336_100016992710 [0,2,0,0,0,0|2,0,0]=4 14646 B18R2.269 Clc1ccc(nn1)COCc2cccc(c2)I 7a_100011215336_100016992710 [0,2,0,0,0,0|2,0,0]=4 14647 B18R2.269 Clc1cccc(c1)CCNc2ccc(cc2)Br 2230a_100000210018_100011713710 [0,2,0,0,0,0|2,0,0]=4 14648 B18R2.269 Clc1cccc(c1)CCNc2ccc(cc2)Br 34a_100000210018_100011713710 [0,2,0,0,0,0|2,0,0]=4 14649 B18R2.269 Clc1cccc(c1)CCNc2ccc(cc2)I 34a_100000185761_100011713710 [0,2,0,0,0,0|2,0,0]=4 14650 B18R2.269 Clc1cccc(c1)CCOc2ccc(cc2)Br 34a_100000185759_100011713710 [0,2,0,0,0,0|2,0,0]=4 14651 B18R2.269 Clc1cccc(c1)CCOc2ccc(cc2)Br 7a_100000185759_100011713710 [0,2,0,0,0,0|2,0,0]=4 14652 B18R2.269 Clc1cccc(c1)CCOc2ccc(cc2)I 34a_100000212066_100011713710 [0,2,0,0,0,0|2,0,0]=4 14653 B18R2.269 Clc1cccc(c1)CCOc2ccc(cc2)I 7a_100000212066_100011713710 [0,2,0,0,0,0|2,0,0]=4 14654 B18R2.269 Clc1cccc(c1)CCSc2ccc(cc2)Br 62a_100000752885_100011713710 [0,2,0,0,0,0|2,0,0]=4 14655 B18R2.269 Clc1cccc(c1)CCSc2ccc(cc2)Br 62a_100011713710_100000752885 [0,2,0,0,0,0|2,0,0]=4 14656 B18R2.269 Clc1cccc(c1)CNCc2ccc(cc2)Br 207a_100000174875_100000210801 [0,2,0,0,0,0|1,0,0]=3 14657 B18R2.269 Clc1cccc(c1)CNCc2ccc(cc2)Br 207a_100000174878_100000186029 [0,2,0,0,0,0|1,0,0]=3 14658 B18R2.269 Clc1cccc(c1)CNCc2ccc(cc2)Br 2230a_100000174875_100000181238 [0,2,0,0,0,0|1,0,0]=3 14659 B18R2.269 Clc1cccc(c1)CNCc2ccc(cc2)Br 2230a_100000174878_100011217064 [0,2,0,0,0,0|1,0,0]=3 14660 B18R2.269 Clc1cccc(c1)CNCc2ccc(cc2)Br 26a_100000174878_100000185759 [0,2,0,0,0,0|1,0,0]=3 14661 B18R2.269 Clc1cccc(c1)CNCc2ccc(cc2)Br 270004a_100000174875_100000210801 [0,2,0,0,0,0|1,0,0]=3 14662 B18R2.269 Clc1cccc(c1)CNCc2ccc(cc2)Br 270004a_100000174878_100000186029 [0,2,0,0,0,0|1,0,0]=3 14663 B18R2.269 Clc1cccc(c1)CNCc2ccc(cc2)Br 34a_100000174875_100000187163 [0,2,0,0,0,0|1,0,0]=3 14664 B18R2.269 Clc1cccc(c1)CNCc2ccc(cc2)Br 34a_100000174878_100000189115 [0,2,0,0,0,0|1,0,0]=3 14665 B18R2.269 Clc1cccc(c1)CNCc2ccc(cc2)I 207a_100000174878_100000188517 [0,2,0,0,0,0|1,0,0]=3 14666 B18R2.269 Clc1cccc(c1)CNCc2ccc(cc2)I 207a_100016989417_100000210801 [0,2,0,0,0,0|1,0,0]=3 14667 B18R2.269 Clc1cccc(c1)CNCc2ccc(cc2)I 2230a_100000174878_100000189116 [0,2,0,0,0,0|1,0,0]=3 14668 B18R2.269 Clc1cccc(c1)CNCc2ccc(cc2)I 2230a_100016989417_100000181238 [0,2,0,0,0,0|1,0,0]=3 14669 B18R2.269 Clc1cccc(c1)CNCc2ccc(cc2)I 270004a_100016989417_100000210801 [0,2,0,0,0,0|1,0,0]=3 14670 B18R2.269 Clc1cccc(c1)CNCc2ccc(cc2)I 34a_100000174878_100000189116 [0,2,0,0,0,0|1,0,0]=3 14671 B18R2.269 Clc1cccc(c1)CNCc2ccc(cc2)I 34a_100016989417_100000187163 [0,2,0,0,0,0|1,0,0]=3 14672 B18R2.269 Clc1cccc(c1)CNCc2ccc(cn2)Br 207a_100000174878_100000754260 [0,2,0,0,0,0|2,0,0]=4 14673 B18R2.269 Clc1cccc(c1)CNCc2ccc(cn2)Br 2230a_100000174878_100000702658 [0,2,0,0,0,0|2,0,0]=4 14674 B18R2.269 Clc1cccc(c1)CNCc2ccc(cn2)Br 270004a_100000174878_100000754260 [0,2,0,0,0,0|2,0,0]=4 14675 B18R2.269 Clc1cccc(c1)CNCc2ccc(cn2)Br 34a_100000174878_100000702658 [0,2,0,0,0,0|2,0,0]=4 14676 B18R2.269 Clc1cccc(c1)CNCc2ccc(cn2)Br 34a_100015188789_100000187163 [0,2,0,0,0,0|2,0,0]=4 14677 B18R2.269 Clc1cccc(c1)CNCc2ccc(nc2)Br 207a_100009817727_100000210801 [0,2,0,0,0,0|2,0,0]=4 14678 B18R2.269 Clc1cccc(c1)CNCc2ccc(nc2)Br 2230a_100000174878_100009831999 [0,2,0,0,0,0|2,0,0]=4 14679 B18R2.269 Clc1cccc(c1)CNCc2ccc(nc2)Br 2230a_100009817727_100000181238 [0,2,0,0,0,0|2,0,0]=4 14680 B18R2.269 Clc1cccc(c1)CNCc2ccc(nc2)Br 270004a_100009817727_100000210801 [0,2,0,0,0,0|2,0,0]=4 14681 B18R2.269 Clc1cccc(c1)CNCc2ccc(nc2)Br 34a_100000174878_100009831999 [0,2,0,0,0,0|2,0,0]=4 14682 B18R2.269 Clc1cccc(c1)CNCc2ccc(nc2)Br 34a_100009817727_100000187163 [0,2,0,0,0,0|2,0,0]=4 14683 B18R2.269 Clc1cccc(c1)CNCc2ccc(nc2)Cl 207a_100000735879_100000210801 [0,2,0,0,0,0|2,0,0]=4 14684 B18R2.269 Clc1cccc(c1)CNCc2ccc(nc2)Cl 2230a_100000174878_100000735431 [0,2,0,0,0,0|2,0,0]=4 14685 B18R2.269 Clc1cccc(c1)CNCc2ccc(nc2)Cl 2230a_100000735879_100000181238 [0,2,0,0,0,0|2,0,0]=4 14686 B18R2.269 Clc1cccc(c1)CNCc2ccc(nc2)Cl 270004a_100000735879_100000210801 [0,2,0,0,0,0|2,0,0]=4 14687 B18R2.269 Clc1cccc(c1)CNCc2ccc(nc2)Cl 34a_100000174878_100000735431 [0,2,0,0,0,0|2,0,0]=4 14688 B18R2.269 Clc1cccc(c1)CNCc2ccc(nc2)Cl 34a_100000735879_100000187163 [0,2,0,0,0,0|2,0,0]=4 14689 B18R2.269 Clc1cccc(c1)COCc2ccc(cc2)Br 34a_100000241301_100000189115 [0,2,0,0,0,0|0,0,0]=2 14690 B18R2.269 Clc1cccc(c1)COCc2ccc(cc2)Br 34a_100000695286_100000187163 [0,2,0,0,0,0|0,0,0]=2 14691 B18R2.269 Clc1cccc(c1)COCc2ccc(cc2)Br 7a_100000241301_100011217064 [0,2,0,0,0,0|0,0,0]=2 14692 B18R2.269 Clc1cccc(c1)COCc2ccc(cc2)I 34a_100000241301_100000189116 [0,2,0,0,0,0|0,0,0]=2 14693 B18R2.269 Clc1cccc(c1)COCc2ccc(cc2)I 34a_100000690907_100000187163 [0,2,0,0,0,0|0,0,0]=2 14694 B18R2.269 Clc1cccc(c1)COCc2ccc(cc2)I 7a_100000241301_100000189116 [0,2,0,0,0,0|0,0,0]=2 14695 B18R2.269 Clc1cccc(c1)COCc2ccc(cc2)I 7a_100000690907_100000187163 [0,2,0,0,0,0|0,0,0]=2 14696 B18R2.269 Clc1cccc(c1)COCc2ccc(cn2)Br 34a_100000241301_100000702658 [0,2,0,0,0,0|1,0,0]=3 14697 B18R2.269 Clc1cccc(c1)COCc2ccc(cn2)Br 34a_100000754261_100000187163 [0,2,0,0,0,0|1,0,0]=3 14698 B18R2.269 Clc1cccc(c1)COCc2ccc(cn2)Br 7a_100000241301_100000702658 [0,2,0,0,0,0|1,0,0]=3 14699 B18R2.269 Clc1cccc(c1)COCc2ccc(nc2)Br 34a_100000241301_100009831999 [0,2,0,0,0,0|1,0,0]=3 14700 B18R2.269 Clc1cccc(c1)COCc2ccc(nc2)Br 34a_100009816760_100000187163 [0,2,0,0,0,0|1,0,0]=3 14701 B18R2.269 Clc1cccc(c1)COCc2ccc(nc2)Br 7a_100000241301_100009831999 [0,2,0,0,0,0|1,0,0]=3 14702 B18R2.269 Clc1cccc(c1)COCc2ccc(nc2)Br 7a_100009816760_100000187163 [0,2,0,0,0,0|1,0,0]=3 14703 B18R2.269 Clc1cccc(c1)COCc2ccc(nc2)Cl 34a_100000241301_100000735431 [0,2,0,0,0,0|1,0,0]=3 14704 B18R2.269 Clc1cccc(c1)COCc2ccc(nc2)Cl 34a_100000755211_100000187163 [0,2,0,0,0,0|1,0,0]=3 14705 B18R2.269 Clc1cccc(c1)COCc2ccc(nc2)Cl 7a_100000241301_100000735431 [0,2,0,0,0,0|1,0,0]=3 14706 B18R2.269 Clc1cccc(c1)COCc2ccc(nc2)Cl 7a_100000755211_100000187163 [0,2,0,0,0,0|1,0,0]=3 14707 B18R2.269 Clc1cccc(c1)COCc2ccc(nn2)Cl 34a_100000241301_100016992710 [0,2,0,0,0,0|2,0,0]=4 14708 B18R2.269 Clc1cccc(c1)COCc2ccc(nn2)Cl 7a_100000241301_100016992710 [0,2,0,0,0,0|2,0,0]=4 14709 B18R2.269 Clc1cccc(c1)COCc2cnc(cn2)Cl 34a_100012002382_100000187163 [0,2,0,0,0,0|2,0,0]=4 14710 B18R2.269 Clc1cccc(c1)COCc2cnc(nc2)Cl 34a_100009855073_100000187163 [0,2,0,0,0,0|2,0,0]=4 14711 B18R2.269 Clc1cccc(c1)COCc2cnc(nc2)Cl 7a_100009855073_100000187163 [0,2,0,0,0,0|2,0,0]=4 14712 B18R2.269 Clc1cccc(c1)COCc2ncc(cn2)Br 34a_100000241301_100010064664 [0,2,0,0,0,0|2,0,0]=4 14713 B18R2.269 Clc1cccc(c1)COCc2ncc(cn2)Br 7a_100000241301_100010064664 [0,2,0,0,0,0|2,0,0]=4 14714 B18R2.269 Clc1cccc(c1)CSCc2ccc(cc2)Br 62a_100000187163_100000189115 [0,2,0,0,0,0|0,1,0]=3 14715 B18R2.269 Clc1cccc(c1)CSCc2ccc(cc2)Br 62a_100000189115_100000187163 [0,2,0,0,0,0|0,1,0]=3 14716 B18R2.269 Clc1cccc(c1)CSCc2ccc(cc2)I 62a_100000187163_100000189116 [0,2,0,0,0,0|0,1,0]=3 14717 B18R2.269 Clc1cccc(c1)CSCc2ccc(cc2)I 62a_100000189116_100000187163 [0,2,0,0,0,0|0,1,0]=3 14718 B18R2.269 Clc1cccc(c1)CSCc2ccc(cn2)Br 62a_100000187163_100000702658 [0,2,0,0,0,0|1,1,0]=4 14719 B18R2.269 Clc1cccc(c1)CSCc2ccc(cn2)Br 62a_100000702658_100000187163 [0,2,0,0,0,0|1,1,0]=4 14720 B18R2.269 Clc1cccc(c1)CSCc2ccc(nc2)Br 62a_100000187163_100009831999 [0,2,0,0,0,0|1,1,0]=4 14721 B18R2.269 Clc1cccc(c1)CSCc2ccc(nc2)Br 62a_100009831999_100000187163 [0,2,0,0,0,0|1,1,0]=4 14722 B18R2.269 Clc1cccc(c1)CSCc2ccc(nc2)Cl 62a_100000187163_100000735431 [0,2,0,0,0,0|1,1,0]=4 14723 B18R2.269 Clc1cccc(c1)CSCc2ccc(nc2)Cl 62a_100000735431_100000187163 [0,2,0,0,0,0|1,1,0]=4 14724 B18R2.269 Clc1cccc(c1)NCCc2ccc(cc2)Br 34a_100000185859_100011740612 [0,2,0,0,0,0|2,0,0]=4 14725 B18R2.269 Clc1cccc(c1)OCCc2ccc(cc2)Br 34a_100000210295_100011740612 [0,2,0,0,0,0|2,0,0]=4 14726 B18R2.269 Clc1cccc(c1)OCCc2ccc(cc2)Br 7a_100000210295_100011740612 [0,2,0,0,0,0|2,0,0]=4 14727 B18R2.269 Clc1cccc(c1)SCCc2ccc(cc2)Br 62a_100000699651_100011740612 [0,2,0,0,0,0|2,0,0]=4 14728 B18R2.269 Clc1cccc(c1)SCCc2ccc(cc2)Br 62a_100011740612_100000699651 [0,2,0,0,0,0|2,0,0]=4 14729 B18R2.269 Clc1cccc(n1)CNCc2ccc(cc2)Br 2230a_100000174875_100000086093 [0,2,0,0,0,0|2,0,0]=4 14730 B18R2.269 Clc1cccc(n1)CNCc2ccc(cc2)Br 2230a_100016990191_100011217064 [0,2,0,0,0,0|2,0,0]=4 14731 B18R2.269 Clc1cccc(n1)CNCc2ccc(cc2)Br 270004a_100000174875_100011361687 [0,2,0,0,0,0|2,0,0]=4 14732 B18R2.269 Clc1cccc(n1)CNCc2ccc(cc2)Br 34a_100000174875_100000086093 [0,2,0,0,0,0|2,0,0]=4 14733 B18R2.269 Clc1cccc(n1)CNCc2ccc(cc2)I 2230a_100016989417_100000086093 [0,2,0,0,0,0|2,0,0]=4 14734 B18R2.269 Clc1cccc(n1)CNCc2ccc(cc2)I 2230a_100016990191_100000189116 [0,2,0,0,0,0|2,0,0]=4 14735 B18R2.269 Clc1cccc(n1)CNCc2ccc(cc2)I 270004a_100016989417_100011361687 [0,2,0,0,0,0|2,0,0]=4 14736 B18R2.269 Clc1cccc(n1)CNCc2ccc(cc2)I 34a_100016989417_100000086093 [0,2,0,0,0,0|2,0,0]=4 14737 B18R2.269 Clc1cccc(n1)COCc2ccc(cc2)Br 34a_100000695286_100000086093 [0,2,0,0,0,0|1,0,0]=3 14738 B18R2.269 Clc1cccc(n1)COCc2ccc(cc2)Br 34a_100011998359_100000189115 [0,2,0,0,0,0|1,0,0]=3 14739 B18R2.269 Clc1cccc(n1)COCc2ccc(cc2)I 34a_100000690907_100000086093 [0,2,0,0,0,0|1,0,0]=3 14740 B18R2.269 Clc1cccc(n1)COCc2ccc(cc2)I 34a_100011998359_100000189116 [0,2,0,0,0,0|1,0,0]=3 14741 B18R2.269 Clc1cccc(n1)COCc2ccc(cc2)I 7a_100000690907_100000086093 [0,2,0,0,0,0|1,0,0]=3 14742 B18R2.269 Clc1cccc(n1)COCc2ccc(cn2)Br 34a_100000754261_100000086093 [0,2,0,0,0,0|2,0,0]=4 14743 B18R2.269 Clc1cccc(n1)COCc2ccc(cn2)Br 34a_100011998359_100000702658 [0,2,0,0,0,0|2,0,0]=4 14744 B18R2.269 Clc1cccc(n1)COCc2ccc(nc2)Br 34a_100009816760_100000086093 [0,2,0,0,0,0|2,0,0]=4 14745 B18R2.269 Clc1cccc(n1)COCc2ccc(nc2)Br 34a_100011998359_100009831999 [0,2,0,0,0,0|2,0,0]=4 14746 B18R2.269 Clc1cccc(n1)COCc2ccc(nc2)Br 7a_100009816760_100000086093 [0,2,0,0,0,0|2,0,0]=4 14747 B18R2.269 Clc1cccc(n1)CSCc2ccc(cc2)Br 62a_100000086093_100000189115 [0,2,0,0,0,0|1,1,0]=4 14748 B18R2.269 Clc1cccc(n1)CSCc2ccc(cc2)Br 62a_100000189115_100000086093 [0,2,0,0,0,0|1,1,0]=4 14749 B18R2.269 Clc1cccc(n1)CSCc2ccc(cc2)I 62a_100000086093_100000189116 [0,2,0,0,0,0|1,1,0]=4 14750 B18R2.269 Clc1cccc(n1)CSCc2ccc(cc2)I 62a_100000189116_100000086093 [0,2,0,0,0,0|1,1,0]=4 14751 B18R2.269 Clc1ccnc(c1)CNCc2ccc(cc2)Br 2230a_100000174875_100016988179 [0,2,0,0,0,0|2,0,0]=4 14752 B18R2.269 Clc1ccnc(c1)CNCc2ccc(cc2)Br 270004a_100000174875_100011998288 [0,2,0,0,0,0|2,0,0]=4 14753 B18R2.269 Clc1ccnc(c1)CNCc2ccc(cc2)Br 34a_100000174875_100016988179 [0,2,0,0,0,0|2,0,0]=4 14754 B18R2.269 Clc1ccnc(c1)CNCc2ccc(cc2)I 2230a_100016989417_100016988179 [0,2,0,0,0,0|2,0,0]=4 14755 B18R2.269 Clc1ccnc(c1)CNCc2ccc(cc2)I 270004a_100016989417_100011998288 [0,2,0,0,0,0|2,0,0]=4 14756 B18R2.269 Clc1ccnc(c1)CNCc2ccc(cc2)I 34a_100016989417_100016988179 [0,2,0,0,0,0|2,0,0]=4 14757 B18R2.269 Clc1ccnc(c1)COCc2ccc(cc2)Br 34a_100000695286_100016988179 [0,2,0,0,0,0|1,0,0]=3 14758 B18R2.269 Clc1ccnc(c1)COCc2ccc(cc2)Br 34a_100000748867_100000189115 [0,2,0,0,0,0|1,0,0]=3 14759 B18R2.269 Clc1ccnc(c1)COCc2ccc(cc2)I 34a_100000690907_100016988179 [0,2,0,0,0,0|1,0,0]=3 14760 B18R2.269 Clc1ccnc(c1)COCc2ccc(cc2)I 34a_100000748867_100000189116 [0,2,0,0,0,0|1,0,0]=3 14761 B18R2.269 Clc1ccnc(c1)COCc2ccc(cc2)I 7a_100000690907_100016988179 [0,2,0,0,0,0|1,0,0]=3 14762 B18R2.269 Clc1ccnc(c1)COCc2ccc(cn2)Br 34a_100000748867_100000702658 [0,2,0,0,0,0|2,0,0]=4 14763 B18R2.269 Clc1ccnc(c1)COCc2ccc(cn2)Br 34a_100000754261_100016988179 [0,2,0,0,0,0|2,0,0]=4 14764 B18R2.269 Clc1ccnc(c1)COCc2ccc(nc2)Br 34a_100000748867_100009831999 [0,2,0,0,0,0|2,0,0]=4 14765 B18R2.269 Clc1ccnc(c1)COCc2ccc(nc2)Br 34a_100009816760_100016988179 [0,2,0,0,0,0|2,0,0]=4 14766 B18R2.269 Clc1ccnc(c1)COCc2ccc(nc2)Br 7a_100009816760_100016988179 [0,2,0,0,0,0|2,0,0]=4 14767 B18R2.269 Clc1ccnc(c1)COCc2ccc(nc2)Cl 34a_100000748867_100000735431 [0,2,0,0,0,0|2,0,0]=4 14768 B18R2.269 Clc1ccnc(c1)COCc2ccc(nc2)Cl 34a_100000755211_100016988179 [0,2,0,0,0,0|2,0,0]=4 14769 B18R2.269 Clc1ccnc(c1)COCc2ccc(nc2)Cl 7a_100000755211_100016988179 [0,2,0,0,0,0|2,0,0]=4 14770 B18R2.269 Clc1ccnc(c1)CSCc2ccc(cc2)Br 62a_100000189115_100016988179 [0,2,0,0,0,0|1,1,0]=4 14771 B18R2.269 Clc1ccnc(c1)CSCc2ccc(cc2)Br 62a_100016988179_100000189115 [0,2,0,0,0,0|1,1,0]=4 14772 B18R2.269 Clc1ccnc(c1)CSCc2ccc(cc2)I 62a_100000189116_100016988179 [0,2,0,0,0,0|1,1,0]=4 14773 B18R2.269 Clc1ccnc(c1)CSCc2ccc(cc2)I 62a_100016988179_100000189116 [0,2,0,0,0,0|1,1,0]=4 14774 B18R2.269 Clc1cnc(cn1)COCc2cccc(c2)Br 34a_100012002382_100000698116 [0,2,0,0,0,0|2,0,0]=4 14775 B18R2.269 Clc1cnc(cn1)COCc2cccc(c2)I 34a_100012002382_100011218688 [0,2,0,0,0,0|2,0,0]=4 14776 B18R2.269 Clc1cncc(c1)CNCc2ccc(cc2)Br 207a_100000174875_100000088910 [0,2,0,0,0,0|2,0,0]=4 14777 B18R2.269 Clc1cncc(c1)CNCc2ccc(cc2)Br 207a_200020614424_100000186029 [0,2,0,0,0,0|2,0,0]=4 14778 B18R2.269 Clc1cncc(c1)CNCc2ccc(cc2)Br 2230a_100000174875_100016992070 [0,2,0,0,0,0|2,0,0]=4 14779 B18R2.269 Clc1cncc(c1)CNCc2ccc(cc2)Br 2230a_200020614424_100011217064 [0,2,0,0,0,0|2,0,0]=4 14780 B18R2.269 Clc1cncc(c1)CNCc2ccc(cc2)Br 270004a_100000174875_100000088910 [0,2,0,0,0,0|2,0,0]=4 14781 B18R2.269 Clc1cncc(c1)CNCc2ccc(cc2)Br 270004a_200020614424_100000186029 [0,2,0,0,0,0|2,0,0]=4 14782 B18R2.269 Clc1cncc(c1)CNCc2ccc(cc2)Br 34a_100000174875_100016992070 [0,2,0,0,0,0|2,0,0]=4 14783 B18R2.269 Clc1cncc(c1)CNCc2ccc(cc2)I 207a_100016989417_100000088910 [0,2,0,0,0,0|2,0,0]=4 14784 B18R2.269 Clc1cncc(c1)CNCc2ccc(cc2)I 207a_200020614424_100000188517 [0,2,0,0,0,0|2,0,0]=4 14785 B18R2.269 Clc1cncc(c1)CNCc2ccc(cc2)I 2230a_100016989417_100016992070 [0,2,0,0,0,0|2,0,0]=4 14786 B18R2.269 Clc1cncc(c1)CNCc2ccc(cc2)I 2230a_200020614424_100000189116 [0,2,0,0,0,0|2,0,0]=4 14787 B18R2.269 Clc1cncc(c1)CNCc2ccc(cc2)I 270004a_100016989417_100000088910 [0,2,0,0,0,0|2,0,0]=4 14788 B18R2.269 Clc1cncc(c1)CNCc2ccc(cc2)I 34a_100016989417_100016992070 [0,2,0,0,0,0|2,0,0]=4 14789 B18R2.269 Clc1cncc(c1)COCc2ccc(cc2)Br 34a_100000092867_100000189115 [0,2,0,0,0,0|1,0,0]=3 14790 B18R2.269 Clc1cncc(c1)COCc2ccc(cc2)Br 34a_100000695286_100016992070 [0,2,0,0,0,0|1,0,0]=3 14791 B18R2.269 Clc1cncc(c1)COCc2ccc(cc2)Br 7a_100000092867_100011217064 [0,2,0,0,0,0|1,0,0]=3 14792 B18R2.269 Clc1cncc(c1)COCc2ccc(cc2)I 34a_100000092867_100000189116 [0,2,0,0,0,0|1,0,0]=3 14793 B18R2.269 Clc1cncc(c1)COCc2ccc(cc2)I 34a_100000690907_100016992070 [0,2,0,0,0,0|1,0,0]=3 14794 B18R2.269 Clc1cncc(c1)COCc2ccc(cc2)I 7a_100000092867_100000189116 [0,2,0,0,0,0|1,0,0]=3 14795 B18R2.269 Clc1cncc(c1)COCc2ccc(cc2)I 7a_100000690907_100016992070 [0,2,0,0,0,0|1,0,0]=3 14796 B18R2.269 Clc1cncc(c1)COCc2ccc(cn2)Br 34a_100000092867_100000702658 [0,2,0,0,0,0|2,0,0]=4 14797 B18R2.269 Clc1cncc(c1)COCc2ccc(cn2)Br 34a_100000754261_100016992070 [0,2,0,0,0,0|2,0,0]=4 14798 B18R2.269 Clc1cncc(c1)COCc2ccc(cn2)Br 7a_100000092867_100000702658 [0,2,0,0,0,0|2,0,0]=4 14799 B18R2.269 Clc1cncc(c1)COCc2ccc(nc2)Br 34a_100000092867_100009831999 [0,2,0,0,0,0|2,0,0]=4 14800 B18R2.269 Clc1cncc(c1)COCc2ccc(nc2)Br 34a_100009816760_100016992070 [0,2,0,0,0,0|2,0,0]=4 14801 B18R2.269 Clc1cncc(c1)COCc2ccc(nc2)Br 7a_100000092867_100009831999 [0,2,0,0,0,0|2,0,0]=4 14802 B18R2.269 Clc1cncc(c1)COCc2ccc(nc2)Br 7a_100009816760_100016992070 [0,2,0,0,0,0|2,0,0]=4 14803 B18R2.269 Clc1cncc(c1)COCc2ccc(nc2)Cl 34a_100000092867_100000735431 [0,2,0,0,0,0|2,0,0]=4 14804 B18R2.269 Clc1cncc(c1)COCc2ccc(nc2)Cl 34a_100000755211_100016992070 [0,2,0,0,0,0|2,0,0]=4 14805 B18R2.269 Clc1cncc(c1)COCc2ccc(nc2)Cl 7a_100000092867_100000735431 [0,2,0,0,0,0|2,0,0]=4 14806 B18R2.269 Clc1cncc(c1)COCc2ccc(nc2)Cl 7a_100000755211_100016992070 [0,2,0,0,0,0|2,0,0]=4 14807 B18R2.269 Clc1cncc(c1)CSCc2ccc(cc2)Br 62a_100000189115_100016992070 [0,2,0,0,0,0|1,1,0]=4 14808 B18R2.269 Clc1cncc(c1)CSCc2ccc(cc2)Br 62a_100016992070_100000189115 [0,2,0,0,0,0|1,1,0]=4 14809 B18R2.269 Clc1cncc(c1)CSCc2ccc(cc2)I 62a_100000189116_100016992070 [0,2,0,0,0,0|1,1,0]=4 14810 B18R2.269 Clc1cncc(c1)CSCc2ccc(cc2)I 62a_100016992070_100000189116 [0,2,0,0,0,0|1,1,0]=4 14811 B18R2.269 Clc1ncc(cn1)COCc2cccc(c2)Br 34a_100009855073_100000698116 [0,2,0,0,0,0|2,0,0]=4 14812 B18R2.269 Clc1ncc(cn1)COCc2cccc(c2)Br 7a_100009855073_100000211773 [0,2,0,0,0,0|2,0,0]=4 14813 B18R2.269 Clc1ncc(cn1)COCc2cccc(c2)I 34a_100009855073_100011218688 [0,2,0,0,0,0|2,0,0]=4 14814 B18R2.269 Clc1ncc(cn1)COCc2cccc(c2)I 7a_100009855073_100011218688 [0,2,0,0,0,0|2,0,0]=4 14815 B18R2.269 Clc1nccc(n1)COCc2ccc(cc2)Br 34a_100000695286_100000099655 [0,2,0,0,0,0|2,0,0]=4 14816 B18R2.269 Clc1nccc(n1)COCc2ccc(cc2)I 34a_100000690907_100000099655 [0,2,0,0,0,0|2,0,0]=4 14817 B18R2.269 Clc1nccc(n1)COCc2ccc(cc2)I 7a_100000690907_100000099655 [0,2,0,0,0,0|2,0,0]=4 14818 B18R2.269 Fc1cc(ccn1)CNCc2ccc(cc2)Br 2230a_100015188774_100011217064 [0,2,0,0,0,0|2,0,0]=4 14819 B18R2.269 Fc1cc(ccn1)CNCc2ccc(cc2)Br 270004a_100000174875_100000068331 [0,2,0,0,0,0|2,0,0]=4 14820 B18R2.269 Fc1cc(ccn1)CNCc2ccc(cc2)Br 270004a_100015188774_100000186029 [0,2,0,0,0,0|2,0,0]=4 14821 B18R2.269 Fc1cc(ccn1)CNCc2ccc(cc2)Br 34a_100015188774_100000189115 [0,2,0,0,0,0|2,0,0]=4 14822 B18R2.269 Fc1cc(ccn1)CNCc2ccc(cc2)Cl 2230a_100015188774_100000694040 [0,2,0,0,0,0|2,0,0]=4 14823 B18R2.269 Fc1cc(ccn1)CNCc2ccc(cc2)Cl 270004a_100000174871_100000068331 [0,2,0,0,0,0|2,0,0]=4 14824 B18R2.269 Fc1cc(ccn1)CNCc2ccc(cc2)Cl 270004a_100015188774_100000189385 [0,2,0,0,0,0|2,0,0]=4 14825 B18R2.269 Fc1cc(ccn1)CNCc2ccc(cc2)Cl 34a_100015188774_100000694040 [0,2,0,0,0,0|2,0,0]=4 14826 B18R2.269 Fc1cc(ccn1)CNCc2ccc(cc2)I 2230a_100015188774_100000189116 [0,2,0,0,0,0|2,0,0]=4 14827 B18R2.269 Fc1cc(ccn1)CNCc2ccc(cc2)I 270004a_100016989417_100000068331 [0,2,0,0,0,0|2,0,0]=4 14828 B18R2.269 Fc1cc(ccn1)CNCc2ccc(cc2)I 34a_100015188774_100000189116 [0,2,0,0,0,0|2,0,0]=4 14829 B18R2.269 Fc1cc(ccn1)COCc2ccc(cc2)Br 34a_100000082451_100000189115 [0,2,0,0,0,0|1,0,0]=3 14830 B18R2.269 Fc1cc(ccn1)COCc2ccc(cc2)Cl 34a_100000082451_100000694040 [0,2,0,0,0,0|1,0,0]=3 14831 B18R2.269 Fc1cc(ccn1)COCc2ccc(cc2)I 34a_100000082451_100000189116 [0,2,0,0,0,0|1,0,0]=3 14832 B18R2.269 Fc1cc(ccn1)COCc2ccc(cn2)Br 34a_100000082451_100000702658 [0,2,0,0,0,0|2,0,0]=4 14833 B18R2.269 Fc1cc(ccn1)COCc2ccc(cn2)Cl 34a_100000082451_100012066911 [0,2,0,0,0,0|2,0,0]=4 14834 B18R2.269 Fc1cc(ccn1)COCc2ccc(nc2)Br 34a_100000082451_100009831999 [0,2,0,0,0,0|2,0,0]=4 14835 B18R2.269 Fc1cc(ccn1)COCc2ccc(nc2)Cl 34a_100000082451_100000735431 [0,2,0,0,0,0|2,0,0]=4 14836 B18R2.269 Fc1ccc(cc1)CCNc2cccc(c2)Br 34a_100000210019_100011217392 [0,2,0,0,0,0|2,0,0]=4 14837 B18R2.269 Fc1ccc(cc1)CCNc2cccc(c2)Cl 34a_100000185859_100011217392 [0,2,0,0,0,0|2,0,0]=4 14838 B18R2.269 Fc1ccc(cc1)CCNc2cccc(c2)F 34a_100000210047_100011217392 [0,2,0,0,0,0|2,0,0]=4 14839 B18R2.269 Fc1ccc(cc1)CCNc2cccc(c2)I 34a_100000211102_100011217392 [0,2,0,0,0,0|2,0,0]=4 14840 B18R2.269 Fc1ccc(cc1)CCOc2cccc(c2)Br 34a_100000210342_100011217392 [0,2,0,0,0,0|2,0,0]=4 14841 B18R2.269 Fc1ccc(cc1)CCOc2cccc(c2)Br 7a_100000210342_100011217392 [0,2,0,0,0,0|2,0,0]=4 14842 B18R2.269 Fc1ccc(cc1)CCOc2cccc(c2)Cl 34a_100000210295_100011217392 [0,2,0,0,0,0|2,0,0]=4 14843 B18R2.269 Fc1ccc(cc1)CCOc2cccc(c2)Cl 7a_100000210295_100011217392 [0,2,0,0,0,0|2,0,0]=4 14844 B18R2.269 Fc1ccc(cc1)CCOc2cccc(c2)F 34a_100000210426_100011217392 [0,2,0,0,0,0|2,0,0]=4 14845 B18R2.269 Fc1ccc(cc1)CCOc2cccc(c2)F 7a_100000210426_100011217392 [0,2,0,0,0,0|2,0,0]=4 14846 B18R2.269 Fc1ccc(cc1)CCOc2cccc(c2)I 34a_100000211634_100011217392 [0,2,0,0,0,0|2,0,0]=4 14847 B18R2.269 Fc1ccc(cc1)CCOc2cccc(c2)I 7a_100000211634_100011217392 [0,2,0,0,0,0|2,0,0]=4 14848 B18R2.269 Fc1ccc(cc1)CCSc2cccc(c2)Br 62a_100000691529_100011217392 [0,2,0,0,0,0|2,0,0]=4 14849 B18R2.269 Fc1ccc(cc1)CCSc2cccc(c2)Br 62a_100011217392_100000691529 [0,2,0,0,0,0|2,0,0]=4 14850 B18R2.269 Fc1ccc(cc1)CCSc2cccc(c2)Cl 62a_100000699651_100011217392 [0,2,0,0,0,0|2,0,0]=4 14851 B18R2.269 Fc1ccc(cc1)CCSc2cccc(c2)Cl 62a_100011217392_100000699651 [0,2,0,0,0,0|2,0,0]=4 14852 B18R2.269 Fc1ccc(cc1)CCSc2cccc(c2)F 62a_100000685547_100011217392 [0,2,0,0,0,0|2,0,0]=4 14853 B18R2.269 Fc1ccc(cc1)CCSc2cccc(c2)F 62a_100011217392_100000685547 [0,2,0,0,0,0|2,0,0]=4 14854 B18R2.269 Fc1ccc(cc1)CCSc2cccc(c2)[S] 62a_100011217392_114929384022 [0,2,0,0,0,0|2,0,0]=4 14855 B18R2.269 Fc1ccc(cc1)CCSc2cccc(c2)[S] 62a_114929384022_100011217392 [0,2,0,0,0,0|2,0,0]=4 14856 B18R2.269 Fc1ccc(cc1)CNCc2cc(ccn2)Br 2230a_100000174882_100010173614 [0,2,0,0,0,0|2,0,0]=4 14857 B18R2.269 Fc1ccc(cc1)CNCc2cc(ccn2)Br 270004a_100000174882_100009818557 [0,2,0,0,0,0|2,0,0]=4 14858 B18R2.269 Fc1ccc(cc1)CNCc2cc(ccn2)Br 34a_100000174882_100010173614 [0,2,0,0,0,0|2,0,0]=4 14859 B18R2.269 Fc1ccc(cc1)CNCc2cc(ccn2)Cl 2230a_100000174882_100016988179 [0,2,0,0,0,0|2,0,0]=4 14860 B18R2.269 Fc1ccc(cc1)CNCc2cc(ccn2)Cl 270004a_100000174882_100011998288 [0,2,0,0,0,0|2,0,0]=4 14861 B18R2.269 Fc1ccc(cc1)CNCc2cc(ccn2)Cl 34a_100000174882_100016988179 [0,2,0,0,0,0|2,0,0]=4 14862 B18R2.269 Fc1ccc(cc1)CNCc2cccc(c2)Br 207a_100000174882_100000210085 [0,2,0,0,0,0|1,0,0]=3 14863 B18R2.269 Fc1ccc(cc1)CNCc2cccc(c2)Br 207a_100000174977_100000210084 [0,2,0,0,0,0|1,0,0]=3 14864 B18R2.269 Fc1ccc(cc1)CNCc2cccc(c2)Br 2230a_100000174882_100000698116 [0,2,0,0,0,0|1,0,0]=3 14865 B18R2.269 Fc1ccc(cc1)CNCc2cccc(c2)Br 2230a_100000174977_100000198546 [0,2,0,0,0,0|1,0,0]=3 14866 B18R2.269 Fc1ccc(cc1)CNCc2cccc(c2)Br 270004a_100000174882_100000210085 [0,2,0,0,0,0|1,0,0]=3 14867 B18R2.269 Fc1ccc(cc1)CNCc2cccc(c2)Br 270004a_100000174977_100000210084 [0,2,0,0,0,0|1,0,0]=3 14868 B18R2.269 Fc1ccc(cc1)CNCc2cccc(c2)Br 34a_100000174882_100000698116 [0,2,0,0,0,0|1,0,0]=3 14869 B18R2.269 Fc1ccc(cc1)CNCc2cccc(c2)Br 34a_100000174977_100000198546 [0,2,0,0,0,0|1,0,0]=3 14870 B18R2.269 Fc1ccc(cc1)CNCc2cccc(c2)Cl 207a_100000174878_100000210084 [0,2,0,0,0,0|1,0,0]=3 14871 B18R2.269 Fc1ccc(cc1)CNCc2cccc(c2)Cl 207a_100000174882_100000210801 [0,2,0,0,0,0|1,0,0]=3 14872 B18R2.269 Fc1ccc(cc1)CNCc2cccc(c2)Cl 2230a_100000174878_100000198546 [0,2,0,0,0,0|1,0,0]=3 14873 B18R2.269 Fc1ccc(cc1)CNCc2cccc(c2)Cl 2230a_100000174882_100000181238 [0,2,0,0,0,0|1,0,0]=3 14874 B18R2.269 Fc1ccc(cc1)CNCc2cccc(c2)Cl 270004a_100000174878_100000210084 [0,2,0,0,0,0|1,0,0]=3 14875 B18R2.269 Fc1ccc(cc1)CNCc2cccc(c2)Cl 270004a_100000174882_100000210801 [0,2,0,0,0,0|1,0,0]=3 14876 B18R2.269 Fc1ccc(cc1)CNCc2cccc(c2)Cl 34a_100000174878_100000198546 [0,2,0,0,0,0|1,0,0]=3 14877 B18R2.269 Fc1ccc(cc1)CNCc2cccc(c2)Cl 34a_100000174882_100000187163 [0,2,0,0,0,0|1,0,0]=3 14878 B18R2.269 Fc1ccc(cc1)CNCc2cccc(c2)F 207a_100000174882_100000210812 [0,2,0,0,0,0|1,0,0]=3 14879 B18R2.269 Fc1ccc(cc1)CNCc2cccc(c2)F 207a_100000174948_100000210084 [0,2,0,0,0,0|1,0,0]=3 14880 B18R2.269 Fc1ccc(cc1)CNCc2cccc(c2)F 2230a_100000174882_100000230114 [0,2,0,0,0,0|1,0,0]=3 14881 B18R2.269 Fc1ccc(cc1)CNCc2cccc(c2)F 2230a_100000174948_100000198546 [0,2,0,0,0,0|1,0,0]=3 14882 B18R2.269 Fc1ccc(cc1)CNCc2cccc(c2)F 270004a_100000174882_100000210812 [0,2,0,0,0,0|1,0,0]=3 14883 B18R2.269 Fc1ccc(cc1)CNCc2cccc(c2)F 270004a_100000174948_100000210084 [0,2,0,0,0,0|1,0,0]=3 14884 B18R2.269 Fc1ccc(cc1)CNCc2cccc(c2)F 34a_100000174882_100000187166 [0,2,0,0,0,0|1,0,0]=3 14885 B18R2.269 Fc1ccc(cc1)CNCc2cccc(c2)F 34a_100000174948_100000198546 [0,2,0,0,0,0|1,0,0]=3 14886 B18R2.269 Fc1ccc(cc1)CNCc2cccc(c2)I 207a_100000106179_100000210084 [0,2,0,0,0,0|1,0,0]=3 14887 B18R2.269 Fc1ccc(cc1)CNCc2cccc(c2)I 207a_100000174882_100000014684 [0,2,0,0,0,0|1,0,0]=3 14888 B18R2.269 Fc1ccc(cc1)CNCc2cccc(c2)I 2230a_100000106179_100000198546 [0,2,0,0,0,0|1,0,0]=3 14889 B18R2.269 Fc1ccc(cc1)CNCc2cccc(c2)I 2230a_100000174882_100011218688 [0,2,0,0,0,0|1,0,0]=3 14890 B18R2.269 Fc1ccc(cc1)CNCc2cccc(c2)I 270004a_100000106179_100000210084 [0,2,0,0,0,0|1,0,0]=3 14891 B18R2.269 Fc1ccc(cc1)CNCc2cccc(c2)I 270004a_100000174882_100000014684 [0,2,0,0,0,0|1,0,0]=3 14892 B18R2.269 Fc1ccc(cc1)CNCc2cccc(c2)I 34a_100000106179_100000198546 [0,2,0,0,0,0|1,0,0]=3 14893 B18R2.269 Fc1ccc(cc1)CNCc2cccc(c2)I 34a_100000174882_100011218688 [0,2,0,0,0,0|1,0,0]=3 14894 B18R2.269 Fc1ccc(cc1)CNCc2cccc(n2)Br 2230a_100000174882_100009889011 [0,2,0,0,0,0|2,0,0]=4 14895 B18R2.269 Fc1ccc(cc1)CNCc2cccc(n2)Br 2230a_100016987751_100000198546 [0,2,0,0,0,0|2,0,0]=4 14896 B18R2.269 Fc1ccc(cc1)CNCc2cccc(n2)Br 270004a_100000174882_100000688028 [0,2,0,0,0,0|2,0,0]=4 14897 B18R2.269 Fc1ccc(cc1)CNCc2cccc(n2)Br 34a_100000174882_100009889011 [0,2,0,0,0,0|2,0,0]=4 14898 B18R2.269 Fc1ccc(cc1)CNCc2cccc(n2)Cl 2230a_100000174882_100000086093 [0,2,0,0,0,0|2,0,0]=4 14899 B18R2.269 Fc1ccc(cc1)CNCc2cccc(n2)Cl 2230a_100016990191_100000198546 [0,2,0,0,0,0|2,0,0]=4 14900 B18R2.269 Fc1ccc(cc1)CNCc2cccc(n2)Cl 270004a_100000174882_100011361687 [0,2,0,0,0,0|2,0,0]=4 14901 B18R2.269 Fc1ccc(cc1)CNCc2cccc(n2)Cl 34a_100000174882_100000086093 [0,2,0,0,0,0|2,0,0]=4 14902 B18R2.269 Fc1ccc(cc1)CNCc2cccc(n2)F 2230a_100000174882_100009819644 [0,2,0,0,0,0|2,0,0]=4 14903 B18R2.269 Fc1ccc(cc1)CNCc2cccc(n2)F 2230a_100015188798_100000198546 [0,2,0,0,0,0|2,0,0]=4 14904 B18R2.269 Fc1ccc(cc1)CNCc2cccc(n2)F 270004a_100000174882_100000050434 [0,2,0,0,0,0|2,0,0]=4 14905 B18R2.269 Fc1ccc(cc1)CNCc2cccc(n2)F 34a_100000174882_100009819644 [0,2,0,0,0,0|2,0,0]=4 14906 B18R2.269 Fc1ccc(cc1)CNCc2cccc(n2)F 34a_100015188798_100000198546 [0,2,0,0,0,0|2,0,0]=4 14907 B18R2.269 Fc1ccc(cc1)CNCc2ccnc(c2)Br 2230a_100000174882_100010243470 [0,2,0,0,0,0|2,0,0]=4 14908 B18R2.269 Fc1ccc(cc1)CNCc2ccnc(c2)Br 2230a_100025757509_100000198546 [0,2,0,0,0,0|2,0,0]=4 14909 B18R2.269 Fc1ccc(cc1)CNCc2ccnc(c2)Br 270004a_100000174882_100009814634 [0,2,0,0,0,0|2,0,0]=4 14910 B18R2.269 Fc1ccc(cc1)CNCc2ccnc(c2)Br 270004a_100025757509_100000210084 [0,2,0,0,0,0|2,0,0]=4 14911 B18R2.269 Fc1ccc(cc1)CNCc2ccnc(c2)Br 34a_100000174882_100010243470 [0,2,0,0,0,0|2,0,0]=4 14912 B18R2.269 Fc1ccc(cc1)CNCc2ccnc(c2)Br 34a_100025757509_100000198546 [0,2,0,0,0,0|2,0,0]=4 14913 B18R2.269 Fc1ccc(cc1)CNCc2ccnc(c2)Cl 2230a_100000174882_100000764220 [0,2,0,0,0,0|2,0,0]=4 14914 B18R2.269 Fc1ccc(cc1)CNCc2ccnc(c2)Cl 2230a_100015205668_100000198546 [0,2,0,0,0,0|2,0,0]=4 14915 B18R2.269 Fc1ccc(cc1)CNCc2ccnc(c2)Cl 270004a_100000174882_100011290808 [0,2,0,0,0,0|2,0,0]=4 14916 B18R2.269 Fc1ccc(cc1)CNCc2ccnc(c2)Cl 270004a_100015205668_100000210084 [0,2,0,0,0,0|2,0,0]=4 14917 B18R2.269 Fc1ccc(cc1)CNCc2ccnc(c2)Cl 34a_100000174882_100000764220 [0,2,0,0,0,0|2,0,0]=4 14918 B18R2.269 Fc1ccc(cc1)CNCc2ccnc(c2)Cl 34a_100015205668_100000198546 [0,2,0,0,0,0|2,0,0]=4 14919 B18R2.269 Fc1ccc(cc1)CNCc2ccnc(c2)F 2230a_100015188774_100000198546 [0,2,0,0,0,0|2,0,0]=4 14920 B18R2.269 Fc1ccc(cc1)CNCc2ccnc(c2)F 270004a_100000174882_100000068331 [0,2,0,0,0,0|2,0,0]=4 14921 B18R2.269 Fc1ccc(cc1)CNCc2ccnc(c2)F 270004a_100015188774_100000210084 [0,2,0,0,0,0|2,0,0]=4 14922 B18R2.269 Fc1ccc(cc1)CNCc2ccnc(c2)F 34a_100015188774_100000198546 [0,2,0,0,0,0|2,0,0]=4 14923 B18R2.269 Fc1ccc(cc1)CNCc2cncc(c2)Br 207a_100000174882_100000687066 [0,2,0,0,0,0|2,0,0]=4 14924 B18R2.269 Fc1ccc(cc1)CNCc2cncc(c2)Br 207a_100011249555_100000210084 [0,2,0,0,0,0|2,0,0]=4 14925 B18R2.269 Fc1ccc(cc1)CNCc2cncc(c2)Br 2230a_100000174882_100000738771 [0,2,0,0,0,0|2,0,0]=4 14926 B18R2.269 Fc1ccc(cc1)CNCc2cncc(c2)Br 270004a_100000174882_100000687066 [0,2,0,0,0,0|2,0,0]=4 14927 B18R2.269 Fc1ccc(cc1)CNCc2cncc(c2)Br 270004a_100011249555_100000210084 [0,2,0,0,0,0|2,0,0]=4 14928 B18R2.269 Fc1ccc(cc1)CNCc2cncc(c2)Br 34a_100000174882_100000738771 [0,2,0,0,0,0|2,0,0]=4 14929 B18R2.269 Fc1ccc(cc1)CNCc2cncc(c2)Cl 207a_100000174882_100000088910 [0,2,0,0,0,0|2,0,0]=4 14930 B18R2.269 Fc1ccc(cc1)CNCc2cncc(c2)Cl 207a_200020614424_100000210084 [0,2,0,0,0,0|2,0,0]=4 14931 B18R2.269 Fc1ccc(cc1)CNCc2cncc(c2)Cl 2230a_100000174882_100016992070 [0,2,0,0,0,0|2,0,0]=4 14932 B18R2.269 Fc1ccc(cc1)CNCc2cncc(c2)Cl 2230a_200020614424_100000198546 [0,2,0,0,0,0|2,0,0]=4 14933 B18R2.269 Fc1ccc(cc1)CNCc2cncc(c2)Cl 270004a_100000174882_100000088910 [0,2,0,0,0,0|2,0,0]=4 14934 B18R2.269 Fc1ccc(cc1)CNCc2cncc(c2)Cl 270004a_200020614424_100000210084 [0,2,0,0,0,0|2,0,0]=4 14935 B18R2.269 Fc1ccc(cc1)CNCc2cncc(c2)Cl 34a_100000174882_100016992070 [0,2,0,0,0,0|2,0,0]=4 14936 B18R2.269 Fc1ccc(cc1)CNCc2cncc(c2)F 207a_100000174882_100011361476 [0,2,0,0,0,0|2,0,0]=4 14937 B18R2.269 Fc1ccc(cc1)CNCc2cncc(c2)F 207a_100011962886_100000210084 [0,2,0,0,0,0|2,0,0]=4 14938 B18R2.269 Fc1ccc(cc1)CNCc2cncc(c2)F 2230a_100000174882_100000725299 [0,2,0,0,0,0|2,0,0]=4 14939 B18R2.269 Fc1ccc(cc1)CNCc2cncc(c2)F 2230a_100011962886_100000198546 [0,2,0,0,0,0|2,0,0]=4 14940 B18R2.269 Fc1ccc(cc1)CNCc2cncc(c2)F 270004a_100000174882_100011361476 [0,2,0,0,0,0|2,0,0]=4 14941 B18R2.269 Fc1ccc(cc1)CNCc2cncc(c2)F 270004a_100011962886_100000210084 [0,2,0,0,0,0|2,0,0]=4 14942 B18R2.269 Fc1ccc(cc1)CNCc2cncc(c2)F 34a_100000174882_100000725299 [0,2,0,0,0,0|2,0,0]=4 14943 B18R2.269 Fc1ccc(cc1)CNCc2cncc(c2)F 34a_100011962886_100000198546 [0,2,0,0,0,0|2,0,0]=4 14944 B18R2.269 Fc1ccc(cc1)COCc2cc(ccn2)Br 34a_100000210977_100010173614 [0,2,0,0,0,0|1,0,0]=3 14945 B18R2.269 Fc1ccc(cc1)COCc2cc(ccn2)Br 7a_100000210977_100010173614 [0,2,0,0,0,0|1,0,0]=3 14946 B18R2.269 Fc1ccc(cc1)COCc2cc(ccn2)Cl 34a_100000210977_100016988179 [0,2,0,0,0,0|1,0,0]=3 14947 B18R2.269 Fc1ccc(cc1)COCc2cc(ccn2)Cl 34a_100000748867_100000198546 [0,2,0,0,0,0|1,0,0]=3 14948 B18R2.269 Fc1ccc(cc1)COCc2cc(ccn2)Cl 7a_100000210977_100016988179 [0,2,0,0,0,0|1,0,0]=3 14949 B18R2.269 Fc1ccc(cc1)COCc2cccc(c2)Br 34a_100000210977_100000698116 [0,2,0,0,0,0|0,0,0]=2 14950 B18R2.269 Fc1ccc(cc1)COCc2cccc(c2)Br 34a_100000687537_100000198546 [0,2,0,0,0,0|0,0,0]=2 14951 B18R2.269 Fc1ccc(cc1)COCc2cccc(c2)Br 7a_100000210977_100000211773 [0,2,0,0,0,0|0,0,0]=2 14952 B18R2.269 Fc1ccc(cc1)COCc2cccc(c2)Br 7a_100000687537_100000198546 [0,2,0,0,0,0|0,0,0]=2 14953 B18R2.269 Fc1ccc(cc1)COCc2cccc(c2)Cl 34a_100000210977_100000187163 [0,2,0,0,0,0|0,0,0]=2 14954 B18R2.269 Fc1ccc(cc1)COCc2cccc(c2)Cl 34a_100000241301_100000198546 [0,2,0,0,0,0|0,0,0]=2 14955 B18R2.269 Fc1ccc(cc1)COCc2cccc(c2)Cl 7a_100000210977_100000187163 [0,2,0,0,0,0|0,0,0]=2 14956 B18R2.269 Fc1ccc(cc1)COCc2cccc(c2)Cl 7a_100000241301_100000198546 [0,2,0,0,0,0|0,0,0]=2 14957 B18R2.269 Fc1ccc(cc1)COCc2cccc(c2)F 34a_100000210976_100000198546 [0,2,0,0,0,0|0,0,0]=2 14958 B18R2.269 Fc1ccc(cc1)COCc2cccc(c2)F 34a_100000210977_100000187166 [0,2,0,0,0,0|0,0,0]=2 14959 B18R2.269 Fc1ccc(cc1)COCc2cccc(c2)F 7a_100000210976_100000198546 [0,2,0,0,0,0|0,0,0]=2 14960 B18R2.269 Fc1ccc(cc1)COCc2cccc(c2)F 7a_100000210977_100000230114 [0,2,0,0,0,0|0,0,0]=2 14961 B18R2.269 Fc1ccc(cc1)COCc2cccc(c2)I 34a_100000210977_100011218688 [0,2,0,0,0,0|0,0,0]=2 14962 B18R2.269 Fc1ccc(cc1)COCc2cccc(c2)I 34a_100011215336_100000198546 [0,2,0,0,0,0|0,0,0]=2 14963 B18R2.269 Fc1ccc(cc1)COCc2cccc(c2)I 7a_100000210977_100011218688 [0,2,0,0,0,0|0,0,0]=2 14964 B18R2.269 Fc1ccc(cc1)COCc2cccc(c2)I 7a_100011215336_100000198546 [0,2,0,0,0,0|0,0,0]=2 14965 B18R2.269 Fc1ccc(cc1)COCc2cccc(n2)Br 34a_100000210977_100009889011 [0,2,0,0,0,0|1,0,0]=3 14966 B18R2.269 Fc1ccc(cc1)COCc2cccc(n2)Br 34a_100000694195_100000198546 [0,2,0,0,0,0|1,0,0]=3 14967 B18R2.269 Fc1ccc(cc1)COCc2cccc(n2)Br 7a_100000210977_100009889011 [0,2,0,0,0,0|1,0,0]=3 14968 B18R2.269 Fc1ccc(cc1)COCc2cccc(n2)Cl 34a_100000210977_100000086093 [0,2,0,0,0,0|1,0,0]=3 14969 B18R2.269 Fc1ccc(cc1)COCc2cccc(n2)Cl 34a_100011998359_100000198546 [0,2,0,0,0,0|1,0,0]=3 14970 B18R2.269 Fc1ccc(cc1)COCc2cccc(n2)Cl 7a_100000210977_100000086093 [0,2,0,0,0,0|1,0,0]=3 14971 B18R2.269 Fc1ccc(cc1)COCc2cccc(n2)F 34a_100000086748_100000198546 [0,2,0,0,0,0|1,0,0]=3 14972 B18R2.269 Fc1ccc(cc1)COCc2cccc(n2)F 34a_100000210977_100009819644 [0,2,0,0,0,0|1,0,0]=3 14973 B18R2.269 Fc1ccc(cc1)COCc2cccc(n2)F 7a_100000210977_100009819644 [0,2,0,0,0,0|1,0,0]=3 14974 B18R2.269 Fc1ccc(cc1)COCc2ccnc(c2)Br 34a_100000210977_100010243470 [0,2,0,0,0,0|1,0,0]=3 14975 B18R2.269 Fc1ccc(cc1)COCc2ccnc(c2)Br 34a_100009814636_100000198546 [0,2,0,0,0,0|1,0,0]=3 14976 B18R2.269 Fc1ccc(cc1)COCc2ccnc(c2)Br 7a_100000210977_100010254460 [0,2,0,0,0,0|1,0,0]=3 14977 B18R2.269 Fc1ccc(cc1)COCc2ccnc(c2)Br 7a_100009814636_100000198546 [0,2,0,0,0,0|1,0,0]=3 14978 B18R2.269 Fc1ccc(cc1)COCc2ccnc(c2)Cl 34a_100000210977_100000764220 [0,2,0,0,0,0|1,0,0]=3 14979 B18R2.269 Fc1ccc(cc1)COCc2ccnc(c2)Cl 34a_100000748751_100000198546 [0,2,0,0,0,0|1,0,0]=3 14980 B18R2.269 Fc1ccc(cc1)COCc2ccnc(c2)Cl 7a_100000210977_100000764220 [0,2,0,0,0,0|1,0,0]=3 14981 B18R2.269 Fc1ccc(cc1)COCc2ccnc(c2)F 34a_100000082451_100000198546 [0,2,0,0,0,0|1,0,0]=3 14982 B18R2.269 Fc1ccc(cc1)COCc2ccnc(n2)Cl 34a_100000210977_100000099655 [0,2,0,0,0,0|2,0,0]=4 14983 B18R2.269 Fc1ccc(cc1)COCc2ccnc(n2)Cl 7a_100000210977_100000099655 [0,2,0,0,0,0|2,0,0]=4 14984 B18R2.269 Fc1ccc(cc1)COCc2cncc(c2)Br 34a_100000210977_100000738771 [0,2,0,0,0,0|1,0,0]=3 14985 B18R2.269 Fc1ccc(cc1)COCc2cncc(c2)Br 34a_100011259137_100000198546 [0,2,0,0,0,0|1,0,0]=3 14986 B18R2.269 Fc1ccc(cc1)COCc2cncc(c2)Br 7a_100000210977_100000738771 [0,2,0,0,0,0|1,0,0]=3 14987 B18R2.269 Fc1ccc(cc1)COCc2cncc(c2)Br 7a_100011259137_100000198546 [0,2,0,0,0,0|1,0,0]=3 14988 B18R2.269 Fc1ccc(cc1)COCc2cncc(c2)Cl 34a_100000092867_100000198546 [0,2,0,0,0,0|1,0,0]=3 14989 B18R2.269 Fc1ccc(cc1)COCc2cncc(c2)Cl 34a_100000210977_100016992070 [0,2,0,0,0,0|1,0,0]=3 14990 B18R2.269 Fc1ccc(cc1)COCc2cncc(c2)Cl 7a_100000092867_100000198546 [0,2,0,0,0,0|1,0,0]=3 14991 B18R2.269 Fc1ccc(cc1)COCc2cncc(c2)Cl 7a_100000210977_100016992070 [0,2,0,0,0,0|1,0,0]=3 14992 B18R2.269 Fc1ccc(cc1)COCc2cncc(c2)F 34a_100000210977_100000725299 [0,2,0,0,0,0|1,0,0]=3 14993 B18R2.269 Fc1ccc(cc1)COCc2cncc(c2)F 34a_100011962875_100000198546 [0,2,0,0,0,0|1,0,0]=3 14994 B18R2.269 Fc1ccc(cc1)COCc2cncc(c2)F 7a_100000210977_100000725299 [0,2,0,0,0,0|1,0,0]=3 14995 B18R2.269 Fc1ccc(cc1)COCc2cncc(c2)F 7a_100011962875_100000198546 [0,2,0,0,0,0|1,0,0]=3 14996 B18R2.269 Fc1ccc(cc1)CSCc2cc(ccn2)Br 62a_100000198546_100010173614 [0,2,0,0,0,0|1,1,0]=4 14997 B18R2.269 Fc1ccc(cc1)CSCc2cc(ccn2)Br 62a_100010173614_100000187164 [0,2,0,0,0,0|1,1,0]=4 14998 B18R2.269 Fc1ccc(cc1)CSCc2cc(ccn2)Cl 62a_100000198546_100016988179 [0,2,0,0,0,0|1,1,0]=4 14999 B18R2.269 Fc1ccc(cc1)CSCc2cc(ccn2)Cl 62a_100016988179_100000187164 [0,2,0,0,0,0|1,1,0]=4 15000 B18R2.269 Fc1ccc(cc1)CSCc2cccc(c2)Br 62a_100000198546_100000211773 [0,2,0,0,0,0|0,1,0]=3 15001 B18R2.269 Fc1ccc(cc1)CSCc2cccc(c2)Br 62a_100000211773_100000187164 [0,2,0,0,0,0|0,1,0]=3 15002 B18R2.269 Fc1ccc(cc1)CSCc2cccc(c2)Cl 62a_100000187163_100000187164 [0,2,0,0,0,0|0,1,0]=3 15003 B18R2.269 Fc1ccc(cc1)CSCc2cccc(c2)Cl 62a_100000198546_100000187163 [0,2,0,0,0,0|0,1,0]=3 15004 B18R2.269 Fc1ccc(cc1)CSCc2cccc(c2)F 62a_100000198546_100000230114 [0,2,0,0,0,0|0,1,0]=3 15005 B18R2.269 Fc1ccc(cc1)CSCc2cccc(c2)F 62a_100000230114_100000187164 [0,2,0,0,0,0|0,1,0]=3 15006 B18R2.269 Fc1ccc(cc1)CSCc2cccc(c2)I 62a_100000198546_100011218688 [0,2,0,0,0,0|0,1,0]=3 15007 B18R2.269 Fc1ccc(cc1)CSCc2cccc(c2)I 62a_100011218688_100000187164 [0,2,0,0,0,0|0,1,0]=3 15008 B18R2.269 Fc1ccc(cc1)CSCc2cccc(n2)Br 62a_100000198546_100009889011 [0,2,0,0,0,0|1,1,0]=4 15009 B18R2.269 Fc1ccc(cc1)CSCc2cccc(n2)Br 62a_100009889011_100000187164 [0,2,0,0,0,0|1,1,0]=4 15010 B18R2.269 Fc1ccc(cc1)CSCc2cccc(n2)Cl 62a_100000086093_100000187164 [0,2,0,0,0,0|1,1,0]=4 15011 B18R2.269 Fc1ccc(cc1)CSCc2cccc(n2)Cl 62a_100000198546_100000086093 [0,2,0,0,0,0|1,1,0]=4 15012 B18R2.269 Fc1ccc(cc1)CSCc2cccc(n2)F 62a_100000198546_100009819644 [0,2,0,0,0,0|1,1,0]=4 15013 B18R2.269 Fc1ccc(cc1)CSCc2cccc(n2)F 62a_100009819644_100000187164 [0,2,0,0,0,0|1,1,0]=4 15014 B18R2.269 Fc1ccc(cc1)CSCc2ccnc(c2)Br 62a_100000198546_100010243470 [0,2,0,0,0,0|1,1,0]=4 15015 B18R2.269 Fc1ccc(cc1)CSCc2ccnc(c2)Br 62a_100010254460_100000187164 [0,2,0,0,0,0|1,1,0]=4 15016 B18R2.269 Fc1ccc(cc1)CSCc2ccnc(c2)Cl 62a_100000198546_100000764220 [0,2,0,0,0,0|1,1,0]=4 15017 B18R2.269 Fc1ccc(cc1)CSCc2ccnc(c2)Cl 62a_100000764220_100000187164 [0,2,0,0,0,0|1,1,0]=4 15018 B18R2.269 Fc1ccc(cc1)CSCc2cncc(c2)Br 62a_100000198546_100000738771 [0,2,0,0,0,0|1,1,0]=4 15019 B18R2.269 Fc1ccc(cc1)CSCc2cncc(c2)Br 62a_100000738771_100000187164 [0,2,0,0,0,0|1,1,0]=4 15020 B18R2.269 Fc1ccc(cc1)CSCc2cncc(c2)Cl 62a_100000198546_100016992070 [0,2,0,0,0,0|1,1,0]=4 15021 B18R2.269 Fc1ccc(cc1)CSCc2cncc(c2)Cl 62a_100016992070_100000187164 [0,2,0,0,0,0|1,1,0]=4 15022 B18R2.269 Fc1ccc(cc1)CSCc2cncc(c2)F 62a_100000198546_100000725299 [0,2,0,0,0,0|1,1,0]=4 15023 B18R2.269 Fc1ccc(cc1)CSCc2cncc(c2)F 62a_100000725299_100000187164 [0,2,0,0,0,0|1,1,0]=4 15024 B18R2.269 Fc1ccc(cc1)NCCc2cccc(c2)Br 34a_100000185862_100011740638 [0,2,0,0,0,0|2,0,0]=4 15025 B18R2.269 Fc1ccc(cc1)NCCc2cccc(c2)Cl 34a_100000185862_100011713710 [0,2,0,0,0,0|2,0,0]=4 15026 B18R2.269 Fc1ccc(cc1)NCCc2cccc(c2)F 34a_100000185862_100011217235 [0,2,0,0,0,0|2,0,0]=4 15027 B18R2.269 Fc1ccc(cc1)OCCc2cccc(c2)Br 34a_100000210339_100011740638 [0,2,0,0,0,0|2,0,0]=4 15028 B18R2.269 Fc1ccc(cc1)OCCc2cccc(c2)Cl 34a_100000210339_100011713710 [0,2,0,0,0,0|2,0,0]=4 15029 B18R2.269 Fc1ccc(cc1)OCCc2cccc(c2)F 34a_100000210339_100011217235 [0,2,0,0,0,0|2,0,0]=4 15030 B18R2.269 Fc1ccc(cc1)SCCc2cccc(c2)Br 62a_100000211213_100011740638 [0,2,0,0,0,0|2,0,0]=4 15031 B18R2.269 Fc1ccc(cc1)SCCc2cccc(c2)Br 62a_100011740638_100000211213 [0,2,0,0,0,0|2,0,0]=4 15032 B18R2.269 Fc1ccc(cc1)SCCc2cccc(c2)Cl 62a_100000211213_100011713710 [0,2,0,0,0,0|2,0,0]=4 15033 B18R2.269 Fc1ccc(cc1)SCCc2cccc(c2)Cl 62a_100011713710_100000211213 [0,2,0,0,0,0|2,0,0]=4 15034 B18R2.269 Fc1ccc(cc1)SCCc2cccc(c2)F 62a_100000211213_100011217235 [0,2,0,0,0,0|2,0,0]=4 15035 B18R2.269 Fc1ccc(cc1)SCCc2cccc(c2)F 62a_100011217235_100000211213 [0,2,0,0,0,0|2,0,0]=4 15036 B18R2.269 Fc1ccc(cn1)CNCc2cccc(c2)Br 2230a_100000101913_100000698116 [0,2,0,0,0,0|2,0,0]=4 15037 B18R2.269 Fc1ccc(cn1)CNCc2cccc(c2)Br 2230a_100000174977_100009820150 [0,2,0,0,0,0|2,0,0]=4 15038 B18R2.269 Fc1ccc(cn1)CNCc2cccc(c2)Br 270004a_100000101913_100000210085 [0,2,0,0,0,0|2,0,0]=4 15039 B18R2.269 Fc1ccc(cn1)CNCc2cccc(c2)Br 34a_100000101913_100000698116 [0,2,0,0,0,0|2,0,0]=4 15040 B18R2.269 Fc1ccc(cn1)CNCc2cccc(c2)Br 34a_100000174977_100000099788 [0,2,0,0,0,0|2,0,0]=4 15041 B18R2.269 Fc1ccc(cn1)CNCc2cccc(c2)Cl 2230a_100000101913_100000181238 [0,2,0,0,0,0|2,0,0]=4 15042 B18R2.269 Fc1ccc(cn1)CNCc2cccc(c2)Cl 2230a_100000174878_100009820150 [0,2,0,0,0,0|2,0,0]=4 15043 B18R2.269 Fc1ccc(cn1)CNCc2cccc(c2)Cl 270004a_100000101913_100000210801 [0,2,0,0,0,0|2,0,0]=4 15044 B18R2.269 Fc1ccc(cn1)CNCc2cccc(c2)Cl 34a_100000101913_100000187163 [0,2,0,0,0,0|2,0,0]=4 15045 B18R2.269 Fc1ccc(cn1)CNCc2cccc(c2)Cl 34a_100000174878_100000099788 [0,2,0,0,0,0|2,0,0]=4 15046 B18R2.269 Fc1ccc(cn1)CNCc2cccc(c2)I 2230a_100000101913_100011218688 [0,2,0,0,0,0|2,0,0]=4 15047 B18R2.269 Fc1ccc(cn1)CNCc2cccc(c2)I 2230a_100000106179_100009820150 [0,2,0,0,0,0|2,0,0]=4 15048 B18R2.269 Fc1ccc(cn1)CNCc2cccc(c2)I 270004a_100000101913_100000014684 [0,2,0,0,0,0|2,0,0]=4 15049 B18R2.269 Fc1ccc(cn1)CNCc2cccc(c2)I 34a_100000101913_100011218688 [0,2,0,0,0,0|2,0,0]=4 15050 B18R2.269 Fc1ccc(cn1)CNCc2cccc(c2)I 34a_100000106179_100000099788 [0,2,0,0,0,0|2,0,0]=4 15051 B18R2.269 Fc1ccc(cn1)COCc2cc(ccn2)Br 34a_100000079959_100010173614 [0,2,0,0,0,0|2,0,0]=4 15052 B18R2.269 Fc1ccc(cn1)COCc2cc(ccn2)Cl 34a_100000079959_100016988179 [0,2,0,0,0,0|2,0,0]=4 15053 B18R2.269 Fc1ccc(cn1)COCc2cc(ccn2)Cl 34a_100000748867_100000099788 [0,2,0,0,0,0|2,0,0]=4 15054 B18R2.269 Fc1ccc(cn1)COCc2cccc(c2)Br 34a_100000079959_100000698116 [0,2,0,0,0,0|1,0,0]=3 15055 B18R2.269 Fc1ccc(cn1)COCc2cccc(c2)Br 34a_100000687537_100000099788 [0,2,0,0,0,0|1,0,0]=3 15056 B18R2.269 Fc1ccc(cn1)COCc2cccc(c2)Br 7a_100000687537_100009820150 [0,2,0,0,0,0|1,0,0]=3 15057 B18R2.269 Fc1ccc(cn1)COCc2cccc(c2)Cl 34a_100000079959_100000187163 [0,2,0,0,0,0|1,0,0]=3 15058 B18R2.269 Fc1ccc(cn1)COCc2cccc(c2)Cl 34a_100000241301_100000099788 [0,2,0,0,0,0|1,0,0]=3 15059 B18R2.269 Fc1ccc(cn1)COCc2cccc(c2)Cl 7a_100000241301_100009820150 [0,2,0,0,0,0|1,0,0]=3 15060 B18R2.269 Fc1ccc(cn1)COCc2cccc(c2)I 34a_100000079959_100011218688 [0,2,0,0,0,0|1,0,0]=3 15061 B18R2.269 Fc1ccc(cn1)COCc2cccc(c2)I 34a_100011215336_100000099788 [0,2,0,0,0,0|1,0,0]=3 15062 B18R2.269 Fc1ccc(cn1)COCc2cccc(c2)I 7a_100011215336_100009820150 [0,2,0,0,0,0|1,0,0]=3 15063 B18R2.269 Fc1ccc(cn1)COCc2cccc(n2)Br 34a_100000079959_100009889011 [0,2,0,0,0,0|2,0,0]=4 15064 B18R2.269 Fc1ccc(cn1)COCc2cccc(n2)Br 34a_100000694195_100000099788 [0,2,0,0,0,0|2,0,0]=4 15065 B18R2.269 Fc1ccc(cn1)COCc2cccc(n2)Cl 34a_100000079959_100000086093 [0,2,0,0,0,0|2,0,0]=4 15066 B18R2.269 Fc1ccc(cn1)COCc2cccc(n2)Cl 34a_100011998359_100000099788 [0,2,0,0,0,0|2,0,0]=4 15067 B18R2.269 Fc1ccc(cn1)COCc2cccc(n2)F 34a_100000079959_100009819644 [0,2,0,0,0,0|2,0,0]=4 15068 B18R2.269 Fc1ccc(cn1)COCc2cccc(n2)F 34a_100000086748_100000099788 [0,2,0,0,0,0|2,0,0]=4 15069 B18R2.269 Fc1ccc(cn1)COCc2ccnc(c2)Br 34a_100000079959_100010243470 [0,2,0,0,0,0|2,0,0]=4 15070 B18R2.269 Fc1ccc(cn1)COCc2ccnc(c2)Br 34a_100009814636_100000099788 [0,2,0,0,0,0|2,0,0]=4 15071 B18R2.269 Fc1ccc(cn1)COCc2ccnc(c2)Br 7a_100009814636_100009820150 [0,2,0,0,0,0|2,0,0]=4 15072 B18R2.269 Fc1ccc(cn1)COCc2ccnc(c2)Cl 34a_100000079959_100000764220 [0,2,0,0,0,0|2,0,0]=4 15073 B18R2.269 Fc1ccc(cn1)COCc2ccnc(c2)Cl 34a_100000748751_100000099788 [0,2,0,0,0,0|2,0,0]=4 15074 B18R2.269 Fc1ccc(cn1)COCc2ccnc(c2)F 34a_100000082451_100000099788 [0,2,0,0,0,0|2,0,0]=4 15075 B18R2.269 Fc1ccc(cn1)COCc2cncc(c2)Br 34a_100000079959_100000738771 [0,2,0,0,0,0|2,0,0]=4 15076 B18R2.269 Fc1ccc(cn1)COCc2cncc(c2)Br 34a_100011259137_100000099788 [0,2,0,0,0,0|2,0,0]=4 15077 B18R2.269 Fc1ccc(cn1)COCc2cncc(c2)Br 7a_100011259137_100009820150 [0,2,0,0,0,0|2,0,0]=4 15078 B18R2.269 Fc1ccc(cn1)COCc2cncc(c2)Cl 34a_100000079959_100016992070 [0,2,0,0,0,0|2,0,0]=4 15079 B18R2.269 Fc1ccc(cn1)COCc2cncc(c2)Cl 34a_100000092867_100000099788 [0,2,0,0,0,0|2,0,0]=4 15080 B18R2.269 Fc1ccc(cn1)COCc2cncc(c2)Cl 7a_100000092867_100009820150 [0,2,0,0,0,0|2,0,0]=4 15081 B18R2.269 Fc1ccc(cn1)CSCc2cccc(c2)Br 62a_100000211773_100000099788 [0,2,0,0,0,0|1,1,0]=4 15082 B18R2.269 Fc1ccc(cn1)CSCc2cccc(c2)Br 62a_100009820150_100000211773 [0,2,0,0,0,0|1,1,0]=4 15083 B18R2.269 Fc1ccc(cn1)CSCc2cccc(c2)Cl 62a_100000187163_100000099788 [0,2,0,0,0,0|1,1,0]=4 15084 B18R2.269 Fc1ccc(cn1)CSCc2cccc(c2)Cl 62a_100009820150_100000187163 [0,2,0,0,0,0|1,1,0]=4 15085 B18R2.269 Fc1ccc(cn1)CSCc2cccc(c2)I 62a_100009820150_100011218688 [0,2,0,0,0,0|1,1,0]=4 15086 B18R2.269 Fc1ccc(cn1)CSCc2cccc(c2)I 62a_100011218688_100000099788 [0,2,0,0,0,0|1,1,0]=4 15087 B18R2.269 Fc1ccc(nc1)CNCc2cccc(c2)Br 207a_100000174977_100011934744 [0,2,0,0,0,0|2,0,0]=4 15088 B18R2.269 Fc1ccc(nc1)CNCc2cccc(c2)Br 2230a_100000174977_100000703193 [0,2,0,0,0,0|2,0,0]=4 15089 B18R2.269 Fc1ccc(nc1)CNCc2cccc(c2)Br 270004a_100000174977_100011934744 [0,2,0,0,0,0|2,0,0]=4 15090 B18R2.269 Fc1ccc(nc1)CNCc2cccc(c2)Br 34a_100000174977_100000703193 [0,2,0,0,0,0|2,0,0]=4 15091 B18R2.269 Fc1ccc(nc1)CNCc2cccc(c2)Br 34a_100020620131_100000698116 [0,2,0,0,0,0|2,0,0]=4 15092 B18R2.269 Fc1ccc(nc1)CNCc2cccc(c2)Cl 207a_100000174878_100011934744 [0,2,0,0,0,0|2,0,0]=4 15093 B18R2.269 Fc1ccc(nc1)CNCc2cccc(c2)Cl 2230a_100000174878_100000703193 [0,2,0,0,0,0|2,0,0]=4 15094 B18R2.269 Fc1ccc(nc1)CNCc2cccc(c2)Cl 270004a_100000174878_100011934744 [0,2,0,0,0,0|2,0,0]=4 15095 B18R2.269 Fc1ccc(nc1)CNCc2cccc(c2)Cl 34a_100000174878_100000703193 [0,2,0,0,0,0|2,0,0]=4 15096 B18R2.269 Fc1ccc(nc1)CNCc2cccc(c2)Cl 34a_100020620131_100000187163 [0,2,0,0,0,0|2,0,0]=4 15097 B18R2.269 Fc1ccc(nc1)CNCc2cccc(c2)F 207a_100000174948_100011934744 [0,2,0,0,0,0|2,0,0]=4 15098 B18R2.269 Fc1ccc(nc1)CNCc2cccc(c2)F 2230a_100000174948_100000703193 [0,2,0,0,0,0|2,0,0]=4 15099 B18R2.269 Fc1ccc(nc1)CNCc2cccc(c2)F 270004a_100000174948_100011934744 [0,2,0,0,0,0|2,0,0]=4 15100 B18R2.269 Fc1ccc(nc1)CNCc2cccc(c2)F 34a_100000174948_100000703193 [0,2,0,0,0,0|2,0,0]=4 15101 B18R2.269 Fc1ccc(nc1)CNCc2cccc(c2)F 34a_100020620131_100000187166 [0,2,0,0,0,0|2,0,0]=4 15102 B18R2.269 Fc1ccc(nc1)CNCc2cccc(c2)I 207a_100000106179_100011934744 [0,2,0,0,0,0|2,0,0]=4 15103 B18R2.269 Fc1ccc(nc1)CNCc2cccc(c2)I 2230a_100000106179_100000703193 [0,2,0,0,0,0|2,0,0]=4 15104 B18R2.269 Fc1ccc(nc1)CNCc2cccc(c2)I 270004a_100000106179_100011934744 [0,2,0,0,0,0|2,0,0]=4 15105 B18R2.269 Fc1ccc(nc1)CNCc2cccc(c2)I 34a_100000106179_100000703193 [0,2,0,0,0,0|2,0,0]=4 15106 B18R2.269 Fc1ccc(nc1)CNCc2cccc(c2)I 34a_100020620131_100011218688 [0,2,0,0,0,0|2,0,0]=4 15107 B18R2.269 Fc1ccc(nc1)COCc2cc(ccn2)Br 34a_100011999454_100010173614 [0,2,0,0,0,0|2,0,0]=4 15108 B18R2.269 Fc1ccc(nc1)COCc2cc(ccn2)Cl 34a_100000748867_100000703193 [0,2,0,0,0,0|2,0,0]=4 15109 B18R2.269 Fc1ccc(nc1)COCc2cc(ccn2)Cl 34a_100011999454_100016988179 [0,2,0,0,0,0|2,0,0]=4 15110 B18R2.269 Fc1ccc(nc1)COCc2cccc(c2)Br 34a_100000687537_100000703193 [0,2,0,0,0,0|1,0,0]=3 15111 B18R2.269 Fc1ccc(nc1)COCc2cccc(c2)Br 34a_100011999454_100000698116 [0,2,0,0,0,0|1,0,0]=3 15112 B18R2.269 Fc1ccc(nc1)COCc2cccc(c2)Br 7a_100000687537_100000703193 [0,2,0,0,0,0|1,0,0]=3 15113 B18R2.269 Fc1ccc(nc1)COCc2cccc(c2)Cl 34a_100000241301_100000703193 [0,2,0,0,0,0|1,0,0]=3 15114 B18R2.269 Fc1ccc(nc1)COCc2cccc(c2)Cl 34a_100011999454_100000187163 [0,2,0,0,0,0|1,0,0]=3 15115 B18R2.269 Fc1ccc(nc1)COCc2cccc(c2)Cl 7a_100000241301_100000703193 [0,2,0,0,0,0|1,0,0]=3 15116 B18R2.269 Fc1ccc(nc1)COCc2cccc(c2)F 34a_100000210976_100000703193 [0,2,0,0,0,0|1,0,0]=3 15117 B18R2.269 Fc1ccc(nc1)COCc2cccc(c2)F 34a_100011999454_100000187166 [0,2,0,0,0,0|1,0,0]=3 15118 B18R2.269 Fc1ccc(nc1)COCc2cccc(c2)F 7a_100000210976_100000703193 [0,2,0,0,0,0|1,0,0]=3 15119 B18R2.269 Fc1ccc(nc1)COCc2cccc(c2)I 34a_100011215336_100000703193 [0,2,0,0,0,0|1,0,0]=3 15120 B18R2.269 Fc1ccc(nc1)COCc2cccc(c2)I 34a_100011999454_100011218688 [0,2,0,0,0,0|1,0,0]=3 15121 B18R2.269 Fc1ccc(nc1)COCc2cccc(c2)I 7a_100011215336_100000703193 [0,2,0,0,0,0|1,0,0]=3 15122 B18R2.269 Fc1ccc(nc1)COCc2cccc(n2)Br 34a_100000694195_100000703193 [0,2,0,0,0,0|2,0,0]=4 15123 B18R2.269 Fc1ccc(nc1)COCc2cccc(n2)Br 34a_100011999454_100009889011 [0,2,0,0,0,0|2,0,0]=4 15124 B18R2.269 Fc1ccc(nc1)COCc2cccc(n2)Cl 34a_100011998359_100000703193 [0,2,0,0,0,0|2,0,0]=4 15125 B18R2.269 Fc1ccc(nc1)COCc2cccc(n2)Cl 34a_100011999454_100000086093 [0,2,0,0,0,0|2,0,0]=4 15126 B18R2.269 Fc1ccc(nc1)COCc2cccc(n2)F 34a_100000086748_100000703193 [0,2,0,0,0,0|2,0,0]=4 15127 B18R2.269 Fc1ccc(nc1)COCc2cccc(n2)F 34a_100011999454_100009819644 [0,2,0,0,0,0|2,0,0]=4 15128 B18R2.269 Fc1ccc(nc1)COCc2ccnc(c2)Br 34a_100009814636_100000703193 [0,2,0,0,0,0|2,0,0]=4 15129 B18R2.269 Fc1ccc(nc1)COCc2ccnc(c2)Br 34a_100011999454_100010243470 [0,2,0,0,0,0|2,0,0]=4 15130 B18R2.269 Fc1ccc(nc1)COCc2ccnc(c2)Br 7a_100009814636_100000703193 [0,2,0,0,0,0|2,0,0]=4 15131 B18R2.269 Fc1ccc(nc1)COCc2ccnc(c2)Cl 34a_100000748751_100000703193 [0,2,0,0,0,0|2,0,0]=4 15132 B18R2.269 Fc1ccc(nc1)COCc2ccnc(c2)Cl 34a_100011999454_100000764220 [0,2,0,0,0,0|2,0,0]=4 15133 B18R2.269 Fc1ccc(nc1)COCc2ccnc(c2)F 34a_100000082451_100000703193 [0,2,0,0,0,0|2,0,0]=4 15134 B18R2.269 Fc1ccc(nc1)COCc2cncc(c2)Br 34a_100011259137_100000703193 [0,2,0,0,0,0|2,0,0]=4 15135 B18R2.269 Fc1ccc(nc1)COCc2cncc(c2)Br 34a_100011999454_100000738771 [0,2,0,0,0,0|2,0,0]=4 15136 B18R2.269 Fc1ccc(nc1)COCc2cncc(c2)Br 7a_100011259137_100000703193 [0,2,0,0,0,0|2,0,0]=4 15137 B18R2.269 Fc1ccc(nc1)COCc2cncc(c2)Cl 34a_100000092867_100000703193 [0,2,0,0,0,0|2,0,0]=4 15138 B18R2.269 Fc1ccc(nc1)COCc2cncc(c2)Cl 34a_100011999454_100016992070 [0,2,0,0,0,0|2,0,0]=4 15139 B18R2.269 Fc1ccc(nc1)COCc2cncc(c2)Cl 7a_100000092867_100000703193 [0,2,0,0,0,0|2,0,0]=4 15140 B18R2.269 Fc1ccc(nc1)COCc2cncc(c2)F 34a_100011962875_100000703193 [0,2,0,0,0,0|2,0,0]=4 15141 B18R2.269 Fc1ccc(nc1)COCc2cncc(c2)F 34a_100011999454_100000725299 [0,2,0,0,0,0|2,0,0]=4 15142 B18R2.269 Fc1ccc(nc1)COCc2cncc(c2)F 7a_100011962875_100000703193 [0,2,0,0,0,0|2,0,0]=4 15143 B18R2.269 Fc1ccc(nc1)CSCc2cccc(c2)Br 62a_100000211773_100000703193 [0,2,0,0,0,0|1,1,0]=4 15144 B18R2.269 Fc1ccc(nc1)CSCc2cccc(c2)Br 62a_100000703193_100000211773 [0,2,0,0,0,0|1,1,0]=4 15145 B18R2.269 Fc1ccc(nc1)CSCc2cccc(c2)Cl 62a_100000187163_100000703193 [0,2,0,0,0,0|1,1,0]=4 15146 B18R2.269 Fc1ccc(nc1)CSCc2cccc(c2)Cl 62a_100000703193_100000187163 [0,2,0,0,0,0|1,1,0]=4 15147 B18R2.269 Fc1ccc(nc1)CSCc2cccc(c2)F 62a_100000230114_100000703193 [0,2,0,0,0,0|1,1,0]=4 15148 B18R2.269 Fc1ccc(nc1)CSCc2cccc(c2)F 62a_100000703193_100000230114 [0,2,0,0,0,0|1,1,0]=4 15149 B18R2.269 Fc1ccc(nc1)CSCc2cccc(c2)I 62a_100000703193_100011218688 [0,2,0,0,0,0|1,1,0]=4 15150 B18R2.269 Fc1ccc(nc1)CSCc2cccc(c2)I 62a_100011218688_100000703193 [0,2,0,0,0,0|1,1,0]=4 15151 B18R2.269 Fc1cccc(c1)CCNc2ccc(cc2)Br 2230a_100000210018_100011217235 [0,2,0,0,0,0|2,0,0]=4 15152 B18R2.269 Fc1cccc(c1)CCNc2ccc(cc2)Br 34a_100000210018_100011217235 [0,2,0,0,0,0|2,0,0]=4 15153 B18R2.269 Fc1cccc(c1)CCNc2ccc(cc2)Cl 2230a_100000210052_100011217235 [0,2,0,0,0,0|2,0,0]=4 15154 B18R2.269 Fc1cccc(c1)CCNc2ccc(cc2)Cl 34a_100000210052_100011217235 [0,2,0,0,0,0|2,0,0]=4 15155 B18R2.269 Fc1cccc(c1)CCNc2ccc(cc2)I 34a_100000185761_100011217235 [0,2,0,0,0,0|2,0,0]=4 15156 B18R2.269 Fc1cccc(c1)CCOc2ccc(cc2)Br 34a_100000185759_100011217235 [0,2,0,0,0,0|2,0,0]=4 15157 B18R2.269 Fc1cccc(c1)CCOc2ccc(cc2)Br 7a_100000185759_100011217235 [0,2,0,0,0,0|2,0,0]=4 15158 B18R2.269 Fc1cccc(c1)CCOc2ccc(cc2)Cl 34a_100000210216_100011217235 [0,2,0,0,0,0|2,0,0]=4 15159 B18R2.269 Fc1cccc(c1)CCOc2ccc(cc2)Cl 7a_100000210216_100011217235 [0,2,0,0,0,0|2,0,0]=4 15160 B18R2.269 Fc1cccc(c1)CCOc2ccc(cc2)I 34a_100000212066_100011217235 [0,2,0,0,0,0|2,0,0]=4 15161 B18R2.269 Fc1cccc(c1)CCOc2ccc(cc2)I 7a_100000212066_100011217235 [0,2,0,0,0,0|2,0,0]=4 15162 B18R2.269 Fc1cccc(c1)CCSc2ccc(cc2)Br 62a_100000752885_100011217235 [0,2,0,0,0,0|2,0,0]=4 15163 B18R2.269 Fc1cccc(c1)CCSc2ccc(cc2)Br 62a_100011217235_100000752885 [0,2,0,0,0,0|2,0,0]=4 15164 B18R2.269 Fc1cccc(c1)CCSc2ccc(cc2)Cl 62a_100000755918_100011217235 [0,2,0,0,0,0|2,0,0]=4 15165 B18R2.269 Fc1cccc(c1)CCSc2ccc(cc2)Cl 62a_100011217235_100000755918 [0,2,0,0,0,0|2,0,0]=4 15166 B18R2.269 Fc1cccc(c1)CNCc2ccc(cc2)Br 207a_100000174875_100000210812 [0,2,0,0,0,0|1,0,0]=3 15167 B18R2.269 Fc1cccc(c1)CNCc2ccc(cc2)Br 207a_100000174948_100000186029 [0,2,0,0,0,0|1,0,0]=3 15168 B18R2.269 Fc1cccc(c1)CNCc2ccc(cc2)Br 2230a_100000174875_100000230114 [0,2,0,0,0,0|1,0,0]=3 15169 B18R2.269 Fc1cccc(c1)CNCc2ccc(cc2)Br 2230a_100000174948_100011217064 [0,2,0,0,0,0|1,0,0]=3 15170 B18R2.269 Fc1cccc(c1)CNCc2ccc(cc2)Br 270004a_100000174875_100000210812 [0,2,0,0,0,0|1,0,0]=3 15171 B18R2.269 Fc1cccc(c1)CNCc2ccc(cc2)Br 270004a_100000174948_100000186029 [0,2,0,0,0,0|1,0,0]=3 15172 B18R2.269 Fc1cccc(c1)CNCc2ccc(cc2)Br 34a_100000174875_100000187166 [0,2,0,0,0,0|1,0,0]=3 15173 B18R2.269 Fc1cccc(c1)CNCc2ccc(cc2)Br 34a_100000174948_100000189115 [0,2,0,0,0,0|1,0,0]=3 15174 B18R2.269 Fc1cccc(c1)CNCc2ccc(cc2)Cl 207a_100000174871_100000210812 [0,2,0,0,0,0|1,0,0]=3 15175 B18R2.269 Fc1cccc(c1)CNCc2ccc(cc2)Cl 207a_100000174948_100000189385 [0,2,0,0,0,0|1,0,0]=3 15176 B18R2.269 Fc1cccc(c1)CNCc2ccc(cc2)Cl 2230a_100000174871_100000230114 [0,2,0,0,0,0|1,0,0]=3 15177 B18R2.269 Fc1cccc(c1)CNCc2ccc(cc2)Cl 2230a_100000174948_100000694040 [0,2,0,0,0,0|1,0,0]=3 15178 B18R2.269 Fc1cccc(c1)CNCc2ccc(cc2)Cl 270004a_100000174871_100000210812 [0,2,0,0,0,0|1,0,0]=3 15179 B18R2.269 Fc1cccc(c1)CNCc2ccc(cc2)Cl 270004a_100000174948_100000189385 [0,2,0,0,0,0|1,0,0]=3 15180 B18R2.269 Fc1cccc(c1)CNCc2ccc(cc2)Cl 34a_100000174871_100000187166 [0,2,0,0,0,0|1,0,0]=3 15181 B18R2.269 Fc1cccc(c1)CNCc2ccc(cc2)Cl 34a_100000174948_100000694040 [0,2,0,0,0,0|1,0,0]=3 15182 B18R2.269 Fc1cccc(c1)CNCc2ccc(cc2)I 207a_100000174948_100000188517 [0,2,0,0,0,0|1,0,0]=3 15183 B18R2.269 Fc1cccc(c1)CNCc2ccc(cc2)I 207a_100016989417_100000210812 [0,2,0,0,0,0|1,0,0]=3 15184 B18R2.269 Fc1cccc(c1)CNCc2ccc(cc2)I 2230a_100000174948_100000189116 [0,2,0,0,0,0|1,0,0]=3 15185 B18R2.269 Fc1cccc(c1)CNCc2ccc(cc2)I 2230a_100016989417_100000230114 [0,2,0,0,0,0|1,0,0]=3 15186 B18R2.269 Fc1cccc(c1)CNCc2ccc(cc2)I 270004a_100016989417_100000210812 [0,2,0,0,0,0|1,0,0]=3 15187 B18R2.269 Fc1cccc(c1)CNCc2ccc(cc2)I 34a_100000174948_100000189116 [0,2,0,0,0,0|1,0,0]=3 15188 B18R2.269 Fc1cccc(c1)CNCc2ccc(cc2)I 34a_100016989417_100000187166 [0,2,0,0,0,0|1,0,0]=3 15189 B18R2.269 Fc1cccc(c1)CNCc2ccc(cn2)Br 207a_100000174948_100000754260 [0,2,0,0,0,0|2,0,0]=4 15190 B18R2.269 Fc1cccc(c1)CNCc2ccc(cn2)Br 2230a_100000174948_100000702658 [0,2,0,0,0,0|2,0,0]=4 15191 B18R2.269 Fc1cccc(c1)CNCc2ccc(cn2)Br 270004a_100000174948_100000754260 [0,2,0,0,0,0|2,0,0]=4 15192 B18R2.269 Fc1cccc(c1)CNCc2ccc(cn2)Br 34a_100000174948_100000702658 [0,2,0,0,0,0|2,0,0]=4 15193 B18R2.269 Fc1cccc(c1)CNCc2ccc(cn2)Br 34a_100015188789_100000187166 [0,2,0,0,0,0|2,0,0]=4 15194 B18R2.269 Fc1cccc(c1)CNCc2ccc(cn2)Cl 207a_100000174948_100011361569 [0,2,0,0,0,0|2,0,0]=4 15195 B18R2.269 Fc1cccc(c1)CNCc2ccc(cn2)Cl 2230a_100000174948_100012066911 [0,2,0,0,0,0|2,0,0]=4 15196 B18R2.269 Fc1cccc(c1)CNCc2ccc(cn2)Cl 270004a_100000174948_100011361569 [0,2,0,0,0,0|2,0,0]=4 15197 B18R2.269 Fc1cccc(c1)CNCc2ccc(cn2)Cl 270004a_100000697193_100000210812 [0,2,0,0,0,0|2,0,0]=4 15198 B18R2.269 Fc1cccc(c1)CNCc2ccc(cn2)Cl 34a_100000174948_100012066911 [0,2,0,0,0,0|2,0,0]=4 15199 B18R2.269 Fc1cccc(c1)CNCc2ccc(cn2)Cl 34a_100000697193_100000187166 [0,2,0,0,0,0|2,0,0]=4 15200 B18R2.269 Fc1cccc(c1)CNCc2ccc(nc2)Br 207a_100009817727_100000210812 [0,2,0,0,0,0|2,0,0]=4 15201 B18R2.269 Fc1cccc(c1)CNCc2ccc(nc2)Br 2230a_100000174948_100009831999 [0,2,0,0,0,0|2,0,0]=4 15202 B18R2.269 Fc1cccc(c1)CNCc2ccc(nc2)Br 2230a_100009817727_100000230114 [0,2,0,0,0,0|2,0,0]=4 15203 B18R2.269 Fc1cccc(c1)CNCc2ccc(nc2)Br 270004a_100009817727_100000210812 [0,2,0,0,0,0|2,0,0]=4 15204 B18R2.269 Fc1cccc(c1)CNCc2ccc(nc2)Br 34a_100000174948_100009831999 [0,2,0,0,0,0|2,0,0]=4 15205 B18R2.269 Fc1cccc(c1)CNCc2ccc(nc2)Br 34a_100009817727_100000187166 [0,2,0,0,0,0|2,0,0]=4 15206 B18R2.269 Fc1cccc(c1)CNCc2ccc(nc2)Cl 207a_100000735879_100000210812 [0,2,0,0,0,0|2,0,0]=4 15207 B18R2.269 Fc1cccc(c1)CNCc2ccc(nc2)Cl 2230a_100000174948_100000735431 [0,2,0,0,0,0|2,0,0]=4 15208 B18R2.269 Fc1cccc(c1)CNCc2ccc(nc2)Cl 2230a_100000735879_100000230114 [0,2,0,0,0,0|2,0,0]=4 15209 B18R2.269 Fc1cccc(c1)CNCc2ccc(nc2)Cl 270004a_100000735879_100000210812 [0,2,0,0,0,0|2,0,0]=4 15210 B18R2.269 Fc1cccc(c1)CNCc2ccc(nc2)Cl 34a_100000174948_100000735431 [0,2,0,0,0,0|2,0,0]=4 15211 B18R2.269 Fc1cccc(c1)CNCc2ccc(nc2)Cl 34a_100000735879_100000187166 [0,2,0,0,0,0|2,0,0]=4 15212 B18R2.269 Fc1cccc(c1)CNCc2ccc(nc2)F 2230a_100000101913_100000230114 [0,2,0,0,0,0|2,0,0]=4 15213 B18R2.269 Fc1cccc(c1)CNCc2ccc(nc2)F 2230a_100000174948_100009820150 [0,2,0,0,0,0|2,0,0]=4 15214 B18R2.269 Fc1cccc(c1)CNCc2ccc(nc2)F 270004a_100000101913_100000210812 [0,2,0,0,0,0|2,0,0]=4 15215 B18R2.269 Fc1cccc(c1)CNCc2ccc(nc2)F 34a_100000101913_100000187166 [0,2,0,0,0,0|2,0,0]=4 15216 B18R2.269 Fc1cccc(c1)CNCc2ccc(nc2)F 34a_100000174948_100000099788 [0,2,0,0,0,0|2,0,0]=4 15217 B18R2.269 Fc1cccc(c1)COCc2ccc(cc2)Br 34a_100000210976_100000189115 [0,2,0,0,0,0|0,0,0]=2 15218 B18R2.269 Fc1cccc(c1)COCc2ccc(cc2)Br 34a_100000695286_100000187166 [0,2,0,0,0,0|0,0,0]=2 15219 B18R2.269 Fc1cccc(c1)COCc2ccc(cc2)Br 7a_100000210976_100011217064 [0,2,0,0,0,0|0,0,0]=2 15220 B18R2.269 Fc1cccc(c1)COCc2ccc(cc2)Cl 34a_100000210976_100000694040 [0,2,0,0,0,0|0,0,0]=2 15221 B18R2.269 Fc1cccc(c1)COCc2ccc(cc2)Cl 34a_100000211118_100000187166 [0,2,0,0,0,0|0,0,0]=2 15222 B18R2.269 Fc1cccc(c1)COCc2ccc(cc2)Cl 7a_100000210976_100000187161 [0,2,0,0,0,0|0,0,0]=2 15223 B18R2.269 Fc1cccc(c1)COCc2ccc(cc2)Cl 7a_100000211118_100000230114 [0,2,0,0,0,0|0,0,0]=2 15224 B18R2.269 Fc1cccc(c1)COCc2ccc(cc2)I 34a_100000210976_100000189116 [0,2,0,0,0,0|0,0,0]=2 15225 B18R2.269 Fc1cccc(c1)COCc2ccc(cc2)I 34a_100000690907_100000187166 [0,2,0,0,0,0|0,0,0]=2 15226 B18R2.269 Fc1cccc(c1)COCc2ccc(cc2)I 7a_100000210976_100000189116 [0,2,0,0,0,0|0,0,0]=2 15227 B18R2.269 Fc1cccc(c1)COCc2ccc(cc2)I 7a_100000690907_100000230114 [0,2,0,0,0,0|0,0,0]=2 15228 B18R2.269 Fc1cccc(c1)COCc2ccc(cn2)Br 34a_100000210976_100000702658 [0,2,0,0,0,0|1,0,0]=3 15229 B18R2.269 Fc1cccc(c1)COCc2ccc(cn2)Br 34a_100000754261_100000187166 [0,2,0,0,0,0|1,0,0]=3 15230 B18R2.269 Fc1cccc(c1)COCc2ccc(cn2)Br 7a_100000210976_100000702658 [0,2,0,0,0,0|1,0,0]=3 15231 B18R2.269 Fc1cccc(c1)COCc2ccc(cn2)Cl 34a_100000210976_100012066911 [0,2,0,0,0,0|1,0,0]=3 15232 B18R2.269 Fc1cccc(c1)COCc2ccc(cn2)Cl 34a_100000703999_100000187166 [0,2,0,0,0,0|1,0,0]=3 15233 B18R2.269 Fc1cccc(c1)COCc2ccc(cn2)Cl 7a_100000210976_100012066911 [0,2,0,0,0,0|1,0,0]=3 15234 B18R2.269 Fc1cccc(c1)COCc2ccc(nc2)Br 34a_100000210976_100009831999 [0,2,0,0,0,0|1,0,0]=3 15235 B18R2.269 Fc1cccc(c1)COCc2ccc(nc2)Br 34a_100009816760_100000187166 [0,2,0,0,0,0|1,0,0]=3 15236 B18R2.269 Fc1cccc(c1)COCc2ccc(nc2)Br 7a_100000210976_100009831999 [0,2,0,0,0,0|1,0,0]=3 15237 B18R2.269 Fc1cccc(c1)COCc2ccc(nc2)Br 7a_100009816760_100000230114 [0,2,0,0,0,0|1,0,0]=3 15238 B18R2.269 Fc1cccc(c1)COCc2ccc(nc2)Cl 34a_100000210976_100000735431 [0,2,0,0,0,0|1,0,0]=3 15239 B18R2.269 Fc1cccc(c1)COCc2ccc(nc2)Cl 34a_100000755211_100000187166 [0,2,0,0,0,0|1,0,0]=3 15240 B18R2.269 Fc1cccc(c1)COCc2ccc(nc2)Cl 7a_100000210976_100000735431 [0,2,0,0,0,0|1,0,0]=3 15241 B18R2.269 Fc1cccc(c1)COCc2ccc(nc2)Cl 7a_100000755211_100000230114 [0,2,0,0,0,0|1,0,0]=3 15242 B18R2.269 Fc1cccc(c1)COCc2ccc(nc2)F 34a_100000079959_100000187166 [0,2,0,0,0,0|1,0,0]=3 15243 B18R2.269 Fc1cccc(c1)COCc2ccc(nc2)F 34a_100000210976_100000099788 [0,2,0,0,0,0|1,0,0]=3 15244 B18R2.269 Fc1cccc(c1)COCc2ccc(nc2)F 7a_100000210976_100009820150 [0,2,0,0,0,0|1,0,0]=3 15245 B18R2.269 Fc1cccc(c1)COCc2ccc(nn2)Cl 34a_100000210976_100016992710 [0,2,0,0,0,0|2,0,0]=4 15246 B18R2.269 Fc1cccc(c1)COCc2ccc(nn2)Cl 7a_100000210976_100016992710 [0,2,0,0,0,0|2,0,0]=4 15247 B18R2.269 Fc1cccc(c1)COCc2cnc(cn2)Cl 34a_100012002382_100000187166 [0,2,0,0,0,0|2,0,0]=4 15248 B18R2.269 Fc1cccc(c1)COCc2cnc(nc2)Cl 34a_100009855073_100000187166 [0,2,0,0,0,0|2,0,0]=4 15249 B18R2.269 Fc1cccc(c1)COCc2cnc(nc2)Cl 7a_100009855073_100000230114 [0,2,0,0,0,0|2,0,0]=4 15250 B18R2.269 Fc1cccc(c1)COCc2ncc(cn2)Br 34a_100000210976_100010064664 [0,2,0,0,0,0|2,0,0]=4 15251 B18R2.269 Fc1cccc(c1)COCc2ncc(cn2)Br 7a_100000210976_100010064664 [0,2,0,0,0,0|2,0,0]=4 15252 B18R2.269 Fc1cccc(c1)CSCc2ccc(cc2)Br 62a_100000189115_100000230114 [0,2,0,0,0,0|0,1,0]=3 15253 B18R2.269 Fc1cccc(c1)CSCc2ccc(cc2)Br 62a_100000230114_100000189115 [0,2,0,0,0,0|0,1,0]=3 15254 B18R2.269 Fc1cccc(c1)CSCc2ccc(cc2)Cl 62a_100000187161_100000230114 [0,2,0,0,0,0|0,1,0]=3 15255 B18R2.269 Fc1cccc(c1)CSCc2ccc(cc2)Cl 62a_100000230114_100000187161 [0,2,0,0,0,0|0,1,0]=3 15256 B18R2.269 Fc1cccc(c1)CSCc2ccc(cc2)I 62a_100000189116_100000230114 [0,2,0,0,0,0|0,1,0]=3 15257 B18R2.269 Fc1cccc(c1)CSCc2ccc(cc2)I 62a_100000230114_100000189116 [0,2,0,0,0,0|0,1,0]=3 15258 B18R2.269 Fc1cccc(c1)CSCc2ccc(cn2)Br 62a_100000230114_100000702658 [0,2,0,0,0,0|1,1,0]=4 15259 B18R2.269 Fc1cccc(c1)CSCc2ccc(cn2)Br 62a_100000702658_100000230114 [0,2,0,0,0,0|1,1,0]=4 15260 B18R2.269 Fc1cccc(c1)CSCc2ccc(cn2)Cl 62a_100000230114_100000697101 [0,2,0,0,0,0|1,1,0]=4 15261 B18R2.269 Fc1cccc(c1)CSCc2ccc(cn2)Cl 62a_100012066911_100000230114 [0,2,0,0,0,0|1,1,0]=4 15262 B18R2.269 Fc1cccc(c1)CSCc2ccc(nc2)Br 62a_100000230114_100009831999 [0,2,0,0,0,0|1,1,0]=4 15263 B18R2.269 Fc1cccc(c1)CSCc2ccc(nc2)Br 62a_100009831999_100000230114 [0,2,0,0,0,0|1,1,0]=4 15264 B18R2.269 Fc1cccc(c1)CSCc2ccc(nc2)Cl 62a_100000230114_100000735431 [0,2,0,0,0,0|1,1,0]=4 15265 B18R2.269 Fc1cccc(c1)CSCc2ccc(nc2)Cl 62a_100000735431_100000230114 [0,2,0,0,0,0|1,1,0]=4 15266 B18R2.269 Fc1cccc(c1)CSCc2ccc(nc2)F 62a_100000230114_100000099788 [0,2,0,0,0,0|1,1,0]=4 15267 B18R2.269 Fc1cccc(c1)CSCc2ccc(nc2)F 62a_100009820150_100000230114 [0,2,0,0,0,0|1,1,0]=4 15268 B18R2.269 Fc1cccc(c1)NCCc2ccc(cc2)Br 34a_100000210047_100011740612 [0,2,0,0,0,0|2,0,0]=4 15269 B18R2.269 Fc1cccc(c1)NCCc2ccc(cc2)Cl 34a_100000210047_100011713675 [0,2,0,0,0,0|2,0,0]=4 15270 B18R2.269 Fc1cccc(c1)OCCc2ccc(cc2)Br 34a_100000210426_100011740612 [0,2,0,0,0,0|2,0,0]=4 15271 B18R2.269 Fc1cccc(c1)OCCc2ccc(cc2)Br 7a_100000210426_100011740612 [0,2,0,0,0,0|2,0,0]=4 15272 B18R2.269 Fc1cccc(c1)OCCc2ccc(cc2)Cl 34a_100000210426_100011713675 [0,2,0,0,0,0|2,0,0]=4 15273 B18R2.269 Fc1cccc(c1)OCCc2ccc(cc2)Cl 7a_100000210426_100011713675 [0,2,0,0,0,0|2,0,0]=4 15274 B18R2.269 Fc1cccc(c1)SCCc2ccc(cc2)Br 62a_100000685547_100011740612 [0,2,0,0,0,0|2,0,0]=4 15275 B18R2.269 Fc1cccc(c1)SCCc2ccc(cc2)Br 62a_100011740612_100000685547 [0,2,0,0,0,0|2,0,0]=4 15276 B18R2.269 Fc1cccc(c1)SCCc2ccc(cc2)Cl 62a_100000685547_100011713675 [0,2,0,0,0,0|2,0,0]=4 15277 B18R2.269 Fc1cccc(c1)SCCc2ccc(cc2)Cl 62a_100011713675_100000685547 [0,2,0,0,0,0|2,0,0]=4 15278 B18R2.269 Fc1cccc(n1)CNCc2ccc(cc2)Br 2230a_100000174875_100009819644 [0,2,0,0,0,0|2,0,0]=4 15279 B18R2.269 Fc1cccc(n1)CNCc2ccc(cc2)Br 2230a_100015188798_100011217064 [0,2,0,0,0,0|2,0,0]=4 15280 B18R2.269 Fc1cccc(n1)CNCc2ccc(cc2)Br 270004a_100000174875_100000050434 [0,2,0,0,0,0|2,0,0]=4 15281 B18R2.269 Fc1cccc(n1)CNCc2ccc(cc2)Br 34a_100000174875_100009819644 [0,2,0,0,0,0|2,0,0]=4 15282 B18R2.269 Fc1cccc(n1)CNCc2ccc(cc2)Br 34a_100015188798_100000189115 [0,2,0,0,0,0|2,0,0]=4 15283 B18R2.269 Fc1cccc(n1)CNCc2ccc(cc2)Cl 2230a_100000174871_100009819644 [0,2,0,0,0,0|2,0,0]=4 15284 B18R2.269 Fc1cccc(n1)CNCc2ccc(cc2)Cl 2230a_100015188798_100000694040 [0,2,0,0,0,0|2,0,0]=4 15285 B18R2.269 Fc1cccc(n1)CNCc2ccc(cc2)Cl 270004a_100000174871_100000050434 [0,2,0,0,0,0|2,0,0]=4 15286 B18R2.269 Fc1cccc(n1)CNCc2ccc(cc2)Cl 34a_100000174871_100009819644 [0,2,0,0,0,0|2,0,0]=4 15287 B18R2.269 Fc1cccc(n1)CNCc2ccc(cc2)Cl 34a_100015188798_100000694040 [0,2,0,0,0,0|2,0,0]=4 15288 B18R2.269 Fc1cccc(n1)CNCc2ccc(cc2)I 2230a_100015188798_100000189116 [0,2,0,0,0,0|2,0,0]=4 15289 B18R2.269 Fc1cccc(n1)CNCc2ccc(cc2)I 2230a_100016989417_100009819644 [0,2,0,0,0,0|2,0,0]=4 15290 B18R2.269 Fc1cccc(n1)CNCc2ccc(cc2)I 270004a_100016989417_100000050434 [0,2,0,0,0,0|2,0,0]=4 15291 B18R2.269 Fc1cccc(n1)CNCc2ccc(cc2)I 34a_100015188798_100000189116 [0,2,0,0,0,0|2,0,0]=4 15292 B18R2.269 Fc1cccc(n1)CNCc2ccc(cc2)I 34a_100016989417_100009819644 [0,2,0,0,0,0|2,0,0]=4 15293 B18R2.269 Fc1cccc(n1)COCc2ccc(cc2)Br 34a_100000086748_100000189115 [0,2,0,0,0,0|1,0,0]=3 15294 B18R2.269 Fc1cccc(n1)COCc2ccc(cc2)Br 34a_100000695286_100009819644 [0,2,0,0,0,0|1,0,0]=3 15295 B18R2.269 Fc1cccc(n1)COCc2ccc(cc2)Cl 34a_100000086748_100000694040 [0,2,0,0,0,0|1,0,0]=3 15296 B18R2.269 Fc1cccc(n1)COCc2ccc(cc2)Cl 34a_100000211118_100009819644 [0,2,0,0,0,0|1,0,0]=3 15297 B18R2.269 Fc1cccc(n1)COCc2ccc(cc2)Cl 7a_100000211118_100009819644 [0,2,0,0,0,0|1,0,0]=3 15298 B18R2.269 Fc1cccc(n1)COCc2ccc(cc2)I 34a_100000086748_100000189116 [0,2,0,0,0,0|1,0,0]=3 15299 B18R2.269 Fc1cccc(n1)COCc2ccc(cc2)I 34a_100000690907_100009819644 [0,2,0,0,0,0|1,0,0]=3 15300 B18R2.269 Fc1cccc(n1)COCc2ccc(cc2)I 7a_100000690907_100009819644 [0,2,0,0,0,0|1,0,0]=3 15301 B18R2.269 Fc1cccc(n1)COCc2ccc(cn2)Br 34a_100000086748_100000702658 [0,2,0,0,0,0|2,0,0]=4 15302 B18R2.269 Fc1cccc(n1)COCc2ccc(cn2)Br 34a_100000754261_100009819644 [0,2,0,0,0,0|2,0,0]=4 15303 B18R2.269 Fc1cccc(n1)COCc2ccc(cn2)Cl 34a_100000086748_100012066911 [0,2,0,0,0,0|2,0,0]=4 15304 B18R2.269 Fc1cccc(n1)COCc2ccc(cn2)Cl 34a_100000703999_100009819644 [0,2,0,0,0,0|2,0,0]=4 15305 B18R2.269 Fc1cccc(n1)COCc2ccc(nc2)Br 34a_100000086748_100009831999 [0,2,0,0,0,0|2,0,0]=4 15306 B18R2.269 Fc1cccc(n1)COCc2ccc(nc2)Br 34a_100009816760_100009819644 [0,2,0,0,0,0|2,0,0]=4 15307 B18R2.269 Fc1cccc(n1)COCc2ccc(nc2)Br 7a_100009816760_100009819644 [0,2,0,0,0,0|2,0,0]=4 15308 B18R2.269 Fc1cccc(n1)COCc2ccc(nc2)Cl 34a_100000086748_100000735431 [0,2,0,0,0,0|2,0,0]=4 15309 B18R2.269 Fc1cccc(n1)COCc2ccc(nc2)Cl 34a_100000755211_100009819644 [0,2,0,0,0,0|2,0,0]=4 15310 B18R2.269 Fc1cccc(n1)COCc2ccc(nc2)Cl 7a_100000755211_100009819644 [0,2,0,0,0,0|2,0,0]=4 15311 B18R2.269 Fc1cccc(n1)CSCc2ccc(cc2)Br 62a_100000189115_100009819644 [0,2,0,0,0,0|1,1,0]=4 15312 B18R2.269 Fc1cccc(n1)CSCc2ccc(cc2)Br 62a_100009819644_100000189115 [0,2,0,0,0,0|1,1,0]=4 15313 B18R2.269 Fc1cccc(n1)CSCc2ccc(cc2)Cl 62a_100000187161_100009819644 [0,2,0,0,0,0|1,1,0]=4 15314 B18R2.269 Fc1cccc(n1)CSCc2ccc(cc2)Cl 62a_100009819644_100000187161 [0,2,0,0,0,0|1,1,0]=4 15315 B18R2.269 Fc1cccc(n1)CSCc2ccc(cc2)I 62a_100000189116_100009819644 [0,2,0,0,0,0|1,1,0]=4 15316 B18R2.269 Fc1cccc(n1)CSCc2ccc(cc2)I 62a_100009819644_100000189116 [0,2,0,0,0,0|1,1,0]=4 15317 B18R2.269 Fc1cncc(c1)CNCc2ccc(cc2)Br 207a_100000174875_100011361476 [0,2,0,0,0,0|2,0,0]=4 15318 B18R2.269 Fc1cncc(c1)CNCc2ccc(cc2)Br 207a_100011962886_100000186029 [0,2,0,0,0,0|2,0,0]=4 15319 B18R2.269 Fc1cncc(c1)CNCc2ccc(cc2)Br 2230a_100000174875_100000725299 [0,2,0,0,0,0|2,0,0]=4 15320 B18R2.269 Fc1cncc(c1)CNCc2ccc(cc2)Br 2230a_100011962886_100011217064 [0,2,0,0,0,0|2,0,0]=4 15321 B18R2.269 Fc1cncc(c1)CNCc2ccc(cc2)Br 270004a_100000174875_100011361476 [0,2,0,0,0,0|2,0,0]=4 15322 B18R2.269 Fc1cncc(c1)CNCc2ccc(cc2)Br 270004a_100011962886_100000186029 [0,2,0,0,0,0|2,0,0]=4 15323 B18R2.269 Fc1cncc(c1)CNCc2ccc(cc2)Br 34a_100000174875_100000725299 [0,2,0,0,0,0|2,0,0]=4 15324 B18R2.269 Fc1cncc(c1)CNCc2ccc(cc2)Br 34a_100011962886_100000189115 [0,2,0,0,0,0|2,0,0]=4 15325 B18R2.269 Fc1cncc(c1)CNCc2ccc(cc2)Cl 207a_100000174871_100011361476 [0,2,0,0,0,0|2,0,0]=4 15326 B18R2.269 Fc1cncc(c1)CNCc2ccc(cc2)Cl 207a_100011962886_100000189385 [0,2,0,0,0,0|2,0,0]=4 15327 B18R2.269 Fc1cncc(c1)CNCc2ccc(cc2)Cl 2230a_100000174871_100000725299 [0,2,0,0,0,0|2,0,0]=4 15328 B18R2.269 Fc1cncc(c1)CNCc2ccc(cc2)Cl 2230a_100011962886_100000694040 [0,2,0,0,0,0|2,0,0]=4 15329 B18R2.269 Fc1cncc(c1)CNCc2ccc(cc2)Cl 270004a_100000174871_100011361476 [0,2,0,0,0,0|2,0,0]=4 15330 B18R2.269 Fc1cncc(c1)CNCc2ccc(cc2)Cl 270004a_100011962886_100000189385 [0,2,0,0,0,0|2,0,0]=4 15331 B18R2.269 Fc1cncc(c1)CNCc2ccc(cc2)Cl 34a_100000174871_100000725299 [0,2,0,0,0,0|2,0,0]=4 15332 B18R2.269 Fc1cncc(c1)CNCc2ccc(cc2)Cl 34a_100011962886_100000694040 [0,2,0,0,0,0|2,0,0]=4 15333 B18R2.269 Fc1cncc(c1)CNCc2ccc(cc2)I 207a_100011962886_100000188517 [0,2,0,0,0,0|2,0,0]=4 15334 B18R2.269 Fc1cncc(c1)CNCc2ccc(cc2)I 207a_100016989417_100011361476 [0,2,0,0,0,0|2,0,0]=4 15335 B18R2.269 Fc1cncc(c1)CNCc2ccc(cc2)I 2230a_100011962886_100000189116 [0,2,0,0,0,0|2,0,0]=4 15336 B18R2.269 Fc1cncc(c1)CNCc2ccc(cc2)I 2230a_100016989417_100000725299 [0,2,0,0,0,0|2,0,0]=4 15337 B18R2.269 Fc1cncc(c1)CNCc2ccc(cc2)I 270004a_100016989417_100011361476 [0,2,0,0,0,0|2,0,0]=4 15338 B18R2.269 Fc1cncc(c1)CNCc2ccc(cc2)I 34a_100011962886_100000189116 [0,2,0,0,0,0|2,0,0]=4 15339 B18R2.269 Fc1cncc(c1)CNCc2ccc(cc2)I 34a_100016989417_100000725299 [0,2,0,0,0,0|2,0,0]=4 15340 B18R2.269 Fc1cncc(c1)COCc2ccc(cc2)Br 34a_100000695286_100000725299 [0,2,0,0,0,0|1,0,0]=3 15341 B18R2.269 Fc1cncc(c1)COCc2ccc(cc2)Br 34a_100011962875_100000189115 [0,2,0,0,0,0|1,0,0]=3 15342 B18R2.269 Fc1cncc(c1)COCc2ccc(cc2)Br 7a_100011962875_100011217064 [0,2,0,0,0,0|1,0,0]=3 15343 B18R2.269 Fc1cncc(c1)COCc2ccc(cc2)Cl 34a_100000211118_100000725299 [0,2,0,0,0,0|1,0,0]=3 15344 B18R2.269 Fc1cncc(c1)COCc2ccc(cc2)Cl 34a_100011962875_100000694040 [0,2,0,0,0,0|1,0,0]=3 15345 B18R2.269 Fc1cncc(c1)COCc2ccc(cc2)Cl 7a_100000211118_100000725299 [0,2,0,0,0,0|1,0,0]=3 15346 B18R2.269 Fc1cncc(c1)COCc2ccc(cc2)Cl 7a_100011962875_100000187161 [0,2,0,0,0,0|1,0,0]=3 15347 B18R2.269 Fc1cncc(c1)COCc2ccc(cc2)I 34a_100000690907_100000725299 [0,2,0,0,0,0|1,0,0]=3 15348 B18R2.269 Fc1cncc(c1)COCc2ccc(cc2)I 34a_100011962875_100000189116 [0,2,0,0,0,0|1,0,0]=3 15349 B18R2.269 Fc1cncc(c1)COCc2ccc(cc2)I 7a_100000690907_100000725299 [0,2,0,0,0,0|1,0,0]=3 15350 B18R2.269 Fc1cncc(c1)COCc2ccc(cc2)I 7a_100011962875_100000189116 [0,2,0,0,0,0|1,0,0]=3 15351 B18R2.269 Fc1cncc(c1)COCc2ccc(cn2)Br 34a_100000754261_100000725299 [0,2,0,0,0,0|2,0,0]=4 15352 B18R2.269 Fc1cncc(c1)COCc2ccc(cn2)Br 34a_100011962875_100000702658 [0,2,0,0,0,0|2,0,0]=4 15353 B18R2.269 Fc1cncc(c1)COCc2ccc(cn2)Br 7a_100011962875_100000702658 [0,2,0,0,0,0|2,0,0]=4 15354 B18R2.269 Fc1cncc(c1)COCc2ccc(cn2)Cl 34a_100000703999_100000725299 [0,2,0,0,0,0|2,0,0]=4 15355 B18R2.269 Fc1cncc(c1)COCc2ccc(cn2)Cl 34a_100011962875_100012066911 [0,2,0,0,0,0|2,0,0]=4 15356 B18R2.269 Fc1cncc(c1)COCc2ccc(cn2)Cl 7a_100011962875_100012066911 [0,2,0,0,0,0|2,0,0]=4 15357 B18R2.269 Fc1cncc(c1)COCc2ccc(nc2)Br 34a_100009816760_100000725299 [0,2,0,0,0,0|2,0,0]=4 15358 B18R2.269 Fc1cncc(c1)COCc2ccc(nc2)Br 34a_100011962875_100009831999 [0,2,0,0,0,0|2,0,0]=4 15359 B18R2.269 Fc1cncc(c1)COCc2ccc(nc2)Br 7a_100009816760_100000725299 [0,2,0,0,0,0|2,0,0]=4 15360 B18R2.269 Fc1cncc(c1)COCc2ccc(nc2)Br 7a_100011962875_100009831999 [0,2,0,0,0,0|2,0,0]=4 15361 B18R2.269 Fc1cncc(c1)COCc2ccc(nc2)Cl 34a_100000755211_100000725299 [0,2,0,0,0,0|2,0,0]=4 15362 B18R2.269 Fc1cncc(c1)COCc2ccc(nc2)Cl 34a_100011962875_100000735431 [0,2,0,0,0,0|2,0,0]=4 15363 B18R2.269 Fc1cncc(c1)COCc2ccc(nc2)Cl 7a_100000755211_100000725299 [0,2,0,0,0,0|2,0,0]=4 15364 B18R2.269 Fc1cncc(c1)COCc2ccc(nc2)Cl 7a_100011962875_100000735431 [0,2,0,0,0,0|2,0,0]=4 15365 B18R2.269 Fc1cncc(c1)COCc2ccc(nc2)F 34a_100000079959_100000725299 [0,2,0,0,0,0|2,0,0]=4 15366 B18R2.269 Fc1cncc(c1)COCc2ccc(nc2)F 34a_100011962875_100000099788 [0,2,0,0,0,0|2,0,0]=4 15367 B18R2.269 Fc1cncc(c1)COCc2ccc(nc2)F 7a_100011962875_100009820150 [0,2,0,0,0,0|2,0,0]=4 15368 B18R2.269 Fc1cncc(c1)CSCc2ccc(cc2)Br 62a_100000189115_100000725299 [0,2,0,0,0,0|1,1,0]=4 15369 B18R2.269 Fc1cncc(c1)CSCc2ccc(cc2)Br 62a_100000725299_100000189115 [0,2,0,0,0,0|1,1,0]=4 15370 B18R2.269 Fc1cncc(c1)CSCc2ccc(cc2)Cl 62a_100000187161_100000725299 [0,2,0,0,0,0|1,1,0]=4 15371 B18R2.269 Fc1cncc(c1)CSCc2ccc(cc2)Cl 62a_100000725299_100000187161 [0,2,0,0,0,0|1,1,0]=4 15372 B18R2.269 Fc1cncc(c1)CSCc2ccc(cc2)I 62a_100000189116_100000725299 [0,2,0,0,0,0|1,1,0]=4 15373 B18R2.269 Fc1cncc(c1)CSCc2ccc(cc2)I 62a_100000725299_100000189116 [0,2,0,0,0,0|1,1,0]=4 15374 B18R2.269 Ic1ccc(cc1)CNCc2cccc(c2)I 207a_100000106179_100000188517 [0,2,0,0,0,0|1,0,0]=3 15375 B18R2.269 Ic1ccc(cc1)CNCc2cccc(c2)I 207a_100016989417_100000014684 [0,2,0,0,0,0|1,0,0]=3 15376 B18R2.269 Ic1ccc(cc1)CNCc2cccc(c2)I 2230a_100000106179_100000189116 [0,2,0,0,0,0|1,0,0]=3 15377 B18R2.269 Ic1ccc(cc1)CNCc2cccc(c2)I 2230a_100016989417_100011218688 [0,2,0,0,0,0|1,0,0]=3 15378 B18R2.269 Ic1ccc(cc1)CNCc2cccc(c2)I 270004a_100016989417_100000014684 [0,2,0,0,0,0|1,0,0]=3 15379 B18R2.269 Ic1ccc(cc1)CNCc2cccc(c2)I 34a_100000106179_100000189116 [0,2,0,0,0,0|1,0,0]=3 15380 B18R2.269 Ic1ccc(cc1)CNCc2cccc(c2)I 34a_100016989417_100011218688 [0,2,0,0,0,0|1,0,0]=3 15381 B18R2.269 Ic1ccc(cc1)COCc2cccc(c2)I 34a_100000690907_100011218688 [0,2,0,0,0,0|0,0,0]=2 15382 B18R2.269 Ic1ccc(cc1)COCc2cccc(c2)I 34a_100011215336_100000189116 [0,2,0,0,0,0|0,0,0]=2 15383 B18R2.269 Ic1ccc(cc1)COCc2cccc(c2)I 7a_100000690907_100011218688 [0,2,0,0,0,0|0,0,0]=2 15384 B18R2.269 Ic1ccc(cc1)COCc2cccc(c2)I 7a_100011215336_100000189116 [0,2,0,0,0,0|0,0,0]=2 15385 B18R2.269 Ic1ccc(cc1)CSCc2cccc(c2)I 62a_100000189116_100011218688 [0,2,0,0,0,0|0,1,0]=3 15386 B18R2.269 Ic1ccc(cc1)CSCc2cccc(c2)I 62a_100011218688_100000189116 [0,2,0,0,0,0|0,1,0]=3 15387 B18R2.269 Nc1ccc(cc1)COCc2cc(ccn2)Br 34a_100011215238_100010173614 [0,2,0,0,0,0|1,0,0]=3 15388 B18R2.269 Nc1ccc(cc1)COCc2cc(ccn2)Cl 34a_100011215238_100016988179 [0,2,0,0,0,0|1,0,0]=3 15389 B18R2.269 Nc1ccc(cc1)COCc2cccc(c2)Br 34a_100011215238_100000698116 [0,2,0,0,0,0|0,0,0]=2 15390 B18R2.269 Nc1ccc(cc1)COCc2cccc(c2)Cl 34a_100011215238_100000187163 [0,2,0,0,0,0|0,0,0]=2 15391 B18R2.269 Nc1ccc(cc1)COCc2cccc(c2)F 34a_100011215238_100000187166 [0,2,0,0,0,0|0,0,0]=2 15392 B18R2.269 Nc1ccc(cc1)COCc2cccc(c2)I 34a_100011215238_100011218688 [0,2,0,0,0,0|0,0,0]=2 15393 B18R2.269 Nc1ccc(cc1)COCc2cccc(c2)O 34a_100011215238_100011660834 [0,2,0,0,0,0|0,0,0]=2 15394 B18R2.269 Nc1ccc(cc1)COCc2cccc(n2)Br 34a_100011215238_100009889011 [0,2,0,0,0,0|1,0,0]=3 15395 B18R2.269 Nc1ccc(cc1)COCc2cccc(n2)Cl 34a_100011215238_100000086093 [0,2,0,0,0,0|1,0,0]=3 15396 B18R2.269 Nc1ccc(cc1)COCc2cccc(n2)F 34a_100011215238_100009819644 [0,2,0,0,0,0|1,0,0]=3 15397 B18R2.269 Nc1ccc(cc1)COCc2ccnc(c2)Br 34a_100011215238_100010243470 [0,2,0,0,0,0|1,0,0]=3 15398 B18R2.269 Nc1ccc(cc1)COCc2ccnc(c2)Cl 34a_100011215238_100000764220 [0,2,0,0,0,0|1,0,0]=3 15399 B18R2.269 Nc1ccc(cc1)COCc2ccnc(n2)Cl 34a_100011215238_100000099655 [0,2,0,0,0,0|2,0,0]=4 15400 B18R2.269 Nc1ccc(cc1)COCc2cncc(c2)Br 34a_100011215238_100000738771 [0,2,0,0,0,0|1,0,0]=3 15401 B18R2.269 Nc1ccc(cc1)COCc2cncc(c2)Cl 34a_100011215238_100016992070 [0,2,0,0,0,0|1,0,0]=3 15402 B18R2.269 Nc1ccc(cc1)COCc2cncc(c2)F 34a_100011215238_100000725299 [0,2,0,0,0,0|1,0,0]=3 15403 B18R2.269 Nc1ccc(cc1)OCCc2cccc(c2)Br 34a_100000185829_100011740638 [0,2,0,0,0,0|2,0,0]=4 15404 B18R2.269 Nc1ccc(cc1)OCCc2cccc(c2)Cl 34a_100000185829_100011713710 [0,2,0,0,0,0|2,0,0]=4 15405 B18R2.269 Nc1ccc(cc1)OCCc2cccc(c2)F 34a_100000185829_100011217235 [0,2,0,0,0,0|2,0,0]=4 15406 B18R2.269 Nc1ccc(cc1)SCCc2cccc(c2)Br 62a_100000185761_100011740638 [0,2,0,0,0,0|2,0,0]=4 15407 B18R2.269 Nc1ccc(cc1)SCCc2cccc(c2)Br 62a_100011740638_100000185761 [0,2,0,0,0,0|2,0,0]=4 15408 B18R2.269 Nc1ccc(cc1)SCCc2cccc(c2)Cl 62a_100000185761_100011713710 [0,2,0,0,0,0|2,0,0]=4 15409 B18R2.269 Nc1ccc(cc1)SCCc2cccc(c2)Cl 62a_100011713710_100000185761 [0,2,0,0,0,0|2,0,0]=4 15410 B18R2.269 Nc1ccc(cc1)SCCc2cccc(c2)F 62a_100000185761_100011217235 [0,2,0,0,0,0|2,0,0]=4 15411 B18R2.269 Nc1ccc(cc1)SCCc2cccc(c2)F 62a_100011217235_100000185761 [0,2,0,0,0,0|2,0,0]=4 15412 B18R2.269 Nc1ccc(cn1)COCc2cc(ccn2)Br 34a_100000704267_100010173614 [0,2,0,0,0,0|2,0,0]=4 15413 B18R2.269 Nc1ccc(cn1)COCc2cc(ccn2)Cl 34a_100000704267_100016988179 [0,2,0,0,0,0|2,0,0]=4 15414 B18R2.269 Nc1ccc(cn1)COCc2cccc(c2)Br 34a_100000704267_100000698116 [0,2,0,0,0,0|1,0,0]=3 15415 B18R2.269 Nc1ccc(cn1)COCc2cccc(c2)Cl 34a_100000704267_100000187163 [0,2,0,0,0,0|1,0,0]=3 15416 B18R2.269 Nc1ccc(cn1)COCc2cccc(c2)F 34a_100000704267_100000187166 [0,2,0,0,0,0|1,0,0]=3 15417 B18R2.269 Nc1ccc(cn1)COCc2cccc(c2)I 34a_100000704267_100011218688 [0,2,0,0,0,0|1,0,0]=3 15418 B18R2.269 Nc1ccc(cn1)COCc2cccc(c2)O 34a_100000704267_100011660834 [0,2,0,0,0,0|1,0,0]=3 15419 B18R2.269 Nc1ccc(cn1)COCc2cccc(n2)Br 34a_100000704267_100009889011 [0,2,0,0,0,0|2,0,0]=4 15420 B18R2.269 Nc1ccc(cn1)COCc2cccc(n2)Cl 34a_100000704267_100000086093 [0,2,0,0,0,0|2,0,0]=4 15421 B18R2.269 Nc1ccc(cn1)COCc2cccc(n2)F 34a_100000704267_100009819644 [0,2,0,0,0,0|2,0,0]=4 15422 B18R2.269 Nc1ccc(cn1)COCc2ccnc(c2)Br 34a_100000704267_100010243470 [0,2,0,0,0,0|2,0,0]=4 15423 B18R2.269 Nc1ccc(cn1)COCc2ccnc(c2)Cl 34a_100000704267_100000764220 [0,2,0,0,0,0|2,0,0]=4 15424 B18R2.269 Nc1ccc(cn1)COCc2cncc(c2)Br 34a_100000704267_100000738771 [0,2,0,0,0,0|2,0,0]=4 15425 B18R2.269 Nc1ccc(cn1)COCc2cncc(c2)Cl 34a_100000704267_100016992070 [0,2,0,0,0,0|2,0,0]=4 15426 B18R2.269 Nc1ccc(cn1)COCc2cncc(c2)F 34a_100000704267_100000725299 [0,2,0,0,0,0|2,0,0]=4 15427 B18R2.269 Nc1ccc(nc1)COCc2cc(ccn2)Br 34a_100011998161_100010173614 [0,2,0,0,0,0|2,0,0]=4 15428 B18R2.269 Nc1ccc(nc1)COCc2cc(ccn2)Cl 34a_100011998161_100016988179 [0,2,0,0,0,0|2,0,0]=4 15429 B18R2.269 Nc1ccc(nc1)COCc2cccc(c2)Br 34a_100011998161_100000698116 [0,2,0,0,0,0|1,0,0]=3 15430 B18R2.269 Nc1ccc(nc1)COCc2cccc(c2)Cl 34a_100011998161_100000187163 [0,2,0,0,0,0|1,0,0]=3 15431 B18R2.269 Nc1ccc(nc1)COCc2cccc(c2)F 34a_100011998161_100000187166 [0,2,0,0,0,0|1,0,0]=3 15432 B18R2.269 Nc1ccc(nc1)COCc2cccc(c2)I 34a_100011998161_100011218688 [0,2,0,0,0,0|1,0,0]=3 15433 B18R2.269 Nc1ccc(nc1)COCc2cccc(c2)O 34a_100011998161_100011660834 [0,2,0,0,0,0|1,0,0]=3 15434 B18R2.269 Nc1ccc(nc1)COCc2cccc(n2)Br 34a_100011998161_100009889011 [0,2,0,0,0,0|2,0,0]=4 15435 B18R2.269 Nc1ccc(nc1)COCc2cccc(n2)Cl 34a_100011998161_100000086093 [0,2,0,0,0,0|2,0,0]=4 15436 B18R2.269 Nc1ccc(nc1)COCc2cccc(n2)F 34a_100011998161_100009819644 [0,2,0,0,0,0|2,0,0]=4 15437 B18R2.269 Nc1ccc(nc1)COCc2ccnc(c2)Br 34a_100011998161_100010243470 [0,2,0,0,0,0|2,0,0]=4 15438 B18R2.269 Nc1ccc(nc1)COCc2ccnc(c2)Cl 34a_100011998161_100000764220 [0,2,0,0,0,0|2,0,0]=4 15439 B18R2.269 Nc1ccc(nc1)COCc2cncc(c2)Br 34a_100011998161_100000738771 [0,2,0,0,0,0|2,0,0]=4 15440 B18R2.269 Nc1ccc(nc1)COCc2cncc(c2)Cl 34a_100011998161_100016992070 [0,2,0,0,0,0|2,0,0]=4 15441 B18R2.269 Nc1ccc(nc1)COCc2cncc(c2)F 34a_100011998161_100000725299 [0,2,0,0,0,0|2,0,0]=4 15442 B18R2.269 Nc1cccc(c1)COCc2ccc(cc2)Br 34a_100000211919_100000189115 [0,2,0,0,0,0|0,0,0]=2 15443 B18R2.269 Nc1cccc(c1)COCc2ccc(cc2)Cl 34a_100000211919_100000694040 [0,2,0,0,0,0|0,0,0]=2 15444 B18R2.269 Nc1cccc(c1)COCc2ccc(cc2)F 34a_100000211919_100000198546 [0,2,0,0,0,0|0,0,0]=2 15445 B18R2.269 Nc1cccc(c1)COCc2ccc(cc2)I 34a_100000211919_100000189116 [0,2,0,0,0,0|0,0,0]=2 15446 B18R2.269 Nc1cccc(c1)COCc2ccc(cn2)Br 34a_100000211919_100000702658 [0,2,0,0,0,0|1,0,0]=3 15447 B18R2.269 Nc1cccc(c1)COCc2ccc(cn2)Cl 34a_100000211919_100012066911 [0,2,0,0,0,0|1,0,0]=3 15448 B18R2.269 Nc1cccc(c1)COCc2ccc(cn2)F 34a_100000211919_100000703193 [0,2,0,0,0,0|1,0,0]=3 15449 B18R2.269 Nc1cccc(c1)COCc2ccc(nc2)Br 34a_100000211919_100009831999 [0,2,0,0,0,0|1,0,0]=3 15450 B18R2.269 Nc1cccc(c1)COCc2ccc(nc2)Cl 34a_100000211919_100000735431 [0,2,0,0,0,0|1,0,0]=3 15451 B18R2.269 Nc1cccc(c1)COCc2ccc(nc2)F 34a_100000211919_100000099788 [0,2,0,0,0,0|1,0,0]=3 15452 B18R2.269 Nc1cccc(c1)COCc2ccc(nn2)Cl 34a_100000211919_100016992710 [0,2,0,0,0,0|2,0,0]=4 15453 B18R2.269 Nc1cccc(c1)COCc2ncc(cn2)Br 34a_100000211919_100010064664 [0,2,0,0,0,0|2,0,0]=4 15454 B18R2.269 Nc1cccc(c1)OCCc2ccc(cc2)Br 34a_100000210217_100011740612 [0,2,0,0,0,0|2,0,0]=4 15455 B18R2.269 Nc1cccc(c1)OCCc2ccc(cc2)Cl 34a_100000210217_100011713675 [0,2,0,0,0,0|2,0,0]=4 15456 B18R2.269 Nc1cccc(c1)OCCc2ccc(cc2)F 34a_100000210217_100011217392 [0,2,0,0,0,0|2,0,0]=4 15457 B18R2.269 Nc1cccc(c1)SCCc2ccc(cc2)Br 62a_100000210019_100011740612 [0,2,0,0,0,0|2,0,0]=4 15458 B18R2.269 Nc1cccc(c1)SCCc2ccc(cc2)Br 62a_100011740612_100000210019 [0,2,0,0,0,0|2,0,0]=4 15459 B18R2.269 Nc1cccc(c1)SCCc2ccc(cc2)Cl 62a_100000210019_100011713675 [0,2,0,0,0,0|2,0,0]=4 15460 B18R2.269 Nc1cccc(c1)SCCc2ccc(cc2)Cl 62a_100011713675_100000210019 [0,2,0,0,0,0|2,0,0]=4 15461 B18R2.269 Nc1cccc(c1)SCCc2ccc(cc2)F 62a_100000210019_100011217392 [0,2,0,0,0,0|2,0,0]=4 15462 B18R2.269 Nc1cccc(c1)SCCc2ccc(cc2)F 62a_100011217392_100000210019 [0,2,0,0,0,0|2,0,0]=4 15463 B18R2.269 Nc1cccc(c1)SCCc2ccc(cc2)O 62a_100000210019_100009816426 [0,2,0,0,0,0|2,0,0]=4 15464 B18R2.269 Nc1cccc(c1)SCCc2ccc(cc2)O 62a_100009816426_100000210019 [0,2,0,0,0,0|2,0,0]=4 15465 B18R2.269 Nc1ccnc(c1)COCc2ccc(cc2)Br 34a_100000692640_100000189115 [0,2,0,0,0,0|1,0,0]=3 15466 B18R2.269 Nc1ccnc(c1)COCc2ccc(cc2)Cl 34a_100000692640_100000694040 [0,2,0,0,0,0|1,0,0]=3 15467 B18R2.269 Nc1ccnc(c1)COCc2ccc(cc2)F 34a_100000692640_100000198546 [0,2,0,0,0,0|1,0,0]=3 15468 B18R2.269 Nc1ccnc(c1)COCc2ccc(cc2)I 34a_100000692640_100000189116 [0,2,0,0,0,0|1,0,0]=3 15469 B18R2.269 Nc1ccnc(c1)COCc2ccc(cn2)Br 34a_100000692640_100000702658 [0,2,0,0,0,0|2,0,0]=4 15470 B18R2.269 Nc1ccnc(c1)COCc2ccc(cn2)Cl 34a_100000692640_100012066911 [0,2,0,0,0,0|2,0,0]=4 15471 B18R2.269 Nc1ccnc(c1)COCc2ccc(cn2)F 34a_100000692640_100000703193 [0,2,0,0,0,0|2,0,0]=4 15472 B18R2.269 Nc1ccnc(c1)COCc2ccc(nc2)Br 34a_100000692640_100009831999 [0,2,0,0,0,0|2,0,0]=4 15473 B18R2.269 Nc1ccnc(c1)COCc2ccc(nc2)Cl 34a_100000692640_100000735431 [0,2,0,0,0,0|2,0,0]=4 15474 B18R2.269 Nc1ccnc(c1)COCc2ccc(nc2)F 34a_100000692640_100000099788 [0,2,0,0,0,0|2,0,0]=4 15475 B18R2.269 Nc1cncc(c1)COCc2ccc(cc2)Br 34a_100000085308_100000189115 [0,2,0,0,0,0|1,0,0]=3 15476 B18R2.269 Nc1cncc(c1)COCc2ccc(cc2)Cl 34a_100000085308_100000694040 [0,2,0,0,0,0|1,0,0]=3 15477 B18R2.269 Nc1cncc(c1)COCc2ccc(cc2)F 34a_100000085308_100000198546 [0,2,0,0,0,0|1,0,0]=3 15478 B18R2.269 Nc1cncc(c1)COCc2ccc(cc2)I 34a_100000085308_100000189116 [0,2,0,0,0,0|1,0,0]=3 15479 B18R2.269 Nc1cncc(c1)COCc2ccc(cn2)Br 34a_100000085308_100000702658 [0,2,0,0,0,0|2,0,0]=4 15480 B18R2.269 Nc1cncc(c1)COCc2ccc(cn2)Cl 34a_100000085308_100012066911 [0,2,0,0,0,0|2,0,0]=4 15481 B18R2.269 Nc1cncc(c1)COCc2ccc(cn2)F 34a_100000085308_100000703193 [0,2,0,0,0,0|2,0,0]=4 15482 B18R2.269 Nc1cncc(c1)COCc2ccc(nc2)Br 34a_100000085308_100009831999 [0,2,0,0,0,0|2,0,0]=4 15483 B18R2.269 Nc1cncc(c1)COCc2ccc(nc2)Cl 34a_100000085308_100000735431 [0,2,0,0,0,0|2,0,0]=4 15484 B18R2.269 Nc1cncc(c1)COCc2ccc(nc2)F 34a_100000085308_100000099788 [0,2,0,0,0,0|2,0,0]=4 15485 B18R2.269 O=c1ccc(c[nH]1)COCc2cc(ccn2)Br 34a_100011999846_100010173614 [0,2,0,0,0,0|2,0,0]=4 15486 B18R2.269 O=c1ccc(c[nH]1)COCc2cc(ccn2)Cl 34a_100011999846_100016988179 [0,2,0,0,0,0|2,0,0]=4 15487 B18R2.269 O=c1ccc(c[nH]1)COCc2cccc(c2)Br 34a_100011999846_100000698116 [0,2,0,0,0,0|1,0,0]=3 15488 B18R2.269 O=c1ccc(c[nH]1)COCc2cccc(c2)Cl 34a_100011999846_100000187163 [0,2,0,0,0,0|1,0,0]=3 15489 B18R2.269 O=c1ccc(c[nH]1)COCc2cccc(c2)F 34a_100011999846_100000187166 [0,2,0,0,0,0|1,0,0]=3 15490 B18R2.269 O=c1ccc(c[nH]1)COCc2cccc(c2)I 34a_100011999846_100011218688 [0,2,0,0,0,0|1,0,0]=3 15491 B18R2.269 O=c1ccc(c[nH]1)COCc2cccc(c2)O 34a_100011999846_100011660834 [0,2,0,0,0,0|1,0,0]=3 15492 B18R2.269 O=c1ccc(c[nH]1)COCc2cccc(n2)Br 34a_100011999846_100009889011 [0,2,0,0,0,0|2,0,0]=4 15493 B18R2.269 O=c1ccc(c[nH]1)COCc2cccc(n2)Cl 34a_100011999846_100000086093 [0,2,0,0,0,0|2,0,0]=4 15494 B18R2.269 O=c1ccc(c[nH]1)COCc2cccc(n2)F 34a_100011999846_100009819644 [0,2,0,0,0,0|2,0,0]=4 15495 B18R2.269 O=c1ccc(c[nH]1)COCc2ccnc(c2)Br 34a_100011999846_100010243470 [0,2,0,0,0,0|2,0,0]=4 15496 B18R2.269 O=c1ccc(c[nH]1)COCc2ccnc(c2)Cl 34a_100011999846_100000764220 [0,2,0,0,0,0|2,0,0]=4 15497 B18R2.269 O=c1ccc(c[nH]1)COCc2cncc(c2)Br 34a_100011999846_100000738771 [0,2,0,0,0,0|2,0,0]=4 15498 B18R2.269 O=c1ccc(c[nH]1)COCc2cncc(c2)Cl 34a_100011999846_100016992070 [0,2,0,0,0,0|2,0,0]=4 15499 B18R2.269 O=c1ccc(c[nH]1)COCc2cncc(c2)F 34a_100011999846_100000725299 [0,2,0,0,0,0|2,0,0]=4 15500 B18R2.269 O=c1cccc([nH]1)CNCc2ccc(cc2)Br 207a_100000174875_100011935257 [0,2,0,0,0,0|2,0,0]=4 15501 B18R2.269 O=c1cccc([nH]1)CNCc2ccc(cc2)Br 2230a_100000696482_100011217064 [0,2,0,0,0,0|2,0,0]=4 15502 B18R2.269 O=c1cccc([nH]1)CNCc2ccc(cc2)Cl 207a_100000174871_100011935257 [0,2,0,0,0,0|2,0,0]=4 15503 B18R2.269 O=c1cccc([nH]1)CNCc2ccc(cc2)Cl 2230a_100000696482_100000694040 [0,2,0,0,0,0|2,0,0]=4 15504 B18R2.269 O=c1cccc([nH]1)CNCc2ccc(cc2)F 207a_100000174882_100011935257 [0,2,0,0,0,0|2,0,0]=4 15505 B18R2.269 O=c1cccc([nH]1)CNCc2ccc(cc2)F 2230a_100000696482_100000198546 [0,2,0,0,0,0|2,0,0]=4 15506 B18R2.269 O=c1cccc([nH]1)CNCc2ccc(cc2)I 207a_100016989417_100011935257 [0,2,0,0,0,0|2,0,0]=4 15507 B18R2.269 O=c1cccc([nH]1)CNCc2ccc(cc2)I 2230a_100000696482_100000189116 [0,2,0,0,0,0|2,0,0]=4 15508 B18R2.269 Oc1cc(ccn1)CNCc2ccc(cc2)Br 207a_100000174875_100000688113 [0,2,0,0,0,0|2,0,0]=4 15509 B18R2.269 Oc1cc(ccn1)CNCc2ccc(cc2)Cl 207a_100000174871_100000688113 [0,2,0,0,0,0|2,0,0]=4 15510 B18R2.269 Oc1cc(ccn1)CNCc2ccc(cc2)F 207a_100000174882_100000688113 [0,2,0,0,0,0|2,0,0]=4 15511 B18R2.269 Oc1cc(ccn1)CNCc2ccc(cc2)I 207a_100016989417_100000688113 [0,2,0,0,0,0|2,0,0]=4 15512 B18R2.269 Oc1ccc(cc1)CCOc2cccc(c2)Br 7a_100000210342_100009816426 [0,2,0,0,0,0|2,0,0]=4 15513 B18R2.269 Oc1ccc(cc1)CCOc2cccc(c2)Cl 7a_100000210295_100009816426 [0,2,0,0,0,0|2,0,0]=4 15514 B18R2.269 Oc1ccc(cc1)CCOc2cccc(c2)F 7a_100000210426_100009816426 [0,2,0,0,0,0|2,0,0]=4 15515 B18R2.269 Oc1ccc(cc1)CCOc2cccc(c2)I 7a_100000211634_100009816426 [0,2,0,0,0,0|2,0,0]=4 15516 B18R2.269 Oc1ccc(cc1)CCSc2cccc(c2)Br 62a_100000691529_100009816426 [0,2,0,0,0,0|2,0,0]=4 15517 B18R2.269 Oc1ccc(cc1)CCSc2cccc(c2)Br 62a_100009816426_100000691529 [0,2,0,0,0,0|2,0,0]=4 15518 B18R2.269 Oc1ccc(cc1)CCSc2cccc(c2)Cl 62a_100000699651_100009816426 [0,2,0,0,0,0|2,0,0]=4 15519 B18R2.269 Oc1ccc(cc1)CCSc2cccc(c2)Cl 62a_100009816426_100000699651 [0,2,0,0,0,0|2,0,0]=4 15520 B18R2.269 Oc1ccc(cc1)CCSc2cccc(c2)F 62a_100000685547_100009816426 [0,2,0,0,0,0|2,0,0]=4 15521 B18R2.269 Oc1ccc(cc1)CCSc2cccc(c2)F 62a_100009816426_100000685547 [0,2,0,0,0,0|2,0,0]=4 15522 B18R2.269 Oc1ccc(cc1)CCSc2cccc(c2)O 62a_100009816426_100000211634 [0,2,0,0,0,0|2,0,0]=4 15523 B18R2.269 Oc1ccc(cc1)CCSc2cccc(c2)[S] 62a_100009816426_114929384022 [0,2,0,0,0,0|2,0,0]=4 15524 B18R2.269 Oc1ccc(cc1)CCSc2cccc(c2)[S] 62a_114929384022_100009816426 [0,2,0,0,0,0|2,0,0]=4 15525 B18R2.269 Oc1ccc(cc1)CNCc2cc(ccn2)Br 34a_100000185549_100010173614 [0,2,0,0,0,0|2,0,0]=4 15526 B18R2.269 Oc1ccc(cc1)CNCc2cc(ccn2)Cl 34a_100000185549_100016988179 [0,2,0,0,0,0|2,0,0]=4 15527 B18R2.269 Oc1ccc(cc1)CNCc2cccc(c2)Br 34a_100000185549_100000698116 [0,2,0,0,0,0|1,0,0]=3 15528 B18R2.269 Oc1ccc(cc1)CNCc2cccc(c2)Cl 34a_100000185549_100000187163 [0,2,0,0,0,0|1,0,0]=3 15529 B18R2.269 Oc1ccc(cc1)CNCc2cccc(c2)F 34a_100000185549_100000187166 [0,2,0,0,0,0|1,0,0]=3 15530 B18R2.269 Oc1ccc(cc1)CNCc2cccc(c2)I 34a_100000185549_100011218688 [0,2,0,0,0,0|1,0,0]=3 15531 B18R2.269 Oc1ccc(cc1)CNCc2cccc(c2)O 34a_100000185549_100011660834 [0,2,0,0,0,0|1,0,0]=3 15532 B18R2.269 Oc1ccc(cc1)CNCc2cccc(n2)Br 34a_100000185549_100009889011 [0,2,0,0,0,0|2,0,0]=4 15533 B18R2.269 Oc1ccc(cc1)CNCc2cccc(n2)Cl 34a_100000185549_100000086093 [0,2,0,0,0,0|2,0,0]=4 15534 B18R2.269 Oc1ccc(cc1)CNCc2cccc(n2)F 34a_100000185549_100009819644 [0,2,0,0,0,0|2,0,0]=4 15535 B18R2.269 Oc1ccc(cc1)CNCc2ccnc(c2)Br 34a_100000185549_100010243470 [0,2,0,0,0,0|2,0,0]=4 15536 B18R2.269 Oc1ccc(cc1)CNCc2ccnc(c2)Cl 34a_100000185549_100000764220 [0,2,0,0,0,0|2,0,0]=4 15537 B18R2.269 Oc1ccc(cc1)CNCc2cncc(c2)Br 34a_100000185549_100000738771 [0,2,0,0,0,0|2,0,0]=4 15538 B18R2.269 Oc1ccc(cc1)CNCc2cncc(c2)Cl 34a_100000185549_100016992070 [0,2,0,0,0,0|2,0,0]=4 15539 B18R2.269 Oc1ccc(cc1)CNCc2cncc(c2)F 34a_100000185549_100000725299 [0,2,0,0,0,0|2,0,0]=4 15540 B18R2.269 Oc1ccc(cc1)NCCc2cccc(c2)Br 34a_100000185829_100011740638 [0,2,0,0,0,0|2,0,0]=4 15541 B18R2.269 Oc1ccc(cc1)NCCc2cccc(c2)Cl 34a_100000185829_100011713710 [0,2,0,0,0,0|2,0,0]=4 15542 B18R2.269 Oc1ccc(cc1)NCCc2cccc(c2)F 34a_100000185829_100011217235 [0,2,0,0,0,0|2,0,0]=4 15543 B18R2.269 Oc1ccc(cc1)SCCc2cccc(c2)Br 62a_100011740638_100000185759 [0,2,0,0,0,0|2,0,0]=4 15544 B18R2.269 Oc1ccc(cc1)SCCc2cccc(c2)Cl 62a_100011713710_100000185759 [0,2,0,0,0,0|2,0,0]=4 15545 B18R2.269 Oc1ccc(cc1)SCCc2cccc(c2)F 62a_100011217235_100000185759 [0,2,0,0,0,0|2,0,0]=4 15546 B18R2.269 Oc1ccc(cn1)CNCc2cccc(c2)Br 207a_100000174977_100011361521 [0,2,0,0,0,0|2,0,0]=4 15547 B18R2.269 Oc1ccc(cn1)CNCc2cccc(c2)Br 2230a_100000757128_100000698116 [0,2,0,0,0,0|2,0,0]=4 15548 B18R2.269 Oc1ccc(cn1)CNCc2cccc(c2)Cl 207a_100000174878_100011361521 [0,2,0,0,0,0|2,0,0]=4 15549 B18R2.269 Oc1ccc(cn1)CNCc2cccc(c2)Cl 2230a_100000757128_100000181238 [0,2,0,0,0,0|2,0,0]=4 15550 B18R2.269 Oc1ccc(cn1)CNCc2cccc(c2)F 207a_100000174948_100011361521 [0,2,0,0,0,0|2,0,0]=4 15551 B18R2.269 Oc1ccc(cn1)CNCc2cccc(c2)F 2230a_100000757128_100000230114 [0,2,0,0,0,0|2,0,0]=4 15552 B18R2.269 Oc1ccc(cn1)CNCc2cccc(c2)I 207a_100000106179_100011361521 [0,2,0,0,0,0|2,0,0]=4 15553 B18R2.269 Oc1ccc(cn1)CNCc2cccc(c2)I 2230a_100000757128_100011218688 [0,2,0,0,0,0|2,0,0]=4 15554 B18R2.269 Oc1cccc(c1)CNCc2ccc(cc2)Br 207a_100000174875_100000188321 [0,2,0,0,0,0|1,0,0]=3 15555 B18R2.269 Oc1cccc(c1)CNCc2ccc(cc2)Br 207a_100000743036_100000186029 [0,2,0,0,0,0|1,0,0]=3 15556 B18R2.269 Oc1cccc(c1)CNCc2ccc(cc2)Br 2230a_100000174875_100011660834 [0,2,0,0,0,0|1,0,0]=3 15557 B18R2.269 Oc1cccc(c1)CNCc2ccc(cc2)Br 2230a_100000743036_100011217064 [0,2,0,0,0,0|1,0,0]=3 15558 B18R2.269 Oc1cccc(c1)CNCc2ccc(cc2)Br 270004a_100000174875_100000188321 [0,2,0,0,0,0|1,0,0]=3 15559 B18R2.269 Oc1cccc(c1)CNCc2ccc(cc2)Br 270004a_100000743036_100000186029 [0,2,0,0,0,0|1,0,0]=3 15560 B18R2.269 Oc1cccc(c1)CNCc2ccc(cc2)Br 34a_100000174875_100011660834 [0,2,0,0,0,0|1,0,0]=3 15561 B18R2.269 Oc1cccc(c1)CNCc2ccc(cc2)Br 34a_100000743036_100000189115 [0,2,0,0,0,0|1,0,0]=3 15562 B18R2.269 Oc1cccc(c1)CNCc2ccc(cc2)Cl 207a_100000174871_100000188321 [0,2,0,0,0,0|1,0,0]=3 15563 B18R2.269 Oc1cccc(c1)CNCc2ccc(cc2)Cl 207a_100000743036_100000189385 [0,2,0,0,0,0|1,0,0]=3 15564 B18R2.269 Oc1cccc(c1)CNCc2ccc(cc2)Cl 2230a_100000174871_100011660834 [0,2,0,0,0,0|1,0,0]=3 15565 B18R2.269 Oc1cccc(c1)CNCc2ccc(cc2)Cl 2230a_100000743036_100000694040 [0,2,0,0,0,0|1,0,0]=3 15566 B18R2.269 Oc1cccc(c1)CNCc2ccc(cc2)Cl 270004a_100000174871_100000188321 [0,2,0,0,0,0|1,0,0]=3 15567 B18R2.269 Oc1cccc(c1)CNCc2ccc(cc2)Cl 270004a_100000743036_100000189385 [0,2,0,0,0,0|1,0,0]=3 15568 B18R2.269 Oc1cccc(c1)CNCc2ccc(cc2)Cl 34a_100000174871_100011660834 [0,2,0,0,0,0|1,0,0]=3 15569 B18R2.269 Oc1cccc(c1)CNCc2ccc(cc2)Cl 34a_100000743036_100000694040 [0,2,0,0,0,0|1,0,0]=3 15570 B18R2.269 Oc1cccc(c1)CNCc2ccc(cc2)F 207a_100000174882_100000188321 [0,2,0,0,0,0|1,0,0]=3 15571 B18R2.269 Oc1cccc(c1)CNCc2ccc(cc2)F 207a_100000743036_100000210084 [0,2,0,0,0,0|1,0,0]=3 15572 B18R2.269 Oc1cccc(c1)CNCc2ccc(cc2)F 2230a_100000174882_100011660834 [0,2,0,0,0,0|1,0,0]=3 15573 B18R2.269 Oc1cccc(c1)CNCc2ccc(cc2)F 2230a_100000743036_100000198546 [0,2,0,0,0,0|1,0,0]=3 15574 B18R2.269 Oc1cccc(c1)CNCc2ccc(cc2)F 270004a_100000174882_100000188321 [0,2,0,0,0,0|1,0,0]=3 15575 B18R2.269 Oc1cccc(c1)CNCc2ccc(cc2)F 270004a_100000743036_100000210084 [0,2,0,0,0,0|1,0,0]=3 15576 B18R2.269 Oc1cccc(c1)CNCc2ccc(cc2)F 34a_100000174882_100011660834 [0,2,0,0,0,0|1,0,0]=3 15577 B18R2.269 Oc1cccc(c1)CNCc2ccc(cc2)F 34a_100000743036_100000198546 [0,2,0,0,0,0|1,0,0]=3 15578 B18R2.269 Oc1cccc(c1)CNCc2ccc(cc2)I 207a_100000743036_100000188517 [0,2,0,0,0,0|1,0,0]=3 15579 B18R2.269 Oc1cccc(c1)CNCc2ccc(cc2)I 207a_100016989417_100000188321 [0,2,0,0,0,0|1,0,0]=3 15580 B18R2.269 Oc1cccc(c1)CNCc2ccc(cc2)I 2230a_100000743036_100000189116 [0,2,0,0,0,0|1,0,0]=3 15581 B18R2.269 Oc1cccc(c1)CNCc2ccc(cc2)I 2230a_100016989417_100011660834 [0,2,0,0,0,0|1,0,0]=3 15582 B18R2.269 Oc1cccc(c1)CNCc2ccc(cc2)I 270004a_100016989417_100000188321 [0,2,0,0,0,0|1,0,0]=3 15583 B18R2.269 Oc1cccc(c1)CNCc2ccc(cc2)I 34a_100000743036_100000189116 [0,2,0,0,0,0|1,0,0]=3 15584 B18R2.269 Oc1cccc(c1)CNCc2ccc(cc2)I 34a_100016989417_100011660834 [0,2,0,0,0,0|1,0,0]=3 15585 B18R2.269 Oc1cccc(c1)CNCc2ccc(cn2)Br 207a_100000743036_100000754260 [0,2,0,0,0,0|2,0,0]=4 15586 B18R2.269 Oc1cccc(c1)CNCc2ccc(cn2)Br 2230a_100000743036_100000702658 [0,2,0,0,0,0|2,0,0]=4 15587 B18R2.269 Oc1cccc(c1)CNCc2ccc(cn2)Br 270004a_100000743036_100000754260 [0,2,0,0,0,0|2,0,0]=4 15588 B18R2.269 Oc1cccc(c1)CNCc2ccc(cn2)Br 34a_100000743036_100000702658 [0,2,0,0,0,0|2,0,0]=4 15589 B18R2.269 Oc1cccc(c1)CNCc2ccc(cn2)Br 34a_100015188789_100011660834 [0,2,0,0,0,0|2,0,0]=4 15590 B18R2.269 Oc1cccc(c1)CNCc2ccc(cn2)Cl 207a_100000743036_100011361569 [0,2,0,0,0,0|2,0,0]=4 15591 B18R2.269 Oc1cccc(c1)CNCc2ccc(cn2)Cl 2230a_100000743036_100012066911 [0,2,0,0,0,0|2,0,0]=4 15592 B18R2.269 Oc1cccc(c1)CNCc2ccc(cn2)Cl 270004a_100000697193_100000188321 [0,2,0,0,0,0|2,0,0]=4 15593 B18R2.269 Oc1cccc(c1)CNCc2ccc(cn2)Cl 270004a_100000743036_100011361569 [0,2,0,0,0,0|2,0,0]=4 15594 B18R2.269 Oc1cccc(c1)CNCc2ccc(cn2)Cl 34a_100000697193_100011660834 [0,2,0,0,0,0|2,0,0]=4 15595 B18R2.269 Oc1cccc(c1)CNCc2ccc(cn2)Cl 34a_100000743036_100012066911 [0,2,0,0,0,0|2,0,0]=4 15596 B18R2.269 Oc1cccc(c1)CNCc2ccc(cn2)F 207a_100000743036_100011934744 [0,2,0,0,0,0|2,0,0]=4 15597 B18R2.269 Oc1cccc(c1)CNCc2ccc(cn2)F 2230a_100000743036_100000703193 [0,2,0,0,0,0|2,0,0]=4 15598 B18R2.269 Oc1cccc(c1)CNCc2ccc(cn2)F 270004a_100000743036_100011934744 [0,2,0,0,0,0|2,0,0]=4 15599 B18R2.269 Oc1cccc(c1)CNCc2ccc(cn2)F 34a_100000743036_100000703193 [0,2,0,0,0,0|2,0,0]=4 15600 B18R2.269 Oc1cccc(c1)CNCc2ccc(cn2)F 34a_100020620131_100011660834 [0,2,0,0,0,0|2,0,0]=4 15601 B18R2.269 Oc1cccc(c1)CNCc2ccc(nc2)Br 207a_100009817727_100000188321 [0,2,0,0,0,0|2,0,0]=4 15602 B18R2.269 Oc1cccc(c1)CNCc2ccc(nc2)Br 2230a_100000743036_100009831999 [0,2,0,0,0,0|2,0,0]=4 15603 B18R2.269 Oc1cccc(c1)CNCc2ccc(nc2)Br 2230a_100009817727_100011660834 [0,2,0,0,0,0|2,0,0]=4 15604 B18R2.269 Oc1cccc(c1)CNCc2ccc(nc2)Br 270004a_100009817727_100000188321 [0,2,0,0,0,0|2,0,0]=4 15605 B18R2.269 Oc1cccc(c1)CNCc2ccc(nc2)Br 34a_100000743036_100009831999 [0,2,0,0,0,0|2,0,0]=4 15606 B18R2.269 Oc1cccc(c1)CNCc2ccc(nc2)Br 34a_100009817727_100011660834 [0,2,0,0,0,0|2,0,0]=4 15607 B18R2.269 Oc1cccc(c1)CNCc2ccc(nc2)Cl 207a_100000735879_100000188321 [0,2,0,0,0,0|2,0,0]=4 15608 B18R2.269 Oc1cccc(c1)CNCc2ccc(nc2)Cl 2230a_100000735879_100011660834 [0,2,0,0,0,0|2,0,0]=4 15609 B18R2.269 Oc1cccc(c1)CNCc2ccc(nc2)Cl 2230a_100000743036_100000735431 [0,2,0,0,0,0|2,0,0]=4 15610 B18R2.269 Oc1cccc(c1)CNCc2ccc(nc2)Cl 270004a_100000735879_100000188321 [0,2,0,0,0,0|2,0,0]=4 15611 B18R2.269 Oc1cccc(c1)CNCc2ccc(nc2)Cl 34a_100000735879_100011660834 [0,2,0,0,0,0|2,0,0]=4 15612 B18R2.269 Oc1cccc(c1)CNCc2ccc(nc2)Cl 34a_100000743036_100000735431 [0,2,0,0,0,0|2,0,0]=4 15613 B18R2.269 Oc1cccc(c1)CNCc2ccc(nc2)F 2230a_100000101913_100011660834 [0,2,0,0,0,0|2,0,0]=4 15614 B18R2.269 Oc1cccc(c1)CNCc2ccc(nc2)F 2230a_100000743036_100009820150 [0,2,0,0,0,0|2,0,0]=4 15615 B18R2.269 Oc1cccc(c1)CNCc2ccc(nc2)F 270004a_100000101913_100000188321 [0,2,0,0,0,0|2,0,0]=4 15616 B18R2.269 Oc1cccc(c1)CNCc2ccc(nc2)F 34a_100000101913_100011660834 [0,2,0,0,0,0|2,0,0]=4 15617 B18R2.269 Oc1cccc(c1)CNCc2ccc(nc2)F 34a_100000743036_100000099788 [0,2,0,0,0,0|2,0,0]=4 15618 B18R2.269 Oc1cccc(c1)CNCc2ccc(nc2)O 207a_100000743036_100011361521 [0,2,0,0,0,0|2,0,0]=4 15619 B18R2.269 Oc1cccc(c1)CNCc2ccc(nc2)O 2230a_100000757128_100011660834 [0,2,0,0,0,0|2,0,0]=4 15620 B18R2.269 Oc1cccc(c1)COCc2ccc(cc2)Br 34a_100000695286_100011660834 [0,2,0,0,0,0|0,0,0]=2 15621 B18R2.269 Oc1cccc(c1)COCc2ccc(cc2)Cl 34a_100000211118_100011660834 [0,2,0,0,0,0|0,0,0]=2 15622 B18R2.269 Oc1cccc(c1)COCc2ccc(cc2)Cl 7a_100000211118_100000084143 [0,2,0,0,0,0|0,0,0]=2 15623 B18R2.269 Oc1cccc(c1)COCc2ccc(cc2)F 34a_100000210977_100011660834 [0,2,0,0,0,0|0,0,0]=2 15624 B18R2.269 Oc1cccc(c1)COCc2ccc(cc2)F 7a_100000210977_100000084143 [0,2,0,0,0,0|0,0,0]=2 15625 B18R2.269 Oc1cccc(c1)COCc2ccc(cc2)I 34a_100000690907_100011660834 [0,2,0,0,0,0|0,0,0]=2 15626 B18R2.269 Oc1cccc(c1)COCc2ccc(cc2)I 7a_100000690907_100000084143 [0,2,0,0,0,0|0,0,0]=2 15627 B18R2.269 Oc1cccc(c1)COCc2ccc(cn2)Br 34a_100000754261_100011660834 [0,2,0,0,0,0|1,0,0]=3 15628 B18R2.269 Oc1cccc(c1)COCc2ccc(cn2)Cl 34a_100000703999_100011660834 [0,2,0,0,0,0|1,0,0]=3 15629 B18R2.269 Oc1cccc(c1)COCc2ccc(cn2)F 34a_100011999454_100011660834 [0,2,0,0,0,0|1,0,0]=3 15630 B18R2.269 Oc1cccc(c1)COCc2ccc(nc2)Br 34a_100009816760_100011660834 [0,2,0,0,0,0|1,0,0]=3 15631 B18R2.269 Oc1cccc(c1)COCc2ccc(nc2)Br 7a_100009816760_100000084143 [0,2,0,0,0,0|1,0,0]=3 15632 B18R2.269 Oc1cccc(c1)COCc2ccc(nc2)Cl 34a_100000755211_100011660834 [0,2,0,0,0,0|1,0,0]=3 15633 B18R2.269 Oc1cccc(c1)COCc2ccc(nc2)Cl 7a_100000755211_100000084143 [0,2,0,0,0,0|1,0,0]=3 15634 B18R2.269 Oc1cccc(c1)COCc2ccc(nc2)F 34a_100000079959_100011660834 [0,2,0,0,0,0|1,0,0]=3 15635 B18R2.269 Oc1cccc(c1)COCc2cnc(cn2)Cl 34a_100012002382_100011660834 [0,2,0,0,0,0|2,0,0]=4 15636 B18R2.269 Oc1cccc(c1)COCc2cnc(nc2)Cl 34a_100009855073_100011660834 [0,2,0,0,0,0|2,0,0]=4 15637 B18R2.269 Oc1cccc(c1)COCc2cnc(nc2)Cl 7a_100009855073_100000084143 [0,2,0,0,0,0|2,0,0]=4 15638 B18R2.269 Oc1cccc(c1)CSCc2ccc(cc2)Br 62a_100000189115_100011660834 [0,2,0,0,0,0|0,1,0]=3 15639 B18R2.269 Oc1cccc(c1)CSCc2ccc(cc2)Br 62a_100011660834_100000189115 [0,2,0,0,0,0|0,1,0]=3 15640 B18R2.269 Oc1cccc(c1)CSCc2ccc(cc2)Cl 62a_100000187161_100011660834 [0,2,0,0,0,0|0,1,0]=3 15641 B18R2.269 Oc1cccc(c1)CSCc2ccc(cc2)Cl 62a_100011660834_100000187161 [0,2,0,0,0,0|0,1,0]=3 15642 B18R2.269 Oc1cccc(c1)CSCc2ccc(cc2)F 62a_100000198546_100011660834 [0,2,0,0,0,0|0,1,0]=3 15643 B18R2.269 Oc1cccc(c1)CSCc2ccc(cc2)F 62a_100011660834_100000187164 [0,2,0,0,0,0|0,1,0]=3 15644 B18R2.269 Oc1cccc(c1)CSCc2ccc(cc2)I 62a_100000189116_100011660834 [0,2,0,0,0,0|0,1,0]=3 15645 B18R2.269 Oc1cccc(c1)CSCc2ccc(cc2)I 62a_100011660834_100000189116 [0,2,0,0,0,0|0,1,0]=3 15646 B18R2.269 Oc1cccc(c1)CSCc2ccc(cn2)Br 62a_100000702658_100011660834 [0,2,0,0,0,0|1,1,0]=4 15647 B18R2.269 Oc1cccc(c1)CSCc2ccc(cn2)Br 62a_100011660834_100000702658 [0,2,0,0,0,0|1,1,0]=4 15648 B18R2.269 Oc1cccc(c1)CSCc2ccc(cn2)Cl 62a_100011660834_100000697101 [0,2,0,0,0,0|1,1,0]=4 15649 B18R2.269 Oc1cccc(c1)CSCc2ccc(cn2)Cl 62a_100012066911_100011660834 [0,2,0,0,0,0|1,1,0]=4 15650 B18R2.269 Oc1cccc(c1)CSCc2ccc(cn2)F 62a_100000703193_100011660834 [0,2,0,0,0,0|1,1,0]=4 15651 B18R2.269 Oc1cccc(c1)CSCc2ccc(cn2)F 62a_100011660834_100000703193 [0,2,0,0,0,0|1,1,0]=4 15652 B18R2.269 Oc1cccc(c1)CSCc2ccc(nc2)Br 62a_100009831999_100011660834 [0,2,0,0,0,0|1,1,0]=4 15653 B18R2.269 Oc1cccc(c1)CSCc2ccc(nc2)Br 62a_100011660834_100009831999 [0,2,0,0,0,0|1,1,0]=4 15654 B18R2.269 Oc1cccc(c1)CSCc2ccc(nc2)Cl 62a_100000735431_100011660834 [0,2,0,0,0,0|1,1,0]=4 15655 B18R2.269 Oc1cccc(c1)CSCc2ccc(nc2)Cl 62a_100011660834_100000735431 [0,2,0,0,0,0|1,1,0]=4 15656 B18R2.269 Oc1cccc(c1)CSCc2ccc(nc2)F 62a_100009820150_100011660834 [0,2,0,0,0,0|1,1,0]=4 15657 B18R2.269 Oc1cccc(c1)CSCc2ccc(nc2)F 62a_100011660834_100000099788 [0,2,0,0,0,0|1,1,0]=4 15658 B18R2.269 Oc1cccc(c1)NCCc2ccc(cc2)Br 34a_100000210217_100011740612 [0,2,0,0,0,0|2,0,0]=4 15659 B18R2.269 Oc1cccc(c1)NCCc2ccc(cc2)Cl 34a_100000210217_100011713675 [0,2,0,0,0,0|2,0,0]=4 15660 B18R2.269 Oc1cccc(c1)NCCc2ccc(cc2)F 34a_100000210217_100011217392 [0,2,0,0,0,0|2,0,0]=4 15661 B18R2.269 Oc1cccc(c1)SCCc2ccc(cc2)Br 62a_100011740612_100000211634 [0,2,0,0,0,0|2,0,0]=4 15662 B18R2.269 Oc1cccc(c1)SCCc2ccc(cc2)Cl 62a_100011713675_100000211634 [0,2,0,0,0,0|2,0,0]=4 15663 B18R2.269 Oc1cccc(c1)SCCc2ccc(cc2)F 62a_100011217392_100000211634 [0,2,0,0,0,0|2,0,0]=4 15664 B18R2.269 Oc1cncc(c1)CNCc2ccc(cc2)Br 207a_100000174875_100012187055 [0,2,0,0,0,0|2,0,0]=4 15665 B18R2.269 Oc1cncc(c1)CNCc2ccc(cc2)Br 270004a_100000174875_100012187055 [0,2,0,0,0,0|2,0,0]=4 15666 B18R2.269 Oc1cncc(c1)CNCc2ccc(cc2)Cl 207a_100000174871_100012187055 [0,2,0,0,0,0|2,0,0]=4 15667 B18R2.269 Oc1cncc(c1)CNCc2ccc(cc2)Cl 270004a_100000174871_100012187055 [0,2,0,0,0,0|2,0,0]=4 15668 B18R2.269 Oc1cncc(c1)CNCc2ccc(cc2)F 207a_100000174882_100012187055 [0,2,0,0,0,0|2,0,0]=4 15669 B18R2.269 Oc1cncc(c1)CNCc2ccc(cc2)F 270004a_100000174882_100012187055 [0,2,0,0,0,0|2,0,0]=4 15670 B18R2.269 Oc1cncc(c1)CNCc2ccc(cc2)I 207a_100016989417_100012187055 [0,2,0,0,0,0|2,0,0]=4 15671 B18R2.269 Oc1cncc(c1)CNCc2ccc(cc2)I 270004a_100016989417_100012187055 [0,2,0,0,0,0|2,0,0]=4 15672 B18R2.269 [O-][n+]1ccc(cc1)COCc2cc(ccn2)Br 34a_100000031831_100010173614 [0,2,0,0,0,0|2,0,0]=4 15673 B18R2.269 [O-][n+]1ccc(cc1)COCc2cc(ccn2)Br 7a_100000031831_100010173614 [0,2,0,0,0,0|2,0,0]=4 15674 B18R2.269 [O-][n+]1ccc(cc1)COCc2cc(ccn2)Cl 34a_100000031831_100016988179 [0,2,0,0,0,0|2,0,0]=4 15675 B18R2.269 [O-][n+]1ccc(cc1)COCc2cc(ccn2)Cl 7a_100000031831_100016988179 [0,2,0,0,0,0|2,0,0]=4 15676 B18R2.269 [O-][n+]1ccc(cc1)COCc2cccc(c2)Br 34a_100000031831_100000698116 [0,2,0,0,0,0|1,0,0]=3 15677 B18R2.269 [O-][n+]1ccc(cc1)COCc2cccc(c2)Br 7a_100000031831_100000211773 [0,2,0,0,0,0|1,0,0]=3 15678 B18R2.269 [O-][n+]1ccc(cc1)COCc2cccc(c2)Cl 34a_100000031831_100000187163 [0,2,0,0,0,0|1,0,0]=3 15679 B18R2.269 [O-][n+]1ccc(cc1)COCc2cccc(c2)Cl 7a_100000031831_100000187163 [0,2,0,0,0,0|1,0,0]=3 15680 B18R2.269 [O-][n+]1ccc(cc1)COCc2cccc(c2)F 34a_100000031831_100000187166 [0,2,0,0,0,0|1,0,0]=3 15681 B18R2.269 [O-][n+]1ccc(cc1)COCc2cccc(c2)F 7a_100000031831_100000230114 [0,2,0,0,0,0|1,0,0]=3 15682 B18R2.269 [O-][n+]1ccc(cc1)COCc2cccc(c2)I 34a_100000031831_100011218688 [0,2,0,0,0,0|1,0,0]=3 15683 B18R2.269 [O-][n+]1ccc(cc1)COCc2cccc(c2)I 7a_100000031831_100011218688 [0,2,0,0,0,0|1,0,0]=3 15684 B18R2.269 [O-][n+]1ccc(cc1)COCc2cccc(c2)O 34a_100000031831_100011660834 [0,2,0,0,0,0|1,0,0]=3 15685 B18R2.269 [O-][n+]1ccc(cc1)COCc2cccc(c2)O 7a_100000031831_100000084143 [0,2,0,0,0,0|1,0,0]=3 15686 B18R2.269 [O-][n+]1ccc(cc1)COCc2cccc(n2)Br 34a_100000031831_100009889011 [0,2,0,0,0,0|2,0,0]=4 15687 B18R2.269 [O-][n+]1ccc(cc1)COCc2cccc(n2)Br 7a_100000031831_100009889011 [0,2,0,0,0,0|2,0,0]=4 15688 B18R2.269 [O-][n+]1ccc(cc1)COCc2cccc(n2)Cl 34a_100000031831_100000086093 [0,2,0,0,0,0|2,0,0]=4 15689 B18R2.269 [O-][n+]1ccc(cc1)COCc2cccc(n2)Cl 7a_100000031831_100000086093 [0,2,0,0,0,0|2,0,0]=4 15690 B18R2.269 [O-][n+]1ccc(cc1)COCc2cccc(n2)F 34a_100000031831_100009819644 [0,2,0,0,0,0|2,0,0]=4 15691 B18R2.269 [O-][n+]1ccc(cc1)COCc2cccc(n2)F 7a_100000031831_100009819644 [0,2,0,0,0,0|2,0,0]=4 15692 B18R2.269 [O-][n+]1ccc(cc1)COCc2ccnc(c2)Br 34a_100000031831_100010243470 [0,2,0,0,0,0|2,0,0]=4 15693 B18R2.269 [O-][n+]1ccc(cc1)COCc2ccnc(c2)Br 7a_100000031831_100010254460 [0,2,0,0,0,0|2,0,0]=4 15694 B18R2.269 [O-][n+]1ccc(cc1)COCc2ccnc(c2)Cl 34a_100000031831_100000764220 [0,2,0,0,0,0|2,0,0]=4 15695 B18R2.269 [O-][n+]1ccc(cc1)COCc2ccnc(c2)Cl 7a_100000031831_100000764220 [0,2,0,0,0,0|2,0,0]=4 15696 B18R2.269 [O-][n+]1ccc(cc1)COCc2cncc(c2)Br 34a_100000031831_100000738771 [0,2,0,0,0,0|2,0,0]=4 15697 B18R2.269 [O-][n+]1ccc(cc1)COCc2cncc(c2)Br 7a_100000031831_100000738771 [0,2,0,0,0,0|2,0,0]=4 15698 B18R2.269 [O-][n+]1ccc(cc1)COCc2cncc(c2)Cl 34a_100000031831_100016992070 [0,2,0,0,0,0|2,0,0]=4 15699 B18R2.269 [O-][n+]1ccc(cc1)COCc2cncc(c2)Cl 7a_100000031831_100016992070 [0,2,0,0,0,0|2,0,0]=4 15700 B18R2.269 [O-][n+]1ccc(cc1)COCc2cncc(c2)F 34a_100000031831_100000725299 [0,2,0,0,0,0|2,0,0]=4 15701 B18R2.269 [O-][n+]1ccc(cc1)COCc2cncc(c2)F 7a_100000031831_100000725299 [0,2,0,0,0,0|2,0,0]=4 15702 B18R2.269 [O-][n+]1cccc(c1)COCc2ccc(cc2)Br 34a_100000037817_100000189115 [0,2,0,0,0,0|1,0,0]=3 15703 B18R2.269 [O-][n+]1cccc(c1)COCc2ccc(cc2)Br 7a_100000037817_100011217064 [0,2,0,0,0,0|1,0,0]=3 15704 B18R2.269 [O-][n+]1cccc(c1)COCc2ccc(cc2)Cl 34a_100000037817_100000694040 [0,2,0,0,0,0|1,0,0]=3 15705 B18R2.269 [O-][n+]1cccc(c1)COCc2ccc(cc2)Cl 7a_100000037817_100000187161 [0,2,0,0,0,0|1,0,0]=3 15706 B18R2.269 [O-][n+]1cccc(c1)COCc2ccc(cc2)F 34a_100000037817_100000198546 [0,2,0,0,0,0|1,0,0]=3 15707 B18R2.269 [O-][n+]1cccc(c1)COCc2ccc(cc2)F 7a_100000037817_100000198546 [0,2,0,0,0,0|1,0,0]=3 15708 B18R2.269 [O-][n+]1cccc(c1)COCc2ccc(cc2)I 34a_100000037817_100000189116 [0,2,0,0,0,0|1,0,0]=3 15709 B18R2.269 [O-][n+]1cccc(c1)COCc2ccc(cc2)I 7a_100000037817_100000189116 [0,2,0,0,0,0|1,0,0]=3 15710 B18R2.269 [O-][n+]1cccc(c1)COCc2ccc(cn2)Br 34a_100000037817_100000702658 [0,2,0,0,0,0|2,0,0]=4 15711 B18R2.269 [O-][n+]1cccc(c1)COCc2ccc(cn2)Br 7a_100000037817_100000702658 [0,2,0,0,0,0|2,0,0]=4 15712 B18R2.269 [O-][n+]1cccc(c1)COCc2ccc(cn2)Cl 34a_100000037817_100012066911 [0,2,0,0,0,0|2,0,0]=4 15713 B18R2.269 [O-][n+]1cccc(c1)COCc2ccc(cn2)Cl 7a_100000037817_100012066911 [0,2,0,0,0,0|2,0,0]=4 15714 B18R2.269 [O-][n+]1cccc(c1)COCc2ccc(cn2)F 34a_100000037817_100000703193 [0,2,0,0,0,0|2,0,0]=4 15715 B18R2.269 [O-][n+]1cccc(c1)COCc2ccc(cn2)F 7a_100000037817_100000703193 [0,2,0,0,0,0|2,0,0]=4 15716 B18R2.269 [O-][n+]1cccc(c1)COCc2ccc(nc2)Br 34a_100000037817_100009831999 [0,2,0,0,0,0|2,0,0]=4 15717 B18R2.269 [O-][n+]1cccc(c1)COCc2ccc(nc2)Br 7a_100000037817_100009831999 [0,2,0,0,0,0|2,0,0]=4 15718 B18R2.269 [O-][n+]1cccc(c1)COCc2ccc(nc2)Cl 34a_100000037817_100000735431 [0,2,0,0,0,0|2,0,0]=4 15719 B18R2.269 [O-][n+]1cccc(c1)COCc2ccc(nc2)Cl 7a_100000037817_100000735431 [0,2,0,0,0,0|2,0,0]=4 15720 B18R2.269 [O-][n+]1cccc(c1)COCc2ccc(nc2)F 34a_100000037817_100000099788 [0,2,0,0,0,0|2,0,0]=4 15721 B18R2.269 [O-][n+]1cccc(c1)COCc2ccc(nc2)F 7a_100000037817_100009820150 [0,2,0,0,0,0|2,0,0]=4 15722 B18R2.269 [S]c1cccc(c1)SCCc2ccc(cc2)Br 62a_100011740612_114929384022 [0,2,0,0,0,0|2,0,0]=4 15723 B18R2.269 [S]c1cccc(c1)SCCc2ccc(cc2)Br 62a_114929384022_100011740612 [0,2,0,0,0,0|2,0,0]=4 15724 B18R2.269 [S]c1cccc(c1)SCCc2ccc(cc2)Cl 62a_100011713675_114929384022 [0,2,0,0,0,0|2,0,0]=4 15725 B18R2.269 [S]c1cccc(c1)SCCc2ccc(cc2)Cl 62a_114929384022_100011713675 [0,2,0,0,0,0|2,0,0]=4 15726 B18R2.274 Brc1ccc(cc1)CCNc2ccc(cc2)Br 2230a_100000210018_100011740612 [0,2,0,0,0,0|2,0,0]=4 15727 B18R2.274 Brc1ccc(cc1)CCNc2ccc(cc2)Br 34a_100000210018_100011740612 [0,2,0,0,0,0|2,0,0]=4 15728 B18R2.274 Brc1ccc(cc1)CCNc2ccc(cc2)I 34a_100000185761_100011740612 [0,2,0,0,0,0|2,0,0]=4 15729 B18R2.274 Brc1ccc(cc1)CCOc2ccc(cc2)Br 34a_100000185759_100011740612 [0,2,0,0,0,0|2,0,0]=4 15730 B18R2.274 Brc1ccc(cc1)CCOc2ccc(cc2)Br 7a_100000185759_100011740612 [0,2,0,0,0,0|2,0,0]=4 15731 B18R2.274 Brc1ccc(cc1)CCOc2ccc(cc2)I 34a_100000212066_100011740612 [0,2,0,0,0,0|2,0,0]=4 15732 B18R2.274 Brc1ccc(cc1)CCOc2ccc(cc2)I 7a_100000212066_100011740612 [0,2,0,0,0,0|2,0,0]=4 15733 B18R2.274 Brc1ccc(cc1)CCSc2ccc(cc2)Br 62a_100000752885_100011740612 [0,2,0,0,0,0|2,0,0]=4 15734 B18R2.274 Brc1ccc(cc1)CCSc2ccc(cc2)Br 62a_100011740612_100000752885 [0,2,0,0,0,0|2,0,0]=4 15735 B18R2.274 Brc1ccc(cc1)CNCc2ccc(cc2)Br 207a_100000174875_100000186029 [0,2,0,0,0,0|1,0,0]=3 15736 B18R2.274 Brc1ccc(cc1)CNCc2ccc(cc2)Br 2230a_100000174875_100011217064 [0,2,0,0,0,0|1,0,0]=3 15737 B18R2.274 Brc1ccc(cc1)CNCc2ccc(cc2)Br 26a_100000174875_100000185759 [0,2,0,0,0,0|1,0,0]=3 15738 B18R2.274 Brc1ccc(cc1)CNCc2ccc(cc2)Br 270004a_100000174875_100000186029 [0,2,0,0,0,0|1,0,0]=3 15739 B18R2.274 Brc1ccc(cc1)CNCc2ccc(cc2)Br 34a_100000174875_100000189115 [0,2,0,0,0,0|1,0,0]=3 15740 B18R2.274 Brc1ccc(cc1)CNCc2ccc(cc2)I 207a_100000174875_100000188517 [0,2,0,0,0,0|1,0,0]=3 15741 B18R2.274 Brc1ccc(cc1)CNCc2ccc(cc2)I 207a_100016989417_100000186029 [0,2,0,0,0,0|1,0,0]=3 15742 B18R2.274 Brc1ccc(cc1)CNCc2ccc(cc2)I 2230a_100000174875_100000189116 [0,2,0,0,0,0|1,0,0]=3 15743 B18R2.274 Brc1ccc(cc1)CNCc2ccc(cc2)I 2230a_100016989417_100011217064 [0,2,0,0,0,0|1,0,0]=3 15744 B18R2.274 Brc1ccc(cc1)CNCc2ccc(cc2)I 270004a_100016989417_100000186029 [0,2,0,0,0,0|1,0,0]=3 15745 B18R2.274 Brc1ccc(cc1)CNCc2ccc(cc2)I 34a_100000174875_100000189116 [0,2,0,0,0,0|1,0,0]=3 15746 B18R2.274 Brc1ccc(cc1)CNCc2ccc(cc2)I 34a_100016989417_100000189115 [0,2,0,0,0,0|1,0,0]=3 15747 B18R2.274 Brc1ccc(cc1)CNCc2ccc(cn2)Br 207a_100000174875_100000754260 [0,2,0,0,0,0|2,0,0]=4 15748 B18R2.274 Brc1ccc(cc1)CNCc2ccc(cn2)Br 2230a_100000174875_100000702658 [0,2,0,0,0,0|2,0,0]=4 15749 B18R2.274 Brc1ccc(cc1)CNCc2ccc(cn2)Br 270004a_100000174875_100000754260 [0,2,0,0,0,0|2,0,0]=4 15750 B18R2.274 Brc1ccc(cc1)CNCc2ccc(cn2)Br 34a_100000174875_100000702658 [0,2,0,0,0,0|2,0,0]=4 15751 B18R2.274 Brc1ccc(cc1)CNCc2ccc(cn2)Br 34a_100015188789_100000189115 [0,2,0,0,0,0|2,0,0]=4 15752 B18R2.274 Brc1ccc(cc1)CNCc2ccc(nc2)Br 207a_100009817727_100000186029 [0,2,0,0,0,0|2,0,0]=4 15753 B18R2.274 Brc1ccc(cc1)CNCc2ccc(nc2)Br 2230a_100000174875_100009831999 [0,2,0,0,0,0|2,0,0]=4 15754 B18R2.274 Brc1ccc(cc1)CNCc2ccc(nc2)Br 2230a_100009817727_100011217064 [0,2,0,0,0,0|2,0,0]=4 15755 B18R2.274 Brc1ccc(cc1)CNCc2ccc(nc2)Br 270004a_100009817727_100000186029 [0,2,0,0,0,0|2,0,0]=4 15756 B18R2.274 Brc1ccc(cc1)CNCc2ccc(nc2)Br 34a_100000174875_100009831999 [0,2,0,0,0,0|2,0,0]=4 15757 B18R2.274 Brc1ccc(cc1)CNCc2ccc(nc2)Br 34a_100009817727_100000189115 [0,2,0,0,0,0|2,0,0]=4 15758 B18R2.274 Brc1ccc(cc1)COCc2ccc(cc2)Br 34a_100000695286_100000189115 [0,2,0,0,0,0|0,0,0]=2 15759 B18R2.274 Brc1ccc(cc1)COCc2ccc(cc2)I 34a_100000690907_100000189115 [0,2,0,0,0,0|0,0,0]=2 15760 B18R2.274 Brc1ccc(cc1)COCc2ccc(cc2)I 34a_100000695286_100000189116 [0,2,0,0,0,0|0,0,0]=2 15761 B18R2.274 Brc1ccc(cc1)COCc2ccc(cc2)I 7a_100000690907_100011217064 [0,2,0,0,0,0|0,0,0]=2 15762 B18R2.274 Brc1ccc(cc1)COCc2ccc(cn2)Br 34a_100000695286_100000702658 [0,2,0,0,0,0|1,0,0]=3 15763 B18R2.274 Brc1ccc(cc1)COCc2ccc(cn2)Br 34a_100000754261_100000189115 [0,2,0,0,0,0|1,0,0]=3 15764 B18R2.274 Brc1ccc(cc1)COCc2ccc(nc2)Br 34a_100000695286_100009831999 [0,2,0,0,0,0|1,0,0]=3 15765 B18R2.274 Brc1ccc(cc1)COCc2ccc(nc2)Br 34a_100009816760_100000189115 [0,2,0,0,0,0|1,0,0]=3 15766 B18R2.274 Brc1ccc(cc1)COCc2ccc(nc2)Br 7a_100009816760_100011217064 [0,2,0,0,0,0|1,0,0]=3 15767 B18R2.274 Brc1ccc(cc1)COCc2ncc(cn2)Br 34a_100000695286_100010064664 [0,2,0,0,0,0|2,0,0]=4 15768 B18R2.274 Brc1ccc(cc1)CSCc2ccc(cc2)Br 62a_100000189115_100000189115 [0,2,0,0,0,0|0,1,0]=3 15769 B18R2.274 Brc1ccc(cc1)CSCc2ccc(cc2)I 62a_100000189115_100000189116 [0,2,0,0,0,0|0,1,0]=3 15770 B18R2.274 Brc1ccc(cc1)CSCc2ccc(cc2)I 62a_100000189116_100000189115 [0,2,0,0,0,0|0,1,0]=3 15771 B18R2.274 Brc1ccc(cc1)CSCc2ccc(cn2)Br 62a_100000189115_100000702658 [0,2,0,0,0,0|1,1,0]=4 15772 B18R2.274 Brc1ccc(cc1)CSCc2ccc(cn2)Br 62a_100000702658_100000189115 [0,2,0,0,0,0|1,1,0]=4 15773 B18R2.274 Brc1ccc(cc1)CSCc2ccc(nc2)Br 62a_100000189115_100009831999 [0,2,0,0,0,0|1,1,0]=4 15774 B18R2.274 Brc1ccc(cc1)CSCc2ccc(nc2)Br 62a_100009831999_100000189115 [0,2,0,0,0,0|1,1,0]=4 15775 B18R2.274 Brc1ccc(cn1)CNCc2ccc(cc2)I 207a_100009817727_100000188517 [0,2,0,0,0,0|2,0,0]=4 15776 B18R2.274 Brc1ccc(cn1)CNCc2ccc(cc2)I 2230a_100009817727_100000189116 [0,2,0,0,0,0|2,0,0]=4 15777 B18R2.274 Brc1ccc(cn1)CNCc2ccc(cc2)I 2230a_100016989417_100009831999 [0,2,0,0,0,0|2,0,0]=4 15778 B18R2.274 Brc1ccc(cn1)CNCc2ccc(cc2)I 34a_100009817727_100000189116 [0,2,0,0,0,0|2,0,0]=4 15779 B18R2.274 Brc1ccc(cn1)CNCc2ccc(cc2)I 34a_100016989417_100009831999 [0,2,0,0,0,0|2,0,0]=4 15780 B18R2.274 Brc1ccc(cn1)COCc2ccc(cc2)I 34a_100000690907_100009831999 [0,2,0,0,0,0|1,0,0]=3 15781 B18R2.274 Brc1ccc(cn1)COCc2ccc(cc2)I 34a_100009816760_100000189116 [0,2,0,0,0,0|1,0,0]=3 15782 B18R2.274 Brc1ccc(cn1)COCc2ccc(cc2)I 7a_100000690907_100009831999 [0,2,0,0,0,0|1,0,0]=3 15783 B18R2.274 Brc1ccc(cn1)COCc2ccc(cc2)I 7a_100009816760_100000189116 [0,2,0,0,0,0|1,0,0]=3 15784 B18R2.274 Brc1ccc(cn1)COCc2ccc(nc2)Br 34a_100009816760_100009831999 [0,2,0,0,0,0|2,0,0]=4 15785 B18R2.274 Brc1ccc(cn1)COCc2ccc(nc2)Br 7a_100009816760_100009831999 [0,2,0,0,0,0|2,0,0]=4 15786 B18R2.274 Brc1ccc(cn1)CSCc2ccc(cc2)I 62a_100000189116_100009831999 [0,2,0,0,0,0|1,1,0]=4 15787 B18R2.274 Brc1ccc(cn1)CSCc2ccc(cc2)I 62a_100009831999_100000189116 [0,2,0,0,0,0|1,1,0]=4 15788 B18R2.274 Brc1ccc(nc1)CNCc2ccc(cc2)I 207a_100016989417_100000754260 [0,2,0,0,0,0|2,0,0]=4 15789 B18R2.274 Brc1ccc(nc1)CNCc2ccc(cc2)I 2230a_100016989417_100000702658 [0,2,0,0,0,0|2,0,0]=4 15790 B18R2.274 Brc1ccc(nc1)CNCc2ccc(cc2)I 270004a_100016989417_100000754260 [0,2,0,0,0,0|2,0,0]=4 15791 B18R2.274 Brc1ccc(nc1)CNCc2ccc(cc2)I 34a_100015188789_100000189116 [0,2,0,0,0,0|2,0,0]=4 15792 B18R2.274 Brc1ccc(nc1)CNCc2ccc(cc2)I 34a_100016989417_100000702658 [0,2,0,0,0,0|2,0,0]=4 15793 B18R2.274 Brc1ccc(nc1)COCc2ccc(cc2)I 34a_100000690907_100000702658 [0,2,0,0,0,0|1,0,0]=3 15794 B18R2.274 Brc1ccc(nc1)COCc2ccc(cc2)I 34a_100000754261_100000189116 [0,2,0,0,0,0|1,0,0]=3 15795 B18R2.274 Brc1ccc(nc1)COCc2ccc(cc2)I 7a_100000690907_100000702658 [0,2,0,0,0,0|1,0,0]=3 15796 B18R2.274 Brc1ccc(nc1)COCc2ccc(cn2)Br 34a_100000754261_100000702658 [0,2,0,0,0,0|2,0,0]=4 15797 B18R2.274 Brc1ccc(nc1)COCc2ccc(nc2)Br 34a_100000754261_100009831999 [0,2,0,0,0,0|2,0,0]=4 15798 B18R2.274 Brc1ccc(nc1)COCc2ccc(nc2)Br 34a_100009816760_100000702658 [0,2,0,0,0,0|2,0,0]=4 15799 B18R2.274 Brc1ccc(nc1)COCc2ccc(nc2)Br 7a_100009816760_100000702658 [0,2,0,0,0,0|2,0,0]=4 15800 B18R2.274 Brc1ccc(nc1)CSCc2ccc(cc2)I 62a_100000189116_100000702658 [0,2,0,0,0,0|1,1,0]=4 15801 B18R2.274 Brc1ccc(nc1)CSCc2ccc(cc2)I 62a_100000702658_100000189116 [0,2,0,0,0,0|1,1,0]=4 15802 B18R2.274 Brc1cnc(nc1)COCc2ccc(cc2)I 34a_100000690907_100010064664 [0,2,0,0,0,0|2,0,0]=4 15803 B18R2.274 Brc1cnc(nc1)COCc2ccc(cc2)I 7a_100000690907_100010064664 [0,2,0,0,0,0|2,0,0]=4 15804 B18R2.274 C[n+]1ccc(cc1)COCc2ccc(cc2)Br 34a_100009831711_100000189115 [0,2,0,0,0,0|1,0,0]=3 15805 B18R2.274 C[n+]1ccc(cc1)COCc2ccc(cc2)Cl 34a_100009831711_100000694040 [0,2,0,0,0,0|1,0,0]=3 15806 B18R2.274 C[n+]1ccc(cc1)COCc2ccc(cc2)F 34a_100009831711_100000198546 [0,2,0,0,0,0|1,0,0]=3 15807 B18R2.274 C[n+]1ccc(cc1)COCc2ccc(cc2)I 34a_100009831711_100000189116 [0,2,0,0,0,0|1,0,0]=3 15808 B18R2.274 C[n+]1ccc(cc1)COCc2ccc(cn2)Br 34a_100009831711_100000702658 [0,2,0,0,0,0|2,0,0]=4 15809 B18R2.274 C[n+]1ccc(cc1)COCc2ccc(cn2)Cl 34a_100009831711_100012066911 [0,2,0,0,0,0|2,0,0]=4 15810 B18R2.274 C[n+]1ccc(cc1)COCc2ccc(cn2)F 34a_100009831711_100000703193 [0,2,0,0,0,0|2,0,0]=4 15811 B18R2.274 C[n+]1ccc(cc1)COCc2ccc(nc2)Br 34a_100009831711_100009831999 [0,2,0,0,0,0|2,0,0]=4 15812 B18R2.274 C[n+]1ccc(cc1)COCc2ccc(nc2)Cl 34a_100009831711_100000735431 [0,2,0,0,0,0|2,0,0]=4 15813 B18R2.274 C[n+]1ccc(cc1)COCc2ccc(nc2)F 34a_100009831711_100000099788 [0,2,0,0,0,0|2,0,0]=4 15814 B18R2.274 Cc1ccc(cc1)CCNc2ccc(cc2)Br 2230a_100000210018_100011713686 [0,2,0,0,0,0|2,0,0]=4 15815 B18R2.274 Cc1ccc(cc1)CCNc2ccc(cc2)Br 34a_100000210018_100011713686 [0,2,0,0,0,0|2,0,0]=4 15816 B18R2.274 Cc1ccc(cc1)CCNc2ccc(cc2)C 34a_100000124888_100011713686 [0,2,0,0,0,0|2,0,0]=4 15817 B18R2.274 Cc1ccc(cc1)CCNc2ccc(cc2)Cl 2230a_100000210052_100011713686 [0,2,0,0,0,0|2,0,0]=4 15818 B18R2.274 Cc1ccc(cc1)CCNc2ccc(cc2)Cl 34a_100000210052_100011713686 [0,2,0,0,0,0|2,0,0]=4 15819 B18R2.274 Cc1ccc(cc1)CCNc2ccc(cc2)F 34a_100000185862_100011713686 [0,2,0,0,0,0|2,0,0]=4 15820 B18R2.274 Cc1ccc(cc1)CCNc2ccc(cc2)I 34a_100000185761_100011713686 [0,2,0,0,0,0|2,0,0]=4 15821 B18R2.274 Cc1ccc(cc1)CCNc2ccc(cc2)O 34a_100000185829_100011713686 [0,2,0,0,0,0|2,0,0]=4 15822 B18R2.274 Cc1ccc(cc1)CCOc2ccc(cc2)Br 34a_100000185759_100011713686 [0,2,0,0,0,0|2,0,0]=4 15823 B18R2.274 Cc1ccc(cc1)CCOc2ccc(cc2)Br 7a_100000185759_100011713686 [0,2,0,0,0,0|2,0,0]=4 15824 B18R2.274 Cc1ccc(cc1)CCOc2ccc(cc2)C 34a_100000210336_100011713686 [0,2,0,0,0,0|2,0,0]=4 15825 B18R2.274 Cc1ccc(cc1)CCOc2ccc(cc2)C 7a_100000210336_100011713686 [0,2,0,0,0,0|2,0,0]=4 15826 B18R2.274 Cc1ccc(cc1)CCOc2ccc(cc2)Cl 34a_100000210216_100011713686 [0,2,0,0,0,0|2,0,0]=4 15827 B18R2.274 Cc1ccc(cc1)CCOc2ccc(cc2)Cl 7a_100000210216_100011713686 [0,2,0,0,0,0|2,0,0]=4 15828 B18R2.274 Cc1ccc(cc1)CCOc2ccc(cc2)F 34a_100000210339_100011713686 [0,2,0,0,0,0|2,0,0]=4 15829 B18R2.274 Cc1ccc(cc1)CCOc2ccc(cc2)I 34a_100000212066_100011713686 [0,2,0,0,0,0|2,0,0]=4 15830 B18R2.274 Cc1ccc(cc1)CCOc2ccc(cc2)I 7a_100000212066_100011713686 [0,2,0,0,0,0|2,0,0]=4 15831 B18R2.274 Cc1ccc(cc1)CCOc2ccc(cc2)N 34a_100000185829_100011713686 [0,2,0,0,0,0|2,0,0]=4 15832 B18R2.274 Cc1ccc(cc1)CCSc2ccc(cc2)Br 62a_100000752885_100011713686 [0,2,0,0,0,0|2,0,0]=4 15833 B18R2.274 Cc1ccc(cc1)CCSc2ccc(cc2)Br 62a_100011713686_100000752885 [0,2,0,0,0,0|2,0,0]=4 15834 B18R2.274 Cc1ccc(cc1)CCSc2ccc(cc2)C 62a_100000186775_100011713686 [0,2,0,0,0,0|2,0,0]=4 15835 B18R2.274 Cc1ccc(cc1)CCSc2ccc(cc2)C 62a_100011713686_100000186775 [0,2,0,0,0,0|2,0,0]=4 15836 B18R2.274 Cc1ccc(cc1)CCSc2ccc(cc2)Cl 62a_100000755918_100011713686 [0,2,0,0,0,0|2,0,0]=4 15837 B18R2.274 Cc1ccc(cc1)CCSc2ccc(cc2)Cl 62a_100011713686_100000755918 [0,2,0,0,0,0|2,0,0]=4 15838 B18R2.274 Cc1ccc(cc1)CCSc2ccc(cc2)F 62a_100000211213_100011713686 [0,2,0,0,0,0|2,0,0]=4 15839 B18R2.274 Cc1ccc(cc1)CCSc2ccc(cc2)F 62a_100011713686_100000211213 [0,2,0,0,0,0|2,0,0]=4 15840 B18R2.274 Cc1ccc(cc1)CCSc2ccc(cc2)N 62a_100000185761_100011713686 [0,2,0,0,0,0|2,0,0]=4 15841 B18R2.274 Cc1ccc(cc1)CCSc2ccc(cc2)N 62a_100011713686_100000185761 [0,2,0,0,0,0|2,0,0]=4 15842 B18R2.274 Cc1ccc(cc1)CCSc2ccc(cc2)O 62a_100011713686_100000185759 [0,2,0,0,0,0|2,0,0]=4 15843 B18R2.274 Cc1ccc(cc1)CNCc2ccc(cc2)Br 207a_100000174875_100000211033 [0,2,0,0,0,0|1,0,0]=3 15844 B18R2.274 Cc1ccc(cc1)CNCc2ccc(cc2)Br 207a_100000174908_100000186029 [0,2,0,0,0,0|1,0,0]=3 15845 B18R2.274 Cc1ccc(cc1)CNCc2ccc(cc2)Br 2230a_100000174875_100000210814 [0,2,0,0,0,0|1,0,0]=3 15846 B18R2.274 Cc1ccc(cc1)CNCc2ccc(cc2)Br 2230a_100000174908_100011217064 [0,2,0,0,0,0|1,0,0]=3 15847 B18R2.274 Cc1ccc(cc1)CNCc2ccc(cc2)Br 26a_100000174875_200020625495 [0,2,0,0,0,0|1,0,0]=3 15848 B18R2.274 Cc1ccc(cc1)CNCc2ccc(cc2)Br 270004a_100000174875_100000211033 [0,2,0,0,0,0|1,0,0]=3 15849 B18R2.274 Cc1ccc(cc1)CNCc2ccc(cc2)Br 270004a_100000174908_100000186029 [0,2,0,0,0,0|1,0,0]=3 15850 B18R2.274 Cc1ccc(cc1)CNCc2ccc(cc2)Br 34a_100000174875_100000210814 [0,2,0,0,0,0|1,0,0]=3 15851 B18R2.274 Cc1ccc(cc1)CNCc2ccc(cc2)Br 34a_100000174908_100000189115 [0,2,0,0,0,0|1,0,0]=3 15852 B18R2.274 Cc1ccc(cc1)CNCc2ccc(cc2)C 207a_100000174908_100000211033 [0,2,0,0,0,0|1,0,0]=3 15853 B18R2.274 Cc1ccc(cc1)CNCc2ccc(cc2)C 2230a_100000174908_100000210814 [0,2,0,0,0,0|1,0,0]=3 15854 B18R2.274 Cc1ccc(cc1)CNCc2ccc(cc2)C 270004a_100000174908_100000211033 [0,2,0,0,0,0|1,0,0]=3 15855 B18R2.274 Cc1ccc(cc1)CNCc2ccc(cc2)C 34a_100000174908_100000210814 [0,2,0,0,0,0|1,0,0]=3 15856 B18R2.274 Cc1ccc(cc1)CNCc2ccc(cc2)Cl 207a_100000174871_100000211033 [0,2,0,0,0,0|1,0,0]=3 15857 B18R2.274 Cc1ccc(cc1)CNCc2ccc(cc2)Cl 207a_100000174908_100000189385 [0,2,0,0,0,0|1,0,0]=3 15858 B18R2.274 Cc1ccc(cc1)CNCc2ccc(cc2)Cl 2230a_100000174871_100000210814 [0,2,0,0,0,0|1,0,0]=3 15859 B18R2.274 Cc1ccc(cc1)CNCc2ccc(cc2)Cl 2230a_100000174908_100000694040 [0,2,0,0,0,0|1,0,0]=3 15860 B18R2.274 Cc1ccc(cc1)CNCc2ccc(cc2)Cl 26a_100000174871_200020625495 [0,2,0,0,0,0|1,0,0]=3 15861 B18R2.274 Cc1ccc(cc1)CNCc2ccc(cc2)Cl 270004a_100000174871_100000211033 [0,2,0,0,0,0|1,0,0]=3 15862 B18R2.274 Cc1ccc(cc1)CNCc2ccc(cc2)Cl 270004a_100000174908_100000189385 [0,2,0,0,0,0|1,0,0]=3 15863 B18R2.274 Cc1ccc(cc1)CNCc2ccc(cc2)Cl 34a_100000174871_100000210814 [0,2,0,0,0,0|1,0,0]=3 15864 B18R2.274 Cc1ccc(cc1)CNCc2ccc(cc2)Cl 34a_100000174908_100000694040 [0,2,0,0,0,0|1,0,0]=3 15865 B18R2.274 Cc1ccc(cc1)CNCc2ccc(cc2)F 207a_100000174882_100000211033 [0,2,0,0,0,0|1,0,0]=3 15866 B18R2.274 Cc1ccc(cc1)CNCc2ccc(cc2)F 207a_100000174908_100000210084 [0,2,0,0,0,0|1,0,0]=3 15867 B18R2.274 Cc1ccc(cc1)CNCc2ccc(cc2)F 2230a_100000174882_100000210814 [0,2,0,0,0,0|1,0,0]=3 15868 B18R2.274 Cc1ccc(cc1)CNCc2ccc(cc2)F 2230a_100000174908_100000198546 [0,2,0,0,0,0|1,0,0]=3 15869 B18R2.274 Cc1ccc(cc1)CNCc2ccc(cc2)F 270004a_100000174882_100000211033 [0,2,0,0,0,0|1,0,0]=3 15870 B18R2.274 Cc1ccc(cc1)CNCc2ccc(cc2)F 270004a_100000174908_100000210084 [0,2,0,0,0,0|1,0,0]=3 15871 B18R2.274 Cc1ccc(cc1)CNCc2ccc(cc2)F 34a_100000174882_100000210814 [0,2,0,0,0,0|1,0,0]=3 15872 B18R2.274 Cc1ccc(cc1)CNCc2ccc(cc2)F 34a_100000174908_100000198546 [0,2,0,0,0,0|1,0,0]=3 15873 B18R2.274 Cc1ccc(cc1)CNCc2ccc(cc2)I 207a_100000174908_100000188517 [0,2,0,0,0,0|1,0,0]=3 15874 B18R2.274 Cc1ccc(cc1)CNCc2ccc(cc2)I 207a_100016989417_100000211033 [0,2,0,0,0,0|1,0,0]=3 15875 B18R2.274 Cc1ccc(cc1)CNCc2ccc(cc2)I 2230a_100000174908_100000189116 [0,2,0,0,0,0|1,0,0]=3 15876 B18R2.274 Cc1ccc(cc1)CNCc2ccc(cc2)I 2230a_100016989417_100000210814 [0,2,0,0,0,0|1,0,0]=3 15877 B18R2.274 Cc1ccc(cc1)CNCc2ccc(cc2)I 270004a_100016989417_100000211033 [0,2,0,0,0,0|1,0,0]=3 15878 B18R2.274 Cc1ccc(cc1)CNCc2ccc(cc2)I 34a_100000174908_100000189116 [0,2,0,0,0,0|1,0,0]=3 15879 B18R2.274 Cc1ccc(cc1)CNCc2ccc(cc2)I 34a_100016989417_100000210814 [0,2,0,0,0,0|1,0,0]=3 15880 B18R2.274 Cc1ccc(cc1)CNCc2ccc(cc2)O 34a_100000185549_100000210814 [0,2,0,0,0,0|1,0,0]=3 15881 B18R2.274 Cc1ccc(cc1)CNCc2ccc(cn2)Br 207a_100000174908_100000754260 [0,2,0,0,0,0|2,0,0]=4 15882 B18R2.274 Cc1ccc(cc1)CNCc2ccc(cn2)Br 2230a_100000174908_100000702658 [0,2,0,0,0,0|2,0,0]=4 15883 B18R2.274 Cc1ccc(cc1)CNCc2ccc(cn2)Br 270004a_100000174908_100000754260 [0,2,0,0,0,0|2,0,0]=4 15884 B18R2.274 Cc1ccc(cc1)CNCc2ccc(cn2)Br 34a_100000174908_100000702658 [0,2,0,0,0,0|2,0,0]=4 15885 B18R2.274 Cc1ccc(cc1)CNCc2ccc(cn2)Br 34a_100015188789_100000210814 [0,2,0,0,0,0|2,0,0]=4 15886 B18R2.274 Cc1ccc(cc1)CNCc2ccc(cn2)C 207a_100000174908_100000050478 [0,2,0,0,0,0|2,0,0]=4 15887 B18R2.274 Cc1ccc(cc1)CNCc2ccc(cn2)C 2230a_100000174908_100000691093 [0,2,0,0,0,0|2,0,0]=4 15888 B18R2.274 Cc1ccc(cc1)CNCc2ccc(cn2)C 270004a_100000174908_100000050478 [0,2,0,0,0,0|2,0,0]=4 15889 B18R2.274 Cc1ccc(cc1)CNCc2ccc(cn2)C 34a_100000174908_100000691093 [0,2,0,0,0,0|2,0,0]=4 15890 B18R2.274 Cc1ccc(cc1)CNCc2ccc(cn2)C 34a_100015187455_100000210814 [0,2,0,0,0,0|2,0,0]=4 15891 B18R2.274 Cc1ccc(cc1)CNCc2ccc(cn2)Cl 207a_100000174908_100011361569 [0,2,0,0,0,0|2,0,0]=4 15892 B18R2.274 Cc1ccc(cc1)CNCc2ccc(cn2)Cl 2230a_100000174908_100012066911 [0,2,0,0,0,0|2,0,0]=4 15893 B18R2.274 Cc1ccc(cc1)CNCc2ccc(cn2)Cl 270004a_100000174908_100011361569 [0,2,0,0,0,0|2,0,0]=4 15894 B18R2.274 Cc1ccc(cc1)CNCc2ccc(cn2)Cl 270004a_100000697193_100000211033 [0,2,0,0,0,0|2,0,0]=4 15895 B18R2.274 Cc1ccc(cc1)CNCc2ccc(cn2)Cl 34a_100000174908_100012066911 [0,2,0,0,0,0|2,0,0]=4 15896 B18R2.274 Cc1ccc(cc1)CNCc2ccc(cn2)Cl 34a_100000697193_100000210814 [0,2,0,0,0,0|2,0,0]=4 15897 B18R2.274 Cc1ccc(cc1)CNCc2ccc(cn2)F 207a_100000174908_100011934744 [0,2,0,0,0,0|2,0,0]=4 15898 B18R2.274 Cc1ccc(cc1)CNCc2ccc(cn2)F 2230a_100000174908_100000703193 [0,2,0,0,0,0|2,0,0]=4 15899 B18R2.274 Cc1ccc(cc1)CNCc2ccc(cn2)F 270004a_100000174908_100011934744 [0,2,0,0,0,0|2,0,0]=4 15900 B18R2.274 Cc1ccc(cc1)CNCc2ccc(cn2)F 34a_100000174908_100000703193 [0,2,0,0,0,0|2,0,0]=4 15901 B18R2.274 Cc1ccc(cc1)CNCc2ccc(cn2)F 34a_100020620131_100000210814 [0,2,0,0,0,0|2,0,0]=4 15902 B18R2.274 Cc1ccc(cc1)CNCc2ccc(nc2)Br 207a_100009817727_100000211033 [0,2,0,0,0,0|2,0,0]=4 15903 B18R2.274 Cc1ccc(cc1)CNCc2ccc(nc2)Br 2230a_100000174908_100009831999 [0,2,0,0,0,0|2,0,0]=4 15904 B18R2.274 Cc1ccc(cc1)CNCc2ccc(nc2)Br 2230a_100009817727_100000210814 [0,2,0,0,0,0|2,0,0]=4 15905 B18R2.274 Cc1ccc(cc1)CNCc2ccc(nc2)Br 270004a_100009817727_100000211033 [0,2,0,0,0,0|2,0,0]=4 15906 B18R2.274 Cc1ccc(cc1)CNCc2ccc(nc2)Br 34a_100000174908_100009831999 [0,2,0,0,0,0|2,0,0]=4 15907 B18R2.274 Cc1ccc(cc1)CNCc2ccc(nc2)Br 34a_100009817727_100000210814 [0,2,0,0,0,0|2,0,0]=4 15908 B18R2.274 Cc1ccc(cc1)CNCc2ccc(nc2)C 207a_100000740942_100000211033 [0,2,0,0,0,0|2,0,0]=4 15909 B18R2.274 Cc1ccc(cc1)CNCc2ccc(nc2)C 2230a_100000174908_100016987292 [0,2,0,0,0,0|2,0,0]=4 15910 B18R2.274 Cc1ccc(cc1)CNCc2ccc(nc2)C 270004a_100000174908_100000743784 [0,2,0,0,0,0|2,0,0]=4 15911 B18R2.274 Cc1ccc(cc1)CNCc2ccc(nc2)C 270004a_100000740942_100000211033 [0,2,0,0,0,0|2,0,0]=4 15912 B18R2.274 Cc1ccc(cc1)CNCc2ccc(nc2)C 34a_100000174908_100016987292 [0,2,0,0,0,0|2,0,0]=4 15913 B18R2.274 Cc1ccc(cc1)CNCc2ccc(nc2)C 34a_100000740942_100000210814 [0,2,0,0,0,0|2,0,0]=4 15914 B18R2.274 Cc1ccc(cc1)CNCc2ccc(nc2)Cl 207a_100000735879_100000211033 [0,2,0,0,0,0|2,0,0]=4 15915 B18R2.274 Cc1ccc(cc1)CNCc2ccc(nc2)Cl 2230a_100000174908_100000735431 [0,2,0,0,0,0|2,0,0]=4 15916 B18R2.274 Cc1ccc(cc1)CNCc2ccc(nc2)Cl 2230a_100000735879_100000210814 [0,2,0,0,0,0|2,0,0]=4 15917 B18R2.274 Cc1ccc(cc1)CNCc2ccc(nc2)Cl 270004a_100000735879_100000211033 [0,2,0,0,0,0|2,0,0]=4 15918 B18R2.274 Cc1ccc(cc1)CNCc2ccc(nc2)Cl 34a_100000174908_100000735431 [0,2,0,0,0,0|2,0,0]=4 15919 B18R2.274 Cc1ccc(cc1)CNCc2ccc(nc2)Cl 34a_100000735879_100000210814 [0,2,0,0,0,0|2,0,0]=4 15920 B18R2.274 Cc1ccc(cc1)CNCc2ccc(nc2)F 2230a_100000101913_100000210814 [0,2,0,0,0,0|2,0,0]=4 15921 B18R2.274 Cc1ccc(cc1)CNCc2ccc(nc2)F 2230a_100000174908_100009820150 [0,2,0,0,0,0|2,0,0]=4 15922 B18R2.274 Cc1ccc(cc1)CNCc2ccc(nc2)F 270004a_100000101913_100000211033 [0,2,0,0,0,0|2,0,0]=4 15923 B18R2.274 Cc1ccc(cc1)CNCc2ccc(nc2)F 34a_100000101913_100000210814 [0,2,0,0,0,0|2,0,0]=4 15924 B18R2.274 Cc1ccc(cc1)CNCc2ccc(nc2)F 34a_100000174908_100000099788 [0,2,0,0,0,0|2,0,0]=4 15925 B18R2.274 Cc1ccc(cc1)CNCc2ccc(nc2)O 207a_100000174908_100011361521 [0,2,0,0,0,0|2,0,0]=4 15926 B18R2.274 Cc1ccc(cc1)CNCc2ccc(nc2)O 2230a_100000757128_100000210814 [0,2,0,0,0,0|2,0,0]=4 15927 B18R2.274 Cc1ccc(cc1)COCc2cc[n+](cc2)C 34a_100009831711_100000210814 [0,2,0,0,0,0|1,0,0]=3 15928 B18R2.274 Cc1ccc(cc1)COCc2cc[n+](cc2)[O-] 34a_100000031831_100000210814 [0,2,0,0,0,0|1,0,0]=3 15929 B18R2.274 Cc1ccc(cc1)COCc2cc[n+](cc2)[O-] 7a_100000031831_100000210814 [0,2,0,0,0,0|1,0,0]=3 15930 B18R2.274 Cc1ccc(cc1)COCc2ccc(=O)[nH]c2 34a_100011999846_100000210814 [0,2,0,0,0,0|1,0,0]=3 15931 B18R2.274 Cc1ccc(cc1)COCc2ccc(cc2)Br 34a_100000695286_100000210814 [0,2,0,0,0,0|0,0,0]=2 15932 B18R2.274 Cc1ccc(cc1)COCc2ccc(cc2)Br 34a_100011215236_100000189115 [0,2,0,0,0,0|0,0,0]=2 15933 B18R2.274 Cc1ccc(cc1)COCc2ccc(cc2)Br 7a_100011215236_100011217064 [0,2,0,0,0,0|0,0,0]=2 15934 B18R2.274 Cc1ccc(cc1)COCc2ccc(cc2)C 34a_100011215236_100000210814 [0,2,0,0,0,0|0,0,0]=2 15935 B18R2.274 Cc1ccc(cc1)COCc2ccc(cc2)C 7a_100011215236_100000210814 [0,2,0,0,0,0|0,0,0]=2 15936 B18R2.274 Cc1ccc(cc1)COCc2ccc(cc2)Cl 34a_100000211118_100000210814 [0,2,0,0,0,0|0,0,0]=2 15937 B18R2.274 Cc1ccc(cc1)COCc2ccc(cc2)Cl 34a_100011215236_100000694040 [0,2,0,0,0,0|0,0,0]=2 15938 B18R2.274 Cc1ccc(cc1)COCc2ccc(cc2)Cl 7a_100000211118_100000210814 [0,2,0,0,0,0|0,0,0]=2 15939 B18R2.274 Cc1ccc(cc1)COCc2ccc(cc2)Cl 7a_100011215236_100000187161 [0,2,0,0,0,0|0,0,0]=2 15940 B18R2.274 Cc1ccc(cc1)COCc2ccc(cc2)F 34a_100000210977_100000210814 [0,2,0,0,0,0|0,0,0]=2 15941 B18R2.274 Cc1ccc(cc1)COCc2ccc(cc2)F 34a_100011215236_100000198546 [0,2,0,0,0,0|0,0,0]=2 15942 B18R2.274 Cc1ccc(cc1)COCc2ccc(cc2)F 7a_100000210977_100000210814 [0,2,0,0,0,0|0,0,0]=2 15943 B18R2.274 Cc1ccc(cc1)COCc2ccc(cc2)F 7a_100011215236_100000198546 [0,2,0,0,0,0|0,0,0]=2 15944 B18R2.274 Cc1ccc(cc1)COCc2ccc(cc2)I 34a_100000690907_100000210814 [0,2,0,0,0,0|0,0,0]=2 15945 B18R2.274 Cc1ccc(cc1)COCc2ccc(cc2)I 34a_100011215236_100000189116 [0,2,0,0,0,0|0,0,0]=2 15946 B18R2.274 Cc1ccc(cc1)COCc2ccc(cc2)I 7a_100000690907_100000210814 [0,2,0,0,0,0|0,0,0]=2 15947 B18R2.274 Cc1ccc(cc1)COCc2ccc(cc2)I 7a_100011215236_100000189116 [0,2,0,0,0,0|0,0,0]=2 15948 B18R2.274 Cc1ccc(cc1)COCc2ccc(cc2)N 34a_100011215238_100000210814 [0,2,0,0,0,0|0,0,0]=2 15949 B18R2.274 Cc1ccc(cc1)COCc2ccc(cn2)Br 34a_100000754261_100000210814 [0,2,0,0,0,0|1,0,0]=3 15950 B18R2.274 Cc1ccc(cc1)COCc2ccc(cn2)Br 34a_100011215236_100000702658 [0,2,0,0,0,0|1,0,0]=3 15951 B18R2.274 Cc1ccc(cc1)COCc2ccc(cn2)Br 7a_100011215236_100000702658 [0,2,0,0,0,0|1,0,0]=3 15952 B18R2.274 Cc1ccc(cc1)COCc2ccc(cn2)C 34a_100011215236_100000691093 [0,2,0,0,0,0|1,0,0]=3 15953 B18R2.274 Cc1ccc(cc1)COCc2ccc(cn2)C 34a_100012001401_100000210814 [0,2,0,0,0,0|1,0,0]=3 15954 B18R2.274 Cc1ccc(cc1)COCc2ccc(cn2)C 7a_100011215236_100000691093 [0,2,0,0,0,0|1,0,0]=3 15955 B18R2.274 Cc1ccc(cc1)COCc2ccc(cn2)Cl 34a_100000703999_100000210814 [0,2,0,0,0,0|1,0,0]=3 15956 B18R2.274 Cc1ccc(cc1)COCc2ccc(cn2)Cl 34a_100011215236_100012066911 [0,2,0,0,0,0|1,0,0]=3 15957 B18R2.274 Cc1ccc(cc1)COCc2ccc(cn2)Cl 7a_100011215236_100012066911 [0,2,0,0,0,0|1,0,0]=3 15958 B18R2.274 Cc1ccc(cc1)COCc2ccc(cn2)F 34a_100011215236_100000703193 [0,2,0,0,0,0|1,0,0]=3 15959 B18R2.274 Cc1ccc(cc1)COCc2ccc(cn2)F 34a_100011999454_100000210814 [0,2,0,0,0,0|1,0,0]=3 15960 B18R2.274 Cc1ccc(cc1)COCc2ccc(cn2)F 7a_100011215236_100000703193 [0,2,0,0,0,0|1,0,0]=3 15961 B18R2.274 Cc1ccc(cc1)COCc2ccc(cn2)N 34a_100011998161_100000210814 [0,2,0,0,0,0|1,0,0]=3 15962 B18R2.274 Cc1ccc(cc1)COCc2ccc(nc2)Br 34a_100009816760_100000210814 [0,2,0,0,0,0|1,0,0]=3 15963 B18R2.274 Cc1ccc(cc1)COCc2ccc(nc2)Br 34a_100011215236_100009831999 [0,2,0,0,0,0|1,0,0]=3 15964 B18R2.274 Cc1ccc(cc1)COCc2ccc(nc2)Br 7a_100009816760_100000210814 [0,2,0,0,0,0|1,0,0]=3 15965 B18R2.274 Cc1ccc(cc1)COCc2ccc(nc2)Br 7a_100011215236_100009831999 [0,2,0,0,0,0|1,0,0]=3 15966 B18R2.274 Cc1ccc(cc1)COCc2ccc(nc2)C 34a_100011215236_100016987292 [0,2,0,0,0,0|1,0,0]=3 15967 B18R2.274 Cc1ccc(cc1)COCc2ccc(nc2)C 34a_100011248133_100000210814 [0,2,0,0,0,0|1,0,0]=3 15968 B18R2.274 Cc1ccc(cc1)COCc2ccc(nc2)C 7a_100011215236_100016987292 [0,2,0,0,0,0|1,0,0]=3 15969 B18R2.274 Cc1ccc(cc1)COCc2ccc(nc2)Cl 34a_100000755211_100000210814 [0,2,0,0,0,0|1,0,0]=3 15970 B18R2.274 Cc1ccc(cc1)COCc2ccc(nc2)Cl 34a_100011215236_100000735431 [0,2,0,0,0,0|1,0,0]=3 15971 B18R2.274 Cc1ccc(cc1)COCc2ccc(nc2)Cl 7a_100000755211_100000210814 [0,2,0,0,0,0|1,0,0]=3 15972 B18R2.274 Cc1ccc(cc1)COCc2ccc(nc2)Cl 7a_100011215236_100000735431 [0,2,0,0,0,0|1,0,0]=3 15973 B18R2.274 Cc1ccc(cc1)COCc2ccc(nc2)F 34a_100000079959_100000210814 [0,2,0,0,0,0|1,0,0]=3 15974 B18R2.274 Cc1ccc(cc1)COCc2ccc(nc2)F 34a_100011215236_100000099788 [0,2,0,0,0,0|1,0,0]=3 15975 B18R2.274 Cc1ccc(cc1)COCc2ccc(nc2)F 7a_100011215236_100009820150 [0,2,0,0,0,0|1,0,0]=3 15976 B18R2.274 Cc1ccc(cc1)COCc2ccc(nc2)N 34a_100000704267_100000210814 [0,2,0,0,0,0|1,0,0]=3 15977 B18R2.274 Cc1ccc(cc1)COCc2ccc(nn2)Cl 34a_100011215236_100016992710 [0,2,0,0,0,0|2,0,0]=4 15978 B18R2.274 Cc1ccc(cc1)COCc2ccc(nn2)Cl 7a_100011215236_100016992710 [0,2,0,0,0,0|2,0,0]=4 15979 B18R2.274 Cc1ccc(cc1)COCc2cnc(cn2)C 34a_100011273949_100000210814 [0,2,0,0,0,0|2,0,0]=4 15980 B18R2.274 Cc1ccc(cc1)COCc2cnc(cn2)C 7a_100011215236_100000752025 [0,2,0,0,0,0|2,0,0]=4 15981 B18R2.274 Cc1ccc(cc1)COCc2cnc(cn2)Cl 34a_100012002382_100000210814 [0,2,0,0,0,0|2,0,0]=4 15982 B18R2.274 Cc1ccc(cc1)COCc2cnc(nc2)C 34a_100011746891_100000210814 [0,2,0,0,0,0|2,0,0]=4 15983 B18R2.274 Cc1ccc(cc1)COCc2cnc(nc2)Cl 34a_100009855073_100000210814 [0,2,0,0,0,0|2,0,0]=4 15984 B18R2.274 Cc1ccc(cc1)COCc2cnc(nc2)Cl 7a_100009855073_100000210814 [0,2,0,0,0,0|2,0,0]=4 15985 B18R2.274 Cc1ccc(cc1)COCc2ncc(cn2)Br 34a_100011215236_100010064664 [0,2,0,0,0,0|2,0,0]=4 15986 B18R2.274 Cc1ccc(cc1)COCc2ncc(cn2)Br 7a_100011215236_100010064664 [0,2,0,0,0,0|2,0,0]=4 15987 B18R2.274 Cc1ccc(cc1)COCc2ncc(cn2)C 34a_100011215236_100000685645 [0,2,0,0,0,0|2,0,0]=4 15988 B18R2.274 Cc1ccc(cc1)COCc2ncc(cn2)C 7a_100011215236_100000685645 [0,2,0,0,0,0|2,0,0]=4 15989 B18R2.274 Cc1ccc(cc1)CSCc2ccc(cc2)Br 62a_100000189115_100000210814 [0,2,0,0,0,0|0,1,0]=3 15990 B18R2.274 Cc1ccc(cc1)CSCc2ccc(cc2)Br 62a_100000210814_100000189115 [0,2,0,0,0,0|0,1,0]=3 15991 B18R2.274 Cc1ccc(cc1)CSCc2ccc(cc2)C 62a_100000210814_100000210814 [0,2,0,0,0,0|0,1,0]=3 15992 B18R2.274 Cc1ccc(cc1)CSCc2ccc(cc2)Cl 62a_100000187161_100000210814 [0,2,0,0,0,0|0,1,0]=3 15993 B18R2.274 Cc1ccc(cc1)CSCc2ccc(cc2)Cl 62a_100000210814_100000187161 [0,2,0,0,0,0|0,1,0]=3 15994 B18R2.274 Cc1ccc(cc1)CSCc2ccc(cc2)F 62a_100000198546_100000210814 [0,2,0,0,0,0|0,1,0]=3 15995 B18R2.274 Cc1ccc(cc1)CSCc2ccc(cc2)F 62a_100000210814_100000187164 [0,2,0,0,0,0|0,1,0]=3 15996 B18R2.274 Cc1ccc(cc1)CSCc2ccc(cc2)I 62a_100000189116_100000210814 [0,2,0,0,0,0|0,1,0]=3 15997 B18R2.274 Cc1ccc(cc1)CSCc2ccc(cc2)I 62a_100000210814_100000189116 [0,2,0,0,0,0|0,1,0]=3 15998 B18R2.274 Cc1ccc(cc1)CSCc2ccc(cn2)Br 62a_100000210814_100000702658 [0,2,0,0,0,0|1,1,0]=4 15999 B18R2.274 Cc1ccc(cc1)CSCc2ccc(cn2)Br 62a_100000702658_100000210814 [0,2,0,0,0,0|1,1,0]=4 16000 B18R2.274 Cc1ccc(cc1)CSCc2ccc(cn2)C 62a_100000210814_100000691093 [0,2,0,0,0,0|1,1,0]=4 16001 B18R2.274 Cc1ccc(cc1)CSCc2ccc(cn2)C 62a_100000691093_100000210814 [0,2,0,0,0,0|1,1,0]=4 16002 B18R2.274 Cc1ccc(cc1)CSCc2ccc(cn2)Cl 62a_100000210814_100000697101 [0,2,0,0,0,0|1,1,0]=4 16003 B18R2.274 Cc1ccc(cc1)CSCc2ccc(cn2)Cl 62a_100012066911_100000210814 [0,2,0,0,0,0|1,1,0]=4 16004 B18R2.274 Cc1ccc(cc1)CSCc2ccc(cn2)F 62a_100000210814_100000703193 [0,2,0,0,0,0|1,1,0]=4 16005 B18R2.274 Cc1ccc(cc1)CSCc2ccc(cn2)F 62a_100000703193_100000210814 [0,2,0,0,0,0|1,1,0]=4 16006 B18R2.274 Cc1ccc(cc1)CSCc2ccc(nc2)Br 62a_100000210814_100009831999 [0,2,0,0,0,0|1,1,0]=4 16007 B18R2.274 Cc1ccc(cc1)CSCc2ccc(nc2)Br 62a_100009831999_100000210814 [0,2,0,0,0,0|1,1,0]=4 16008 B18R2.274 Cc1ccc(cc1)CSCc2ccc(nc2)C 62a_100000210814_100016987292 [0,2,0,0,0,0|1,1,0]=4 16009 B18R2.274 Cc1ccc(cc1)CSCc2ccc(nc2)C 62a_100016987292_100000210814 [0,2,0,0,0,0|1,1,0]=4 16010 B18R2.274 Cc1ccc(cc1)CSCc2ccc(nc2)Cl 62a_100000210814_100000735431 [0,2,0,0,0,0|1,1,0]=4 16011 B18R2.274 Cc1ccc(cc1)CSCc2ccc(nc2)Cl 62a_100000735431_100000210814 [0,2,0,0,0,0|1,1,0]=4 16012 B18R2.274 Cc1ccc(cc1)CSCc2ccc(nc2)F 62a_100000210814_100000099788 [0,2,0,0,0,0|1,1,0]=4 16013 B18R2.274 Cc1ccc(cc1)CSCc2ccc(nc2)F 62a_100009820150_100000210814 [0,2,0,0,0,0|1,1,0]=4 16014 B18R2.274 Cc1ccc(cc1)NCCc2ccc(cc2)Br 34a_100000124888_100011740612 [0,2,0,0,0,0|2,0,0]=4 16015 B18R2.274 Cc1ccc(cc1)NCCc2ccc(cc2)Cl 34a_100000124888_100011713675 [0,2,0,0,0,0|2,0,0]=4 16016 B18R2.274 Cc1ccc(cc1)NCCc2ccc(cc2)F 34a_100000124888_100011217392 [0,2,0,0,0,0|2,0,0]=4 16017 B18R2.274 Cc1ccc(cc1)OCCc2ccc(cc2)Br 34a_100000210336_100011740612 [0,2,0,0,0,0|2,0,0]=4 16018 B18R2.274 Cc1ccc(cc1)OCCc2ccc(cc2)Br 7a_100000210336_100011740612 [0,2,0,0,0,0|2,0,0]=4 16019 B18R2.274 Cc1ccc(cc1)OCCc2ccc(cc2)Cl 34a_100000210336_100011713675 [0,2,0,0,0,0|2,0,0]=4 16020 B18R2.274 Cc1ccc(cc1)OCCc2ccc(cc2)Cl 7a_100000210336_100011713675 [0,2,0,0,0,0|2,0,0]=4 16021 B18R2.274 Cc1ccc(cc1)OCCc2ccc(cc2)F 34a_100000210336_100011217392 [0,2,0,0,0,0|2,0,0]=4 16022 B18R2.274 Cc1ccc(cc1)OCCc2ccc(cc2)F 7a_100000210336_100011217392 [0,2,0,0,0,0|2,0,0]=4 16023 B18R2.274 Cc1ccc(cc1)OCCc2ccc(cc2)O 7a_100000210336_100009816426 [0,2,0,0,0,0|2,0,0]=4 16024 B18R2.274 Cc1ccc(cc1)SCCc2ccc(cc2)Br 62a_100000186775_100011740612 [0,2,0,0,0,0|2,0,0]=4 16025 B18R2.274 Cc1ccc(cc1)SCCc2ccc(cc2)Br 62a_100011740612_100000186775 [0,2,0,0,0,0|2,0,0]=4 16026 B18R2.274 Cc1ccc(cc1)SCCc2ccc(cc2)Cl 62a_100000186775_100011713675 [0,2,0,0,0,0|2,0,0]=4 16027 B18R2.274 Cc1ccc(cc1)SCCc2ccc(cc2)Cl 62a_100011713675_100000186775 [0,2,0,0,0,0|2,0,0]=4 16028 B18R2.274 Cc1ccc(cc1)SCCc2ccc(cc2)F 62a_100000186775_100011217392 [0,2,0,0,0,0|2,0,0]=4 16029 B18R2.274 Cc1ccc(cc1)SCCc2ccc(cc2)F 62a_100011217392_100000186775 [0,2,0,0,0,0|2,0,0]=4 16030 B18R2.274 Cc1ccc(cc1)SCCc2ccc(cc2)O 62a_100000186775_100009816426 [0,2,0,0,0,0|2,0,0]=4 16031 B18R2.274 Cc1ccc(cc1)SCCc2ccc(cc2)O 62a_100009816426_100000186775 [0,2,0,0,0,0|2,0,0]=4 16032 B18R2.274 Cc1ccc(cn1)CNCc2ccc(cc2)Br 207a_100000740942_100000186029 [0,2,0,0,0,0|2,0,0]=4 16033 B18R2.274 Cc1ccc(cn1)CNCc2ccc(cc2)Br 2230a_100000174875_100016987292 [0,2,0,0,0,0|2,0,0]=4 16034 B18R2.274 Cc1ccc(cn1)CNCc2ccc(cc2)Br 270004a_100000174875_100000743784 [0,2,0,0,0,0|2,0,0]=4 16035 B18R2.274 Cc1ccc(cn1)CNCc2ccc(cc2)Br 270004a_100000740942_100000186029 [0,2,0,0,0,0|2,0,0]=4 16036 B18R2.274 Cc1ccc(cn1)CNCc2ccc(cc2)Br 34a_100000174875_100016987292 [0,2,0,0,0,0|2,0,0]=4 16037 B18R2.274 Cc1ccc(cn1)CNCc2ccc(cc2)Br 34a_100000740942_100000189115 [0,2,0,0,0,0|2,0,0]=4 16038 B18R2.274 Cc1ccc(cn1)CNCc2ccc(cc2)Cl 207a_100000740942_100000189385 [0,2,0,0,0,0|2,0,0]=4 16039 B18R2.274 Cc1ccc(cn1)CNCc2ccc(cc2)Cl 2230a_100000174871_100016987292 [0,2,0,0,0,0|2,0,0]=4 16040 B18R2.274 Cc1ccc(cn1)CNCc2ccc(cc2)Cl 270004a_100000174871_100000743784 [0,2,0,0,0,0|2,0,0]=4 16041 B18R2.274 Cc1ccc(cn1)CNCc2ccc(cc2)Cl 270004a_100000740942_100000189385 [0,2,0,0,0,0|2,0,0]=4 16042 B18R2.274 Cc1ccc(cn1)CNCc2ccc(cc2)Cl 34a_100000174871_100016987292 [0,2,0,0,0,0|2,0,0]=4 16043 B18R2.274 Cc1ccc(cn1)CNCc2ccc(cc2)Cl 34a_100000740942_100000694040 [0,2,0,0,0,0|2,0,0]=4 16044 B18R2.274 Cc1ccc(cn1)CNCc2ccc(cc2)F 207a_100000740942_100000210084 [0,2,0,0,0,0|2,0,0]=4 16045 B18R2.274 Cc1ccc(cn1)CNCc2ccc(cc2)F 2230a_100000174882_100016987292 [0,2,0,0,0,0|2,0,0]=4 16046 B18R2.274 Cc1ccc(cn1)CNCc2ccc(cc2)F 270004a_100000174882_100000743784 [0,2,0,0,0,0|2,0,0]=4 16047 B18R2.274 Cc1ccc(cn1)CNCc2ccc(cc2)F 270004a_100000740942_100000210084 [0,2,0,0,0,0|2,0,0]=4 16048 B18R2.274 Cc1ccc(cn1)CNCc2ccc(cc2)F 34a_100000174882_100016987292 [0,2,0,0,0,0|2,0,0]=4 16049 B18R2.274 Cc1ccc(cn1)CNCc2ccc(cc2)F 34a_100000740942_100000198546 [0,2,0,0,0,0|2,0,0]=4 16050 B18R2.274 Cc1ccc(cn1)CNCc2ccc(cc2)I 207a_100000740942_100000188517 [0,2,0,0,0,0|2,0,0]=4 16051 B18R2.274 Cc1ccc(cn1)CNCc2ccc(cc2)I 2230a_100016989417_100016987292 [0,2,0,0,0,0|2,0,0]=4 16052 B18R2.274 Cc1ccc(cn1)CNCc2ccc(cc2)I 270004a_100016989417_100000743784 [0,2,0,0,0,0|2,0,0]=4 16053 B18R2.274 Cc1ccc(cn1)CNCc2ccc(cc2)I 34a_100000740942_100000189116 [0,2,0,0,0,0|2,0,0]=4 16054 B18R2.274 Cc1ccc(cn1)CNCc2ccc(cc2)I 34a_100016989417_100016987292 [0,2,0,0,0,0|2,0,0]=4 16055 B18R2.274 Cc1ccc(cn1)CNCc2ccc(cc2)O 34a_100000185549_100016987292 [0,2,0,0,0,0|2,0,0]=4 16056 B18R2.274 Cc1ccc(cn1)COCc2cc[n+](cc2)C 34a_100009831711_100016987292 [0,2,0,0,0,0|2,0,0]=4 16057 B18R2.274 Cc1ccc(cn1)COCc2cc[n+](cc2)[O-] 34a_100000031831_100016987292 [0,2,0,0,0,0|2,0,0]=4 16058 B18R2.274 Cc1ccc(cn1)COCc2cc[n+](cc2)[O-] 7a_100000031831_100016987292 [0,2,0,0,0,0|2,0,0]=4 16059 B18R2.274 Cc1ccc(cn1)COCc2ccc(=O)[nH]c2 34a_100011999846_100016987292 [0,2,0,0,0,0|2,0,0]=4 16060 B18R2.274 Cc1ccc(cn1)COCc2ccc(cc2)Br 34a_100000695286_100016987292 [0,2,0,0,0,0|1,0,0]=3 16061 B18R2.274 Cc1ccc(cn1)COCc2ccc(cc2)Br 34a_100011248133_100000189115 [0,2,0,0,0,0|1,0,0]=3 16062 B18R2.274 Cc1ccc(cn1)COCc2ccc(cc2)Cl 34a_100000211118_100016987292 [0,2,0,0,0,0|1,0,0]=3 16063 B18R2.274 Cc1ccc(cn1)COCc2ccc(cc2)Cl 34a_100011248133_100000694040 [0,2,0,0,0,0|1,0,0]=3 16064 B18R2.274 Cc1ccc(cn1)COCc2ccc(cc2)Cl 7a_100000211118_100016987292 [0,2,0,0,0,0|1,0,0]=3 16065 B18R2.274 Cc1ccc(cn1)COCc2ccc(cc2)F 34a_100000210977_100016987292 [0,2,0,0,0,0|1,0,0]=3 16066 B18R2.274 Cc1ccc(cn1)COCc2ccc(cc2)F 34a_100011248133_100000198546 [0,2,0,0,0,0|1,0,0]=3 16067 B18R2.274 Cc1ccc(cn1)COCc2ccc(cc2)F 7a_100000210977_100016987292 [0,2,0,0,0,0|1,0,0]=3 16068 B18R2.274 Cc1ccc(cn1)COCc2ccc(cc2)I 34a_100000690907_100016987292 [0,2,0,0,0,0|1,0,0]=3 16069 B18R2.274 Cc1ccc(cn1)COCc2ccc(cc2)I 34a_100011248133_100000189116 [0,2,0,0,0,0|1,0,0]=3 16070 B18R2.274 Cc1ccc(cn1)COCc2ccc(cc2)I 7a_100000690907_100016987292 [0,2,0,0,0,0|1,0,0]=3 16071 B18R2.274 Cc1ccc(cn1)COCc2ccc(cc2)N 34a_100011215238_100016987292 [0,2,0,0,0,0|1,0,0]=3 16072 B18R2.274 Cc1ccc(cn1)COCc2ccc(cn2)Br 34a_100000754261_100016987292 [0,2,0,0,0,0|2,0,0]=4 16073 B18R2.274 Cc1ccc(cn1)COCc2ccc(cn2)Br 34a_100011248133_100000702658 [0,2,0,0,0,0|2,0,0]=4 16074 B18R2.274 Cc1ccc(cn1)COCc2ccc(cn2)Cl 34a_100000703999_100016987292 [0,2,0,0,0,0|2,0,0]=4 16075 B18R2.274 Cc1ccc(cn1)COCc2ccc(cn2)Cl 34a_100011248133_100012066911 [0,2,0,0,0,0|2,0,0]=4 16076 B18R2.274 Cc1ccc(cn1)COCc2ccc(cn2)F 34a_100011248133_100000703193 [0,2,0,0,0,0|2,0,0]=4 16077 B18R2.274 Cc1ccc(cn1)COCc2ccc(cn2)F 34a_100011999454_100016987292 [0,2,0,0,0,0|2,0,0]=4 16078 B18R2.274 Cc1ccc(cn1)COCc2ccc(cn2)N 34a_100011998161_100016987292 [0,2,0,0,0,0|2,0,0]=4 16079 B18R2.274 Cc1ccc(cn1)COCc2ccc(nc2)Br 34a_100009816760_100016987292 [0,2,0,0,0,0|2,0,0]=4 16080 B18R2.274 Cc1ccc(cn1)COCc2ccc(nc2)Br 34a_100011248133_100009831999 [0,2,0,0,0,0|2,0,0]=4 16081 B18R2.274 Cc1ccc(cn1)COCc2ccc(nc2)Br 7a_100009816760_100016987292 [0,2,0,0,0,0|2,0,0]=4 16082 B18R2.274 Cc1ccc(cn1)COCc2ccc(nc2)C 34a_100011248133_100016987292 [0,2,0,0,0,0|2,0,0]=4 16083 B18R2.274 Cc1ccc(cn1)COCc2ccc(nc2)Cl 34a_100000755211_100016987292 [0,2,0,0,0,0|2,0,0]=4 16084 B18R2.274 Cc1ccc(cn1)COCc2ccc(nc2)Cl 34a_100011248133_100000735431 [0,2,0,0,0,0|2,0,0]=4 16085 B18R2.274 Cc1ccc(cn1)COCc2ccc(nc2)Cl 7a_100000755211_100016987292 [0,2,0,0,0,0|2,0,0]=4 16086 B18R2.274 Cc1ccc(cn1)COCc2ccc(nc2)F 34a_100000079959_100016987292 [0,2,0,0,0,0|2,0,0]=4 16087 B18R2.274 Cc1ccc(cn1)COCc2ccc(nc2)F 34a_100011248133_100000099788 [0,2,0,0,0,0|2,0,0]=4 16088 B18R2.274 Cc1ccc(cn1)COCc2ccc(nc2)N 34a_100000704267_100016987292 [0,2,0,0,0,0|2,0,0]=4 16089 B18R2.274 Cc1ccc(cn1)CSCc2ccc(cc2)Br 62a_100000189115_100016987292 [0,2,0,0,0,0|1,1,0]=4 16090 B18R2.274 Cc1ccc(cn1)CSCc2ccc(cc2)Br 62a_100016987292_100000189115 [0,2,0,0,0,0|1,1,0]=4 16091 B18R2.274 Cc1ccc(cn1)CSCc2ccc(cc2)Cl 62a_100000187161_100016987292 [0,2,0,0,0,0|1,1,0]=4 16092 B18R2.274 Cc1ccc(cn1)CSCc2ccc(cc2)Cl 62a_100016987292_100000187161 [0,2,0,0,0,0|1,1,0]=4 16093 B18R2.274 Cc1ccc(cn1)CSCc2ccc(cc2)F 62a_100000198546_100016987292 [0,2,0,0,0,0|1,1,0]=4 16094 B18R2.274 Cc1ccc(cn1)CSCc2ccc(cc2)F 62a_100016987292_100000187164 [0,2,0,0,0,0|1,1,0]=4 16095 B18R2.274 Cc1ccc(cn1)CSCc2ccc(cc2)I 62a_100000189116_100016987292 [0,2,0,0,0,0|1,1,0]=4 16096 B18R2.274 Cc1ccc(cn1)CSCc2ccc(cc2)I 62a_100016987292_100000189116 [0,2,0,0,0,0|1,1,0]=4 16097 B18R2.274 Cc1ccc(nc1)CNCc2ccc(cc2)Br 207a_100000174875_100000050478 [0,2,0,0,0,0|2,0,0]=4 16098 B18R2.274 Cc1ccc(nc1)CNCc2ccc(cc2)Br 2230a_100000174875_100000691093 [0,2,0,0,0,0|2,0,0]=4 16099 B18R2.274 Cc1ccc(nc1)CNCc2ccc(cc2)Br 270004a_100000174875_100000050478 [0,2,0,0,0,0|2,0,0]=4 16100 B18R2.274 Cc1ccc(nc1)CNCc2ccc(cc2)Br 34a_100000174875_100000691093 [0,2,0,0,0,0|2,0,0]=4 16101 B18R2.274 Cc1ccc(nc1)CNCc2ccc(cc2)Br 34a_100015187455_100000189115 [0,2,0,0,0,0|2,0,0]=4 16102 B18R2.274 Cc1ccc(nc1)CNCc2ccc(cc2)Cl 207a_100000174871_100000050478 [0,2,0,0,0,0|2,0,0]=4 16103 B18R2.274 Cc1ccc(nc1)CNCc2ccc(cc2)Cl 2230a_100000174871_100000691093 [0,2,0,0,0,0|2,0,0]=4 16104 B18R2.274 Cc1ccc(nc1)CNCc2ccc(cc2)Cl 270004a_100000174871_100000050478 [0,2,0,0,0,0|2,0,0]=4 16105 B18R2.274 Cc1ccc(nc1)CNCc2ccc(cc2)Cl 34a_100000174871_100000691093 [0,2,0,0,0,0|2,0,0]=4 16106 B18R2.274 Cc1ccc(nc1)CNCc2ccc(cc2)Cl 34a_100015187455_100000694040 [0,2,0,0,0,0|2,0,0]=4 16107 B18R2.274 Cc1ccc(nc1)CNCc2ccc(cc2)F 207a_100000174882_100000050478 [0,2,0,0,0,0|2,0,0]=4 16108 B18R2.274 Cc1ccc(nc1)CNCc2ccc(cc2)F 2230a_100000174882_100000691093 [0,2,0,0,0,0|2,0,0]=4 16109 B18R2.274 Cc1ccc(nc1)CNCc2ccc(cc2)F 270004a_100000174882_100000050478 [0,2,0,0,0,0|2,0,0]=4 16110 B18R2.274 Cc1ccc(nc1)CNCc2ccc(cc2)F 34a_100000174882_100000691093 [0,2,0,0,0,0|2,0,0]=4 16111 B18R2.274 Cc1ccc(nc1)CNCc2ccc(cc2)F 34a_100015187455_100000198546 [0,2,0,0,0,0|2,0,0]=4 16112 B18R2.274 Cc1ccc(nc1)CNCc2ccc(cc2)I 207a_100016989417_100000050478 [0,2,0,0,0,0|2,0,0]=4 16113 B18R2.274 Cc1ccc(nc1)CNCc2ccc(cc2)I 2230a_100016989417_100000691093 [0,2,0,0,0,0|2,0,0]=4 16114 B18R2.274 Cc1ccc(nc1)CNCc2ccc(cc2)I 270004a_100016989417_100000050478 [0,2,0,0,0,0|2,0,0]=4 16115 B18R2.274 Cc1ccc(nc1)CNCc2ccc(cc2)I 34a_100015187455_100000189116 [0,2,0,0,0,0|2,0,0]=4 16116 B18R2.274 Cc1ccc(nc1)CNCc2ccc(cc2)I 34a_100016989417_100000691093 [0,2,0,0,0,0|2,0,0]=4 16117 B18R2.274 Cc1ccc(nc1)CNCc2ccc(cc2)O 34a_100000185549_100000691093 [0,2,0,0,0,0|2,0,0]=4 16118 B18R2.274 Cc1ccc(nc1)COCc2cc[n+](cc2)C 34a_100009831711_100000691093 [0,2,0,0,0,0|2,0,0]=4 16119 B18R2.274 Cc1ccc(nc1)COCc2cc[n+](cc2)[O-] 34a_100000031831_100000691093 [0,2,0,0,0,0|2,0,0]=4 16120 B18R2.274 Cc1ccc(nc1)COCc2cc[n+](cc2)[O-] 7a_100000031831_100000691093 [0,2,0,0,0,0|2,0,0]=4 16121 B18R2.274 Cc1ccc(nc1)COCc2ccc(=O)[nH]c2 34a_100011999846_100000691093 [0,2,0,0,0,0|2,0,0]=4 16122 B18R2.274 Cc1ccc(nc1)COCc2ccc(cc2)Br 34a_100000695286_100000691093 [0,2,0,0,0,0|1,0,0]=3 16123 B18R2.274 Cc1ccc(nc1)COCc2ccc(cc2)Br 34a_100012001401_100000189115 [0,2,0,0,0,0|1,0,0]=3 16124 B18R2.274 Cc1ccc(nc1)COCc2ccc(cc2)Cl 34a_100000211118_100000691093 [0,2,0,0,0,0|1,0,0]=3 16125 B18R2.274 Cc1ccc(nc1)COCc2ccc(cc2)Cl 34a_100012001401_100000694040 [0,2,0,0,0,0|1,0,0]=3 16126 B18R2.274 Cc1ccc(nc1)COCc2ccc(cc2)Cl 7a_100000211118_100000691093 [0,2,0,0,0,0|1,0,0]=3 16127 B18R2.274 Cc1ccc(nc1)COCc2ccc(cc2)F 34a_100000210977_100000691093 [0,2,0,0,0,0|1,0,0]=3 16128 B18R2.274 Cc1ccc(nc1)COCc2ccc(cc2)F 34a_100012001401_100000198546 [0,2,0,0,0,0|1,0,0]=3 16129 B18R2.274 Cc1ccc(nc1)COCc2ccc(cc2)F 7a_100000210977_100000691093 [0,2,0,0,0,0|1,0,0]=3 16130 B18R2.274 Cc1ccc(nc1)COCc2ccc(cc2)I 34a_100000690907_100000691093 [0,2,0,0,0,0|1,0,0]=3 16131 B18R2.274 Cc1ccc(nc1)COCc2ccc(cc2)I 34a_100012001401_100000189116 [0,2,0,0,0,0|1,0,0]=3 16132 B18R2.274 Cc1ccc(nc1)COCc2ccc(cc2)I 7a_100000690907_100000691093 [0,2,0,0,0,0|1,0,0]=3 16133 B18R2.274 Cc1ccc(nc1)COCc2ccc(cc2)N 34a_100011215238_100000691093 [0,2,0,0,0,0|1,0,0]=3 16134 B18R2.274 Cc1ccc(nc1)COCc2ccc(cn2)Br 34a_100000754261_100000691093 [0,2,0,0,0,0|2,0,0]=4 16135 B18R2.274 Cc1ccc(nc1)COCc2ccc(cn2)Br 34a_100012001401_100000702658 [0,2,0,0,0,0|2,0,0]=4 16136 B18R2.274 Cc1ccc(nc1)COCc2ccc(cn2)C 34a_100012001401_100000691093 [0,2,0,0,0,0|2,0,0]=4 16137 B18R2.274 Cc1ccc(nc1)COCc2ccc(cn2)Cl 34a_100000703999_100000691093 [0,2,0,0,0,0|2,0,0]=4 16138 B18R2.274 Cc1ccc(nc1)COCc2ccc(cn2)Cl 34a_100012001401_100012066911 [0,2,0,0,0,0|2,0,0]=4 16139 B18R2.274 Cc1ccc(nc1)COCc2ccc(cn2)F 34a_100011999454_100000691093 [0,2,0,0,0,0|2,0,0]=4 16140 B18R2.274 Cc1ccc(nc1)COCc2ccc(cn2)F 34a_100012001401_100000703193 [0,2,0,0,0,0|2,0,0]=4 16141 B18R2.274 Cc1ccc(nc1)COCc2ccc(cn2)N 34a_100011998161_100000691093 [0,2,0,0,0,0|2,0,0]=4 16142 B18R2.274 Cc1ccc(nc1)COCc2ccc(nc2)Br 34a_100009816760_100000691093 [0,2,0,0,0,0|2,0,0]=4 16143 B18R2.274 Cc1ccc(nc1)COCc2ccc(nc2)Br 34a_100012001401_100009831999 [0,2,0,0,0,0|2,0,0]=4 16144 B18R2.274 Cc1ccc(nc1)COCc2ccc(nc2)Br 7a_100009816760_100000691093 [0,2,0,0,0,0|2,0,0]=4 16145 B18R2.274 Cc1ccc(nc1)COCc2ccc(nc2)C 34a_100011248133_100000691093 [0,2,0,0,0,0|2,0,0]=4 16146 B18R2.274 Cc1ccc(nc1)COCc2ccc(nc2)C 34a_100012001401_100016987292 [0,2,0,0,0,0|2,0,0]=4 16147 B18R2.274 Cc1ccc(nc1)COCc2ccc(nc2)Cl 34a_100000755211_100000691093 [0,2,0,0,0,0|2,0,0]=4 16148 B18R2.274 Cc1ccc(nc1)COCc2ccc(nc2)Cl 34a_100012001401_100000735431 [0,2,0,0,0,0|2,0,0]=4 16149 B18R2.274 Cc1ccc(nc1)COCc2ccc(nc2)Cl 7a_100000755211_100000691093 [0,2,0,0,0,0|2,0,0]=4 16150 B18R2.274 Cc1ccc(nc1)COCc2ccc(nc2)F 34a_100000079959_100000691093 [0,2,0,0,0,0|2,0,0]=4 16151 B18R2.274 Cc1ccc(nc1)COCc2ccc(nc2)F 34a_100012001401_100000099788 [0,2,0,0,0,0|2,0,0]=4 16152 B18R2.274 Cc1ccc(nc1)COCc2ccc(nc2)N 34a_100000704267_100000691093 [0,2,0,0,0,0|2,0,0]=4 16153 B18R2.274 Cc1ccc(nc1)CSCc2ccc(cc2)Br 62a_100000189115_100000691093 [0,2,0,0,0,0|1,1,0]=4 16154 B18R2.274 Cc1ccc(nc1)CSCc2ccc(cc2)Br 62a_100000691093_100000189115 [0,2,0,0,0,0|1,1,0]=4 16155 B18R2.274 Cc1ccc(nc1)CSCc2ccc(cc2)Cl 62a_100000187161_100000691093 [0,2,0,0,0,0|1,1,0]=4 16156 B18R2.274 Cc1ccc(nc1)CSCc2ccc(cc2)Cl 62a_100000691093_100000187161 [0,2,0,0,0,0|1,1,0]=4 16157 B18R2.274 Cc1ccc(nc1)CSCc2ccc(cc2)F 62a_100000198546_100000691093 [0,2,0,0,0,0|1,1,0]=4 16158 B18R2.274 Cc1ccc(nc1)CSCc2ccc(cc2)F 62a_100000691093_100000187164 [0,2,0,0,0,0|1,1,0]=4 16159 B18R2.274 Cc1ccc(nc1)CSCc2ccc(cc2)I 62a_100000189116_100000691093 [0,2,0,0,0,0|1,1,0]=4 16160 B18R2.274 Cc1ccc(nc1)CSCc2ccc(cc2)I 62a_100000691093_100000189116 [0,2,0,0,0,0|1,1,0]=4 16161 B18R2.274 Cc1cnc(cn1)COCc2ccc(cc2)Br 34a_100011273949_100000189115 [0,2,0,0,0,0|2,0,0]=4 16162 B18R2.274 Cc1cnc(cn1)COCc2ccc(cc2)Cl 34a_100011273949_100000694040 [0,2,0,0,0,0|2,0,0]=4 16163 B18R2.274 Cc1cnc(cn1)COCc2ccc(cc2)Cl 7a_100000211118_100000752025 [0,2,0,0,0,0|2,0,0]=4 16164 B18R2.274 Cc1cnc(cn1)COCc2ccc(cc2)F 34a_100011273949_100000198546 [0,2,0,0,0,0|2,0,0]=4 16165 B18R2.274 Cc1cnc(cn1)COCc2ccc(cc2)F 7a_100000210977_100000752025 [0,2,0,0,0,0|2,0,0]=4 16166 B18R2.274 Cc1cnc(cn1)COCc2ccc(cc2)I 34a_100011273949_100000189116 [0,2,0,0,0,0|2,0,0]=4 16167 B18R2.274 Cc1cnc(cn1)COCc2ccc(cc2)I 7a_100000690907_100000752025 [0,2,0,0,0,0|2,0,0]=4 16168 B18R2.274 Cc1cnc(nc1)COCc2ccc(cc2)Br 34a_100000695286_100000685645 [0,2,0,0,0,0|2,0,0]=4 16169 B18R2.274 Cc1cnc(nc1)COCc2ccc(cc2)Cl 34a_100000211118_100000685645 [0,2,0,0,0,0|2,0,0]=4 16170 B18R2.274 Cc1cnc(nc1)COCc2ccc(cc2)Cl 7a_100000211118_100000685645 [0,2,0,0,0,0|2,0,0]=4 16171 B18R2.274 Cc1cnc(nc1)COCc2ccc(cc2)F 34a_100000210977_100000685645 [0,2,0,0,0,0|2,0,0]=4 16172 B18R2.274 Cc1cnc(nc1)COCc2ccc(cc2)F 7a_100000210977_100000685645 [0,2,0,0,0,0|2,0,0]=4 16173 B18R2.274 Cc1cnc(nc1)COCc2ccc(cc2)I 34a_100000690907_100000685645 [0,2,0,0,0,0|2,0,0]=4 16174 B18R2.274 Cc1cnc(nc1)COCc2ccc(cc2)I 7a_100000690907_100000685645 [0,2,0,0,0,0|2,0,0]=4 16175 B18R2.274 Cc1cnc(nc1)COCc2ccc(cc2)N 34a_100011215238_100000685645 [0,2,0,0,0,0|2,0,0]=4 16176 B18R2.274 Cc1ncc(cn1)COCc2ccc(cc2)Br 34a_100011746891_100000189115 [0,2,0,0,0,0|2,0,0]=4 16177 B18R2.274 Cc1ncc(cn1)COCc2ccc(cc2)Cl 34a_100011746891_100000694040 [0,2,0,0,0,0|2,0,0]=4 16178 B18R2.274 Cc1ncc(cn1)COCc2ccc(cc2)F 34a_100011746891_100000198546 [0,2,0,0,0,0|2,0,0]=4 16179 B18R2.274 Cc1ncc(cn1)COCc2ccc(cc2)I 34a_100011746891_100000189116 [0,2,0,0,0,0|2,0,0]=4 16180 B18R2.274 Clc1ccc(cc1)CCNc2ccc(cc2)Br 2230a_100000210018_100011713675 [0,2,0,0,0,0|2,0,0]=4 16181 B18R2.274 Clc1ccc(cc1)CCNc2ccc(cc2)Br 34a_100000210018_100011713675 [0,2,0,0,0,0|2,0,0]=4 16182 B18R2.274 Clc1ccc(cc1)CCNc2ccc(cc2)Cl 2230a_100000210052_100011713675 [0,2,0,0,0,0|2,0,0]=4 16183 B18R2.274 Clc1ccc(cc1)CCNc2ccc(cc2)Cl 34a_100000210052_100011713675 [0,2,0,0,0,0|2,0,0]=4 16184 B18R2.274 Clc1ccc(cc1)CCNc2ccc(cc2)I 34a_100000185761_100011713675 [0,2,0,0,0,0|2,0,0]=4 16185 B18R2.274 Clc1ccc(cc1)CCOc2ccc(cc2)Br 34a_100000185759_100011713675 [0,2,0,0,0,0|2,0,0]=4 16186 B18R2.274 Clc1ccc(cc1)CCOc2ccc(cc2)Br 7a_100000185759_100011713675 [0,2,0,0,0,0|2,0,0]=4 16187 B18R2.274 Clc1ccc(cc1)CCOc2ccc(cc2)Cl 34a_100000210216_100011713675 [0,2,0,0,0,0|2,0,0]=4 16188 B18R2.274 Clc1ccc(cc1)CCOc2ccc(cc2)Cl 7a_100000210216_100011713675 [0,2,0,0,0,0|2,0,0]=4 16189 B18R2.274 Clc1ccc(cc1)CCOc2ccc(cc2)I 34a_100000212066_100011713675 [0,2,0,0,0,0|2,0,0]=4 16190 B18R2.274 Clc1ccc(cc1)CCOc2ccc(cc2)I 7a_100000212066_100011713675 [0,2,0,0,0,0|2,0,0]=4 16191 B18R2.274 Clc1ccc(cc1)CCSc2ccc(cc2)Br 62a_100000752885_100011713675 [0,2,0,0,0,0|2,0,0]=4 16192 B18R2.274 Clc1ccc(cc1)CCSc2ccc(cc2)Br 62a_100011713675_100000752885 [0,2,0,0,0,0|2,0,0]=4 16193 B18R2.274 Clc1ccc(cc1)CCSc2ccc(cc2)Cl 62a_100000755918_100011713675 [0,2,0,0,0,0|2,0,0]=4 16194 B18R2.274 Clc1ccc(cc1)CCSc2ccc(cc2)Cl 62a_100011713675_100000755918 [0,2,0,0,0,0|2,0,0]=4 16195 B18R2.274 Clc1ccc(cc1)CNCc2ccc(cc2)Br 207a_100000174871_100000186029 [0,2,0,0,0,0|1,0,0]=3 16196 B18R2.274 Clc1ccc(cc1)CNCc2ccc(cc2)Br 207a_100000174875_100000189385 [0,2,0,0,0,0|1,0,0]=3 16197 B18R2.274 Clc1ccc(cc1)CNCc2ccc(cc2)Br 2230a_100000174871_100011217064 [0,2,0,0,0,0|1,0,0]=3 16198 B18R2.274 Clc1ccc(cc1)CNCc2ccc(cc2)Br 2230a_100000174875_100000694040 [0,2,0,0,0,0|1,0,0]=3 16199 B18R2.274 Clc1ccc(cc1)CNCc2ccc(cc2)Br 26a_100000174871_100000185759 [0,2,0,0,0,0|1,0,0]=3 16200 B18R2.274 Clc1ccc(cc1)CNCc2ccc(cc2)Br 270004a_100000174871_100000186029 [0,2,0,0,0,0|1,0,0]=3 16201 B18R2.274 Clc1ccc(cc1)CNCc2ccc(cc2)Br 270004a_100000174875_100000189385 [0,2,0,0,0,0|1,0,0]=3 16202 B18R2.274 Clc1ccc(cc1)CNCc2ccc(cc2)Br 34a_100000174871_100000189115 [0,2,0,0,0,0|1,0,0]=3 16203 B18R2.274 Clc1ccc(cc1)CNCc2ccc(cc2)Br 34a_100000174875_100000694040 [0,2,0,0,0,0|1,0,0]=3 16204 B18R2.274 Clc1ccc(cc1)CNCc2ccc(cc2)Cl 207a_100000174871_100000189385 [0,2,0,0,0,0|1,0,0]=3 16205 B18R2.274 Clc1ccc(cc1)CNCc2ccc(cc2)Cl 2230a_100000174871_100000694040 [0,2,0,0,0,0|1,0,0]=3 16206 B18R2.274 Clc1ccc(cc1)CNCc2ccc(cc2)Cl 270004a_100000174871_100000189385 [0,2,0,0,0,0|1,0,0]=3 16207 B18R2.274 Clc1ccc(cc1)CNCc2ccc(cc2)Cl 34a_100000174871_100000694040 [0,2,0,0,0,0|1,0,0]=3 16208 B18R2.274 Clc1ccc(cc1)CNCc2ccc(cc2)I 207a_100000174871_100000188517 [0,2,0,0,0,0|1,0,0]=3 16209 B18R2.274 Clc1ccc(cc1)CNCc2ccc(cc2)I 207a_100016989417_100000189385 [0,2,0,0,0,0|1,0,0]=3 16210 B18R2.274 Clc1ccc(cc1)CNCc2ccc(cc2)I 2230a_100000174871_100000189116 [0,2,0,0,0,0|1,0,0]=3 16211 B18R2.274 Clc1ccc(cc1)CNCc2ccc(cc2)I 2230a_100016989417_100000694040 [0,2,0,0,0,0|1,0,0]=3 16212 B18R2.274 Clc1ccc(cc1)CNCc2ccc(cc2)I 270004a_100016989417_100000189385 [0,2,0,0,0,0|1,0,0]=3 16213 B18R2.274 Clc1ccc(cc1)CNCc2ccc(cc2)I 34a_100000174871_100000189116 [0,2,0,0,0,0|1,0,0]=3 16214 B18R2.274 Clc1ccc(cc1)CNCc2ccc(cc2)I 34a_100016989417_100000694040 [0,2,0,0,0,0|1,0,0]=3 16215 B18R2.274 Clc1ccc(cc1)CNCc2ccc(cn2)Br 207a_100000174871_100000754260 [0,2,0,0,0,0|2,0,0]=4 16216 B18R2.274 Clc1ccc(cc1)CNCc2ccc(cn2)Br 2230a_100000174871_100000702658 [0,2,0,0,0,0|2,0,0]=4 16217 B18R2.274 Clc1ccc(cc1)CNCc2ccc(cn2)Br 270004a_100000174871_100000754260 [0,2,0,0,0,0|2,0,0]=4 16218 B18R2.274 Clc1ccc(cc1)CNCc2ccc(cn2)Br 34a_100000174871_100000702658 [0,2,0,0,0,0|2,0,0]=4 16219 B18R2.274 Clc1ccc(cc1)CNCc2ccc(cn2)Br 34a_100015188789_100000694040 [0,2,0,0,0,0|2,0,0]=4 16220 B18R2.274 Clc1ccc(cc1)CNCc2ccc(cn2)Cl 207a_100000174871_100011361569 [0,2,0,0,0,0|2,0,0]=4 16221 B18R2.274 Clc1ccc(cc1)CNCc2ccc(cn2)Cl 2230a_100000174871_100012066911 [0,2,0,0,0,0|2,0,0]=4 16222 B18R2.274 Clc1ccc(cc1)CNCc2ccc(cn2)Cl 270004a_100000174871_100011361569 [0,2,0,0,0,0|2,0,0]=4 16223 B18R2.274 Clc1ccc(cc1)CNCc2ccc(cn2)Cl 270004a_100000697193_100000189385 [0,2,0,0,0,0|2,0,0]=4 16224 B18R2.274 Clc1ccc(cc1)CNCc2ccc(cn2)Cl 34a_100000174871_100012066911 [0,2,0,0,0,0|2,0,0]=4 16225 B18R2.274 Clc1ccc(cc1)CNCc2ccc(cn2)Cl 34a_100000697193_100000694040 [0,2,0,0,0,0|2,0,0]=4 16226 B18R2.274 Clc1ccc(cc1)CNCc2ccc(nc2)Br 207a_100009817727_100000189385 [0,2,0,0,0,0|2,0,0]=4 16227 B18R2.274 Clc1ccc(cc1)CNCc2ccc(nc2)Br 2230a_100000174871_100009831999 [0,2,0,0,0,0|2,0,0]=4 16228 B18R2.274 Clc1ccc(cc1)CNCc2ccc(nc2)Br 2230a_100009817727_100000694040 [0,2,0,0,0,0|2,0,0]=4 16229 B18R2.274 Clc1ccc(cc1)CNCc2ccc(nc2)Br 270004a_100009817727_100000189385 [0,2,0,0,0,0|2,0,0]=4 16230 B18R2.274 Clc1ccc(cc1)CNCc2ccc(nc2)Br 34a_100000174871_100009831999 [0,2,0,0,0,0|2,0,0]=4 16231 B18R2.274 Clc1ccc(cc1)CNCc2ccc(nc2)Br 34a_100009817727_100000694040 [0,2,0,0,0,0|2,0,0]=4 16232 B18R2.274 Clc1ccc(cc1)CNCc2ccc(nc2)Cl 207a_100000735879_100000189385 [0,2,0,0,0,0|2,0,0]=4 16233 B18R2.274 Clc1ccc(cc1)CNCc2ccc(nc2)Cl 2230a_100000174871_100000735431 [0,2,0,0,0,0|2,0,0]=4 16234 B18R2.274 Clc1ccc(cc1)CNCc2ccc(nc2)Cl 2230a_100000735879_100000694040 [0,2,0,0,0,0|2,0,0]=4 16235 B18R2.274 Clc1ccc(cc1)CNCc2ccc(nc2)Cl 270004a_100000735879_100000189385 [0,2,0,0,0,0|2,0,0]=4 16236 B18R2.274 Clc1ccc(cc1)CNCc2ccc(nc2)Cl 34a_100000174871_100000735431 [0,2,0,0,0,0|2,0,0]=4 16237 B18R2.274 Clc1ccc(cc1)CNCc2ccc(nc2)Cl 34a_100000735879_100000694040 [0,2,0,0,0,0|2,0,0]=4 16238 B18R2.274 Clc1ccc(cc1)COCc2ccc(cc2)Br 34a_100000211118_100000189115 [0,2,0,0,0,0|0,0,0]=2 16239 B18R2.274 Clc1ccc(cc1)COCc2ccc(cc2)Br 34a_100000695286_100000694040 [0,2,0,0,0,0|0,0,0]=2 16240 B18R2.274 Clc1ccc(cc1)COCc2ccc(cc2)Br 7a_100000211118_100011217064 [0,2,0,0,0,0|0,0,0]=2 16241 B18R2.274 Clc1ccc(cc1)COCc2ccc(cc2)Cl 34a_100000211118_100000694040 [0,2,0,0,0,0|0,0,0]=2 16242 B18R2.274 Clc1ccc(cc1)COCc2ccc(cc2)Cl 7a_100000211118_100000187161 [0,2,0,0,0,0|0,0,0]=2 16243 B18R2.274 Clc1ccc(cc1)COCc2ccc(cc2)I 34a_100000211118_100000189116 [0,2,0,0,0,0|0,0,0]=2 16244 B18R2.274 Clc1ccc(cc1)COCc2ccc(cc2)I 34a_100000690907_100000694040 [0,2,0,0,0,0|0,0,0]=2 16245 B18R2.274 Clc1ccc(cc1)COCc2ccc(cc2)I 7a_100000211118_100000189116 [0,2,0,0,0,0|0,0,0]=2 16246 B18R2.274 Clc1ccc(cc1)COCc2ccc(cc2)I 7a_100000690907_100000187161 [0,2,0,0,0,0|0,0,0]=2 16247 B18R2.274 Clc1ccc(cc1)COCc2ccc(cn2)Br 34a_100000211118_100000702658 [0,2,0,0,0,0|1,0,0]=3 16248 B18R2.274 Clc1ccc(cc1)COCc2ccc(cn2)Br 34a_100000754261_100000694040 [0,2,0,0,0,0|1,0,0]=3 16249 B18R2.274 Clc1ccc(cc1)COCc2ccc(cn2)Br 7a_100000211118_100000702658 [0,2,0,0,0,0|1,0,0]=3 16250 B18R2.274 Clc1ccc(cc1)COCc2ccc(cn2)Cl 34a_100000211118_100012066911 [0,2,0,0,0,0|1,0,0]=3 16251 B18R2.274 Clc1ccc(cc1)COCc2ccc(cn2)Cl 34a_100000703999_100000694040 [0,2,0,0,0,0|1,0,0]=3 16252 B18R2.274 Clc1ccc(cc1)COCc2ccc(cn2)Cl 7a_100000211118_100012066911 [0,2,0,0,0,0|1,0,0]=3 16253 B18R2.274 Clc1ccc(cc1)COCc2ccc(nc2)Br 34a_100000211118_100009831999 [0,2,0,0,0,0|1,0,0]=3 16254 B18R2.274 Clc1ccc(cc1)COCc2ccc(nc2)Br 34a_100009816760_100000694040 [0,2,0,0,0,0|1,0,0]=3 16255 B18R2.274 Clc1ccc(cc1)COCc2ccc(nc2)Br 7a_100000211118_100009831999 [0,2,0,0,0,0|1,0,0]=3 16256 B18R2.274 Clc1ccc(cc1)COCc2ccc(nc2)Br 7a_100009816760_100000187161 [0,2,0,0,0,0|1,0,0]=3 16257 B18R2.274 Clc1ccc(cc1)COCc2ccc(nc2)Cl 34a_100000211118_100000735431 [0,2,0,0,0,0|1,0,0]=3 16258 B18R2.274 Clc1ccc(cc1)COCc2ccc(nc2)Cl 34a_100000755211_100000694040 [0,2,0,0,0,0|1,0,0]=3 16259 B18R2.274 Clc1ccc(cc1)COCc2ccc(nc2)Cl 7a_100000211118_100000735431 [0,2,0,0,0,0|1,0,0]=3 16260 B18R2.274 Clc1ccc(cc1)COCc2ccc(nc2)Cl 7a_100000755211_100000187161 [0,2,0,0,0,0|1,0,0]=3 16261 B18R2.274 Clc1ccc(cc1)COCc2ccc(nn2)Cl 34a_100000211118_100016992710 [0,2,0,0,0,0|2,0,0]=4 16262 B18R2.274 Clc1ccc(cc1)COCc2ccc(nn2)Cl 7a_100000211118_100016992710 [0,2,0,0,0,0|2,0,0]=4 16263 B18R2.274 Clc1ccc(cc1)COCc2cnc(cn2)Cl 34a_100012002382_100000694040 [0,2,0,0,0,0|2,0,0]=4 16264 B18R2.274 Clc1ccc(cc1)COCc2cnc(nc2)Cl 34a_100009855073_100000694040 [0,2,0,0,0,0|2,0,0]=4 16265 B18R2.274 Clc1ccc(cc1)COCc2cnc(nc2)Cl 7a_100009855073_100000187161 [0,2,0,0,0,0|2,0,0]=4 16266 B18R2.274 Clc1ccc(cc1)COCc2ncc(cn2)Br 34a_100000211118_100010064664 [0,2,0,0,0,0|2,0,0]=4 16267 B18R2.274 Clc1ccc(cc1)COCc2ncc(cn2)Br 7a_100000211118_100010064664 [0,2,0,0,0,0|2,0,0]=4 16268 B18R2.274 Clc1ccc(cc1)CSCc2ccc(cc2)Br 62a_100000187161_100000189115 [0,2,0,0,0,0|0,1,0]=3 16269 B18R2.274 Clc1ccc(cc1)CSCc2ccc(cc2)Br 62a_100000189115_100000187161 [0,2,0,0,0,0|0,1,0]=3 16270 B18R2.274 Clc1ccc(cc1)CSCc2ccc(cc2)Cl 62a_100000187161_100000187161 [0,2,0,0,0,0|0,1,0]=3 16271 B18R2.274 Clc1ccc(cc1)CSCc2ccc(cc2)I 62a_100000187161_100000189116 [0,2,0,0,0,0|0,1,0]=3 16272 B18R2.274 Clc1ccc(cc1)CSCc2ccc(cc2)I 62a_100000189116_100000187161 [0,2,0,0,0,0|0,1,0]=3 16273 B18R2.274 Clc1ccc(cc1)CSCc2ccc(cn2)Br 62a_100000187161_100000702658 [0,2,0,0,0,0|1,1,0]=4 16274 B18R2.274 Clc1ccc(cc1)CSCc2ccc(cn2)Br 62a_100000702658_100000187161 [0,2,0,0,0,0|1,1,0]=4 16275 B18R2.274 Clc1ccc(cc1)CSCc2ccc(cn2)Cl 62a_100000187161_100000697101 [0,2,0,0,0,0|1,1,0]=4 16276 B18R2.274 Clc1ccc(cc1)CSCc2ccc(cn2)Cl 62a_100012066911_100000187161 [0,2,0,0,0,0|1,1,0]=4 16277 B18R2.274 Clc1ccc(cc1)CSCc2ccc(nc2)Br 62a_100000187161_100009831999 [0,2,0,0,0,0|1,1,0]=4 16278 B18R2.274 Clc1ccc(cc1)CSCc2ccc(nc2)Br 62a_100009831999_100000187161 [0,2,0,0,0,0|1,1,0]=4 16279 B18R2.274 Clc1ccc(cc1)CSCc2ccc(nc2)Cl 62a_100000187161_100000735431 [0,2,0,0,0,0|1,1,0]=4 16280 B18R2.274 Clc1ccc(cc1)CSCc2ccc(nc2)Cl 62a_100000735431_100000187161 [0,2,0,0,0,0|1,1,0]=4 16281 B18R2.274 Clc1ccc(cc1)NCCc2ccc(cc2)Br 2230a_100000210052_100011740612 [0,2,0,0,0,0|2,0,0]=4 16282 B18R2.274 Clc1ccc(cc1)NCCc2ccc(cc2)Br 34a_100000210052_100011740612 [0,2,0,0,0,0|2,0,0]=4 16283 B18R2.274 Clc1ccc(cc1)OCCc2ccc(cc2)Br 34a_100000210216_100011740612 [0,2,0,0,0,0|2,0,0]=4 16284 B18R2.274 Clc1ccc(cc1)OCCc2ccc(cc2)Br 7a_100000210216_100011740612 [0,2,0,0,0,0|2,0,0]=4 16285 B18R2.274 Clc1ccc(cc1)SCCc2ccc(cc2)Br 62a_100000755918_100011740612 [0,2,0,0,0,0|2,0,0]=4 16286 B18R2.274 Clc1ccc(cc1)SCCc2ccc(cc2)Br 62a_100011740612_100000755918 [0,2,0,0,0,0|2,0,0]=4 16287 B18R2.274 Clc1ccc(cn1)CNCc2ccc(cc2)Br 207a_100000735879_100000186029 [0,2,0,0,0,0|2,0,0]=4 16288 B18R2.274 Clc1ccc(cn1)CNCc2ccc(cc2)Br 2230a_100000174875_100000735431 [0,2,0,0,0,0|2,0,0]=4 16289 B18R2.274 Clc1ccc(cn1)CNCc2ccc(cc2)Br 2230a_100000735879_100011217064 [0,2,0,0,0,0|2,0,0]=4 16290 B18R2.274 Clc1ccc(cn1)CNCc2ccc(cc2)Br 270004a_100000735879_100000186029 [0,2,0,0,0,0|2,0,0]=4 16291 B18R2.274 Clc1ccc(cn1)CNCc2ccc(cc2)Br 34a_100000174875_100000735431 [0,2,0,0,0,0|2,0,0]=4 16292 B18R2.274 Clc1ccc(cn1)CNCc2ccc(cc2)Br 34a_100000735879_100000189115 [0,2,0,0,0,0|2,0,0]=4 16293 B18R2.274 Clc1ccc(cn1)CNCc2ccc(cc2)I 207a_100000735879_100000188517 [0,2,0,0,0,0|2,0,0]=4 16294 B18R2.274 Clc1ccc(cn1)CNCc2ccc(cc2)I 2230a_100000735879_100000189116 [0,2,0,0,0,0|2,0,0]=4 16295 B18R2.274 Clc1ccc(cn1)CNCc2ccc(cc2)I 2230a_100016989417_100000735431 [0,2,0,0,0,0|2,0,0]=4 16296 B18R2.274 Clc1ccc(cn1)CNCc2ccc(cc2)I 34a_100000735879_100000189116 [0,2,0,0,0,0|2,0,0]=4 16297 B18R2.274 Clc1ccc(cn1)CNCc2ccc(cc2)I 34a_100016989417_100000735431 [0,2,0,0,0,0|2,0,0]=4 16298 B18R2.274 Clc1ccc(cn1)COCc2ccc(cc2)Br 34a_100000695286_100000735431 [0,2,0,0,0,0|1,0,0]=3 16299 B18R2.274 Clc1ccc(cn1)COCc2ccc(cc2)Br 34a_100000755211_100000189115 [0,2,0,0,0,0|1,0,0]=3 16300 B18R2.274 Clc1ccc(cn1)COCc2ccc(cc2)Br 7a_100000755211_100011217064 [0,2,0,0,0,0|1,0,0]=3 16301 B18R2.274 Clc1ccc(cn1)COCc2ccc(cc2)I 34a_100000690907_100000735431 [0,2,0,0,0,0|1,0,0]=3 16302 B18R2.274 Clc1ccc(cn1)COCc2ccc(cc2)I 34a_100000755211_100000189116 [0,2,0,0,0,0|1,0,0]=3 16303 B18R2.274 Clc1ccc(cn1)COCc2ccc(cc2)I 7a_100000690907_100000735431 [0,2,0,0,0,0|1,0,0]=3 16304 B18R2.274 Clc1ccc(cn1)COCc2ccc(cc2)I 7a_100000755211_100000189116 [0,2,0,0,0,0|1,0,0]=3 16305 B18R2.274 Clc1ccc(cn1)COCc2ccc(cn2)Br 34a_100000754261_100000735431 [0,2,0,0,0,0|2,0,0]=4 16306 B18R2.274 Clc1ccc(cn1)COCc2ccc(cn2)Br 34a_100000755211_100000702658 [0,2,0,0,0,0|2,0,0]=4 16307 B18R2.274 Clc1ccc(cn1)COCc2ccc(cn2)Br 7a_100000755211_100000702658 [0,2,0,0,0,0|2,0,0]=4 16308 B18R2.274 Clc1ccc(cn1)COCc2ccc(nc2)Br 34a_100000755211_100009831999 [0,2,0,0,0,0|2,0,0]=4 16309 B18R2.274 Clc1ccc(cn1)COCc2ccc(nc2)Br 34a_100009816760_100000735431 [0,2,0,0,0,0|2,0,0]=4 16310 B18R2.274 Clc1ccc(cn1)COCc2ccc(nc2)Br 7a_100000755211_100009831999 [0,2,0,0,0,0|2,0,0]=4 16311 B18R2.274 Clc1ccc(cn1)COCc2ccc(nc2)Br 7a_100009816760_100000735431 [0,2,0,0,0,0|2,0,0]=4 16312 B18R2.274 Clc1ccc(cn1)COCc2ccc(nc2)Cl 34a_100000755211_100000735431 [0,2,0,0,0,0|2,0,0]=4 16313 B18R2.274 Clc1ccc(cn1)COCc2ccc(nc2)Cl 7a_100000755211_100000735431 [0,2,0,0,0,0|2,0,0]=4 16314 B18R2.274 Clc1ccc(cn1)CSCc2ccc(cc2)Br 62a_100000189115_100000735431 [0,2,0,0,0,0|1,1,0]=4 16315 B18R2.274 Clc1ccc(cn1)CSCc2ccc(cc2)Br 62a_100000735431_100000189115 [0,2,0,0,0,0|1,1,0]=4 16316 B18R2.274 Clc1ccc(cn1)CSCc2ccc(cc2)I 62a_100000189116_100000735431 [0,2,0,0,0,0|1,1,0]=4 16317 B18R2.274 Clc1ccc(cn1)CSCc2ccc(cc2)I 62a_100000735431_100000189116 [0,2,0,0,0,0|1,1,0]=4 16318 B18R2.274 Clc1ccc(nc1)CNCc2ccc(cc2)Br 207a_100000174875_100011361569 [0,2,0,0,0,0|2,0,0]=4 16319 B18R2.274 Clc1ccc(nc1)CNCc2ccc(cc2)Br 2230a_100000174875_100012066911 [0,2,0,0,0,0|2,0,0]=4 16320 B18R2.274 Clc1ccc(nc1)CNCc2ccc(cc2)Br 270004a_100000174875_100011361569 [0,2,0,0,0,0|2,0,0]=4 16321 B18R2.274 Clc1ccc(nc1)CNCc2ccc(cc2)Br 270004a_100000697193_100000186029 [0,2,0,0,0,0|2,0,0]=4 16322 B18R2.274 Clc1ccc(nc1)CNCc2ccc(cc2)Br 34a_100000174875_100012066911 [0,2,0,0,0,0|2,0,0]=4 16323 B18R2.274 Clc1ccc(nc1)CNCc2ccc(cc2)Br 34a_100000697193_100000189115 [0,2,0,0,0,0|2,0,0]=4 16324 B18R2.274 Clc1ccc(nc1)CNCc2ccc(cc2)I 207a_100016989417_100011361569 [0,2,0,0,0,0|2,0,0]=4 16325 B18R2.274 Clc1ccc(nc1)CNCc2ccc(cc2)I 2230a_100016989417_100012066911 [0,2,0,0,0,0|2,0,0]=4 16326 B18R2.274 Clc1ccc(nc1)CNCc2ccc(cc2)I 270004a_100016989417_100011361569 [0,2,0,0,0,0|2,0,0]=4 16327 B18R2.274 Clc1ccc(nc1)CNCc2ccc(cc2)I 34a_100000697193_100000189116 [0,2,0,0,0,0|2,0,0]=4 16328 B18R2.274 Clc1ccc(nc1)CNCc2ccc(cc2)I 34a_100016989417_100012066911 [0,2,0,0,0,0|2,0,0]=4 16329 B18R2.274 Clc1ccc(nc1)COCc2ccc(cc2)Br 34a_100000695286_100012066911 [0,2,0,0,0,0|1,0,0]=3 16330 B18R2.274 Clc1ccc(nc1)COCc2ccc(cc2)Br 34a_100000703999_100000189115 [0,2,0,0,0,0|1,0,0]=3 16331 B18R2.274 Clc1ccc(nc1)COCc2ccc(cc2)I 34a_100000690907_100012066911 [0,2,0,0,0,0|1,0,0]=3 16332 B18R2.274 Clc1ccc(nc1)COCc2ccc(cc2)I 34a_100000703999_100000189116 [0,2,0,0,0,0|1,0,0]=3 16333 B18R2.274 Clc1ccc(nc1)COCc2ccc(cc2)I 7a_100000690907_100012066911 [0,2,0,0,0,0|1,0,0]=3 16334 B18R2.274 Clc1ccc(nc1)COCc2ccc(cn2)Br 34a_100000703999_100000702658 [0,2,0,0,0,0|2,0,0]=4 16335 B18R2.274 Clc1ccc(nc1)COCc2ccc(cn2)Br 34a_100000754261_100012066911 [0,2,0,0,0,0|2,0,0]=4 16336 B18R2.274 Clc1ccc(nc1)COCc2ccc(cn2)Cl 34a_100000703999_100012066911 [0,2,0,0,0,0|2,0,0]=4 16337 B18R2.274 Clc1ccc(nc1)COCc2ccc(nc2)Br 34a_100000703999_100009831999 [0,2,0,0,0,0|2,0,0]=4 16338 B18R2.274 Clc1ccc(nc1)COCc2ccc(nc2)Br 34a_100009816760_100012066911 [0,2,0,0,0,0|2,0,0]=4 16339 B18R2.274 Clc1ccc(nc1)COCc2ccc(nc2)Br 7a_100009816760_100012066911 [0,2,0,0,0,0|2,0,0]=4 16340 B18R2.274 Clc1ccc(nc1)COCc2ccc(nc2)Cl 34a_100000703999_100000735431 [0,2,0,0,0,0|2,0,0]=4 16341 B18R2.274 Clc1ccc(nc1)COCc2ccc(nc2)Cl 34a_100000755211_100012066911 [0,2,0,0,0,0|2,0,0]=4 16342 B18R2.274 Clc1ccc(nc1)COCc2ccc(nc2)Cl 7a_100000755211_100012066911 [0,2,0,0,0,0|2,0,0]=4 16343 B18R2.274 Clc1ccc(nc1)CSCc2ccc(cc2)Br 62a_100000189115_100000697101 [0,2,0,0,0,0|1,1,0]=4 16344 B18R2.274 Clc1ccc(nc1)CSCc2ccc(cc2)Br 62a_100012066911_100000189115 [0,2,0,0,0,0|1,1,0]=4 16345 B18R2.274 Clc1ccc(nc1)CSCc2ccc(cc2)I 62a_100000189116_100000697101 [0,2,0,0,0,0|1,1,0]=4 16346 B18R2.274 Clc1ccc(nc1)CSCc2ccc(cc2)I 62a_100012066911_100000189116 [0,2,0,0,0,0|1,1,0]=4 16347 B18R2.274 Clc1ccc(nn1)COCc2ccc(cc2)Br 34a_100000695286_100016992710 [0,2,0,0,0,0|2,0,0]=4 16348 B18R2.274 Clc1ccc(nn1)COCc2ccc(cc2)I 34a_100000690907_100016992710 [0,2,0,0,0,0|2,0,0]=4 16349 B18R2.274 Clc1ccc(nn1)COCc2ccc(cc2)I 7a_100000690907_100016992710 [0,2,0,0,0,0|2,0,0]=4 16350 B18R2.274 Clc1cnc(cn1)COCc2ccc(cc2)Br 34a_100012002382_100000189115 [0,2,0,0,0,0|2,0,0]=4 16351 B18R2.274 Clc1cnc(cn1)COCc2ccc(cc2)I 34a_100012002382_100000189116 [0,2,0,0,0,0|2,0,0]=4 16352 B18R2.274 Clc1ncc(cn1)COCc2ccc(cc2)Br 34a_100009855073_100000189115 [0,2,0,0,0,0|2,0,0]=4 16353 B18R2.274 Clc1ncc(cn1)COCc2ccc(cc2)Br 7a_100009855073_100011217064 [0,2,0,0,0,0|2,0,0]=4 16354 B18R2.274 Clc1ncc(cn1)COCc2ccc(cc2)I 34a_100009855073_100000189116 [0,2,0,0,0,0|2,0,0]=4 16355 B18R2.274 Clc1ncc(cn1)COCc2ccc(cc2)I 7a_100009855073_100000189116 [0,2,0,0,0,0|2,0,0]=4 16356 B18R2.274 Fc1ccc(cc1)CCNc2ccc(cc2)Br 2230a_100000210018_100011217392 [0,2,0,0,0,0|2,0,0]=4 16357 B18R2.274 Fc1ccc(cc1)CCNc2ccc(cc2)Br 34a_100000210018_100011217392 [0,2,0,0,0,0|2,0,0]=4 16358 B18R2.274 Fc1ccc(cc1)CCNc2ccc(cc2)Cl 2230a_100000210052_100011217392 [0,2,0,0,0,0|2,0,0]=4 16359 B18R2.274 Fc1ccc(cc1)CCNc2ccc(cc2)Cl 34a_100000210052_100011217392 [0,2,0,0,0,0|2,0,0]=4 16360 B18R2.274 Fc1ccc(cc1)CCNc2ccc(cc2)F 34a_100000185862_100011217392 [0,2,0,0,0,0|2,0,0]=4 16361 B18R2.274 Fc1ccc(cc1)CCNc2ccc(cc2)I 34a_100000185761_100011217392 [0,2,0,0,0,0|2,0,0]=4 16362 B18R2.274 Fc1ccc(cc1)CCOc2ccc(cc2)Br 34a_100000185759_100011217392 [0,2,0,0,0,0|2,0,0]=4 16363 B18R2.274 Fc1ccc(cc1)CCOc2ccc(cc2)Br 7a_100000185759_100011217392 [0,2,0,0,0,0|2,0,0]=4 16364 B18R2.274 Fc1ccc(cc1)CCOc2ccc(cc2)Cl 34a_100000210216_100011217392 [0,2,0,0,0,0|2,0,0]=4 16365 B18R2.274 Fc1ccc(cc1)CCOc2ccc(cc2)Cl 7a_100000210216_100011217392 [0,2,0,0,0,0|2,0,0]=4 16366 B18R2.274 Fc1ccc(cc1)CCOc2ccc(cc2)F 34a_100000210339_100011217392 [0,2,0,0,0,0|2,0,0]=4 16367 B18R2.274 Fc1ccc(cc1)CCOc2ccc(cc2)I 34a_100000212066_100011217392 [0,2,0,0,0,0|2,0,0]=4 16368 B18R2.274 Fc1ccc(cc1)CCOc2ccc(cc2)I 7a_100000212066_100011217392 [0,2,0,0,0,0|2,0,0]=4 16369 B18R2.274 Fc1ccc(cc1)CCSc2ccc(cc2)Br 62a_100000752885_100011217392 [0,2,0,0,0,0|2,0,0]=4 16370 B18R2.274 Fc1ccc(cc1)CCSc2ccc(cc2)Br 62a_100011217392_100000752885 [0,2,0,0,0,0|2,0,0]=4 16371 B18R2.274 Fc1ccc(cc1)CCSc2ccc(cc2)Cl 62a_100000755918_100011217392 [0,2,0,0,0,0|2,0,0]=4 16372 B18R2.274 Fc1ccc(cc1)CCSc2ccc(cc2)Cl 62a_100011217392_100000755918 [0,2,0,0,0,0|2,0,0]=4 16373 B18R2.274 Fc1ccc(cc1)CCSc2ccc(cc2)F 62a_100000211213_100011217392 [0,2,0,0,0,0|2,0,0]=4 16374 B18R2.274 Fc1ccc(cc1)CCSc2ccc(cc2)F 62a_100011217392_100000211213 [0,2,0,0,0,0|2,0,0]=4 16375 B18R2.274 Fc1ccc(cc1)CNCc2ccc(cc2)Br 207a_100000174875_100000210084 [0,2,0,0,0,0|1,0,0]=3 16376 B18R2.274 Fc1ccc(cc1)CNCc2ccc(cc2)Br 207a_100000174882_100000186029 [0,2,0,0,0,0|1,0,0]=3 16377 B18R2.274 Fc1ccc(cc1)CNCc2ccc(cc2)Br 2230a_100000174875_100000198546 [0,2,0,0,0,0|1,0,0]=3 16378 B18R2.274 Fc1ccc(cc1)CNCc2ccc(cc2)Br 2230a_100000174882_100011217064 [0,2,0,0,0,0|1,0,0]=3 16379 B18R2.274 Fc1ccc(cc1)CNCc2ccc(cc2)Br 270004a_100000174875_100000210084 [0,2,0,0,0,0|1,0,0]=3 16380 B18R2.274 Fc1ccc(cc1)CNCc2ccc(cc2)Br 270004a_100000174882_100000186029 [0,2,0,0,0,0|1,0,0]=3 16381 B18R2.274 Fc1ccc(cc1)CNCc2ccc(cc2)Br 34a_100000174875_100000198546 [0,2,0,0,0,0|1,0,0]=3 16382 B18R2.274 Fc1ccc(cc1)CNCc2ccc(cc2)Br 34a_100000174882_100000189115 [0,2,0,0,0,0|1,0,0]=3 16383 B18R2.274 Fc1ccc(cc1)CNCc2ccc(cc2)Cl 207a_100000174871_100000210084 [0,2,0,0,0,0|1,0,0]=3 16384 B18R2.274 Fc1ccc(cc1)CNCc2ccc(cc2)Cl 207a_100000174882_100000189385 [0,2,0,0,0,0|1,0,0]=3 16385 B18R2.274 Fc1ccc(cc1)CNCc2ccc(cc2)Cl 2230a_100000174871_100000198546 [0,2,0,0,0,0|1,0,0]=3 16386 B18R2.274 Fc1ccc(cc1)CNCc2ccc(cc2)Cl 2230a_100000174882_100000694040 [0,2,0,0,0,0|1,0,0]=3 16387 B18R2.274 Fc1ccc(cc1)CNCc2ccc(cc2)Cl 270004a_100000174871_100000210084 [0,2,0,0,0,0|1,0,0]=3 16388 B18R2.274 Fc1ccc(cc1)CNCc2ccc(cc2)Cl 270004a_100000174882_100000189385 [0,2,0,0,0,0|1,0,0]=3 16389 B18R2.274 Fc1ccc(cc1)CNCc2ccc(cc2)Cl 34a_100000174871_100000198546 [0,2,0,0,0,0|1,0,0]=3 16390 B18R2.274 Fc1ccc(cc1)CNCc2ccc(cc2)Cl 34a_100000174882_100000694040 [0,2,0,0,0,0|1,0,0]=3 16391 B18R2.274 Fc1ccc(cc1)CNCc2ccc(cc2)F 207a_100000174882_100000210084 [0,2,0,0,0,0|1,0,0]=3 16392 B18R2.274 Fc1ccc(cc1)CNCc2ccc(cc2)F 2230a_100000174882_100000198546 [0,2,0,0,0,0|1,0,0]=3 16393 B18R2.274 Fc1ccc(cc1)CNCc2ccc(cc2)F 270004a_100000174882_100000210084 [0,2,0,0,0,0|1,0,0]=3 16394 B18R2.274 Fc1ccc(cc1)CNCc2ccc(cc2)F 34a_100000174882_100000198546 [0,2,0,0,0,0|1,0,0]=3 16395 B18R2.274 Fc1ccc(cc1)CNCc2ccc(cc2)I 207a_100000174882_100000188517 [0,2,0,0,0,0|1,0,0]=3 16396 B18R2.274 Fc1ccc(cc1)CNCc2ccc(cc2)I 207a_100016989417_100000210084 [0,2,0,0,0,0|1,0,0]=3 16397 B18R2.274 Fc1ccc(cc1)CNCc2ccc(cc2)I 2230a_100000174882_100000189116 [0,2,0,0,0,0|1,0,0]=3 16398 B18R2.274 Fc1ccc(cc1)CNCc2ccc(cc2)I 2230a_100016989417_100000198546 [0,2,0,0,0,0|1,0,0]=3 16399 B18R2.274 Fc1ccc(cc1)CNCc2ccc(cc2)I 270004a_100016989417_100000210084 [0,2,0,0,0,0|1,0,0]=3 16400 B18R2.274 Fc1ccc(cc1)CNCc2ccc(cc2)I 34a_100000174882_100000189116 [0,2,0,0,0,0|1,0,0]=3 16401 B18R2.274 Fc1ccc(cc1)CNCc2ccc(cc2)I 34a_100016989417_100000198546 [0,2,0,0,0,0|1,0,0]=3 16402 B18R2.274 Fc1ccc(cc1)CNCc2ccc(cn2)Br 207a_100000174882_100000754260 [0,2,0,0,0,0|2,0,0]=4 16403 B18R2.274 Fc1ccc(cc1)CNCc2ccc(cn2)Br 2230a_100000174882_100000702658 [0,2,0,0,0,0|2,0,0]=4 16404 B18R2.274 Fc1ccc(cc1)CNCc2ccc(cn2)Br 270004a_100000174882_100000754260 [0,2,0,0,0,0|2,0,0]=4 16405 B18R2.274 Fc1ccc(cc1)CNCc2ccc(cn2)Br 34a_100000174882_100000702658 [0,2,0,0,0,0|2,0,0]=4 16406 B18R2.274 Fc1ccc(cc1)CNCc2ccc(cn2)Br 34a_100015188789_100000198546 [0,2,0,0,0,0|2,0,0]=4 16407 B18R2.274 Fc1ccc(cc1)CNCc2ccc(cn2)Cl 207a_100000174882_100011361569 [0,2,0,0,0,0|2,0,0]=4 16408 B18R2.274 Fc1ccc(cc1)CNCc2ccc(cn2)Cl 2230a_100000174882_100012066911 [0,2,0,0,0,0|2,0,0]=4 16409 B18R2.274 Fc1ccc(cc1)CNCc2ccc(cn2)Cl 270004a_100000174882_100011361569 [0,2,0,0,0,0|2,0,0]=4 16410 B18R2.274 Fc1ccc(cc1)CNCc2ccc(cn2)Cl 270004a_100000697193_100000210084 [0,2,0,0,0,0|2,0,0]=4 16411 B18R2.274 Fc1ccc(cc1)CNCc2ccc(cn2)Cl 34a_100000174882_100012066911 [0,2,0,0,0,0|2,0,0]=4 16412 B18R2.274 Fc1ccc(cc1)CNCc2ccc(cn2)Cl 34a_100000697193_100000198546 [0,2,0,0,0,0|2,0,0]=4 16413 B18R2.274 Fc1ccc(cc1)CNCc2ccc(cn2)F 207a_100000174882_100011934744 [0,2,0,0,0,0|2,0,0]=4 16414 B18R2.274 Fc1ccc(cc1)CNCc2ccc(cn2)F 2230a_100000174882_100000703193 [0,2,0,0,0,0|2,0,0]=4 16415 B18R2.274 Fc1ccc(cc1)CNCc2ccc(cn2)F 270004a_100000174882_100011934744 [0,2,0,0,0,0|2,0,0]=4 16416 B18R2.274 Fc1ccc(cc1)CNCc2ccc(cn2)F 34a_100000174882_100000703193 [0,2,0,0,0,0|2,0,0]=4 16417 B18R2.274 Fc1ccc(cc1)CNCc2ccc(cn2)F 34a_100020620131_100000198546 [0,2,0,0,0,0|2,0,0]=4 16418 B18R2.274 Fc1ccc(cc1)CNCc2ccc(nc2)Br 207a_100009817727_100000210084 [0,2,0,0,0,0|2,0,0]=4 16419 B18R2.274 Fc1ccc(cc1)CNCc2ccc(nc2)Br 2230a_100000174882_100009831999 [0,2,0,0,0,0|2,0,0]=4 16420 B18R2.274 Fc1ccc(cc1)CNCc2ccc(nc2)Br 2230a_100009817727_100000198546 [0,2,0,0,0,0|2,0,0]=4 16421 B18R2.274 Fc1ccc(cc1)CNCc2ccc(nc2)Br 270004a_100009817727_100000210084 [0,2,0,0,0,0|2,0,0]=4 16422 B18R2.274 Fc1ccc(cc1)CNCc2ccc(nc2)Br 34a_100000174882_100009831999 [0,2,0,0,0,0|2,0,0]=4 16423 B18R2.274 Fc1ccc(cc1)CNCc2ccc(nc2)Br 34a_100009817727_100000198546 [0,2,0,0,0,0|2,0,0]=4 16424 B18R2.274 Fc1ccc(cc1)CNCc2ccc(nc2)Cl 207a_100000735879_100000210084 [0,2,0,0,0,0|2,0,0]=4 16425 B18R2.274 Fc1ccc(cc1)CNCc2ccc(nc2)Cl 2230a_100000174882_100000735431 [0,2,0,0,0,0|2,0,0]=4 16426 B18R2.274 Fc1ccc(cc1)CNCc2ccc(nc2)Cl 2230a_100000735879_100000198546 [0,2,0,0,0,0|2,0,0]=4 16427 B18R2.274 Fc1ccc(cc1)CNCc2ccc(nc2)Cl 270004a_100000735879_100000210084 [0,2,0,0,0,0|2,0,0]=4 16428 B18R2.274 Fc1ccc(cc1)CNCc2ccc(nc2)Cl 34a_100000174882_100000735431 [0,2,0,0,0,0|2,0,0]=4 16429 B18R2.274 Fc1ccc(cc1)CNCc2ccc(nc2)Cl 34a_100000735879_100000198546 [0,2,0,0,0,0|2,0,0]=4 16430 B18R2.274 Fc1ccc(cc1)CNCc2ccc(nc2)F 2230a_100000101913_100000198546 [0,2,0,0,0,0|2,0,0]=4 16431 B18R2.274 Fc1ccc(cc1)CNCc2ccc(nc2)F 2230a_100000174882_100009820150 [0,2,0,0,0,0|2,0,0]=4 16432 B18R2.274 Fc1ccc(cc1)CNCc2ccc(nc2)F 270004a_100000101913_100000210084 [0,2,0,0,0,0|2,0,0]=4 16433 B18R2.274 Fc1ccc(cc1)CNCc2ccc(nc2)F 34a_100000101913_100000198546 [0,2,0,0,0,0|2,0,0]=4 16434 B18R2.274 Fc1ccc(cc1)CNCc2ccc(nc2)F 34a_100000174882_100000099788 [0,2,0,0,0,0|2,0,0]=4 16435 B18R2.274 Fc1ccc(cc1)COCc2ccc(cc2)Br 34a_100000210977_100000189115 [0,2,0,0,0,0|0,0,0]=2 16436 B18R2.274 Fc1ccc(cc1)COCc2ccc(cc2)Br 34a_100000695286_100000198546 [0,2,0,0,0,0|0,0,0]=2 16437 B18R2.274 Fc1ccc(cc1)COCc2ccc(cc2)Br 7a_100000210977_100011217064 [0,2,0,0,0,0|0,0,0]=2 16438 B18R2.274 Fc1ccc(cc1)COCc2ccc(cc2)Cl 34a_100000210977_100000694040 [0,2,0,0,0,0|0,0,0]=2 16439 B18R2.274 Fc1ccc(cc1)COCc2ccc(cc2)Cl 34a_100000211118_100000198546 [0,2,0,0,0,0|0,0,0]=2 16440 B18R2.274 Fc1ccc(cc1)COCc2ccc(cc2)Cl 7a_100000210977_100000187161 [0,2,0,0,0,0|0,0,0]=2 16441 B18R2.274 Fc1ccc(cc1)COCc2ccc(cc2)Cl 7a_100000211118_100000198546 [0,2,0,0,0,0|0,0,0]=2 16442 B18R2.274 Fc1ccc(cc1)COCc2ccc(cc2)F 34a_100000210977_100000198546 [0,2,0,0,0,0|0,0,0]=2 16443 B18R2.274 Fc1ccc(cc1)COCc2ccc(cc2)F 7a_100000210977_100000198546 [0,2,0,0,0,0|0,0,0]=2 16444 B18R2.274 Fc1ccc(cc1)COCc2ccc(cc2)I 34a_100000210977_100000189116 [0,2,0,0,0,0|0,0,0]=2 16445 B18R2.274 Fc1ccc(cc1)COCc2ccc(cc2)I 34a_100000690907_100000198546 [0,2,0,0,0,0|0,0,0]=2 16446 B18R2.274 Fc1ccc(cc1)COCc2ccc(cc2)I 7a_100000210977_100000189116 [0,2,0,0,0,0|0,0,0]=2 16447 B18R2.274 Fc1ccc(cc1)COCc2ccc(cc2)I 7a_100000690907_100000198546 [0,2,0,0,0,0|0,0,0]=2 16448 B18R2.274 Fc1ccc(cc1)COCc2ccc(cn2)Br 34a_100000210977_100000702658 [0,2,0,0,0,0|1,0,0]=3 16449 B18R2.274 Fc1ccc(cc1)COCc2ccc(cn2)Br 34a_100000754261_100000198546 [0,2,0,0,0,0|1,0,0]=3 16450 B18R2.274 Fc1ccc(cc1)COCc2ccc(cn2)Br 7a_100000210977_100000702658 [0,2,0,0,0,0|1,0,0]=3 16451 B18R2.274 Fc1ccc(cc1)COCc2ccc(cn2)Cl 34a_100000210977_100012066911 [0,2,0,0,0,0|1,0,0]=3 16452 B18R2.274 Fc1ccc(cc1)COCc2ccc(cn2)Cl 34a_100000703999_100000198546 [0,2,0,0,0,0|1,0,0]=3 16453 B18R2.274 Fc1ccc(cc1)COCc2ccc(cn2)Cl 7a_100000210977_100012066911 [0,2,0,0,0,0|1,0,0]=3 16454 B18R2.274 Fc1ccc(cc1)COCc2ccc(cn2)F 34a_100000210977_100000703193 [0,2,0,0,0,0|1,0,0]=3 16455 B18R2.274 Fc1ccc(cc1)COCc2ccc(cn2)F 34a_100011999454_100000198546 [0,2,0,0,0,0|1,0,0]=3 16456 B18R2.274 Fc1ccc(cc1)COCc2ccc(cn2)F 7a_100000210977_100000703193 [0,2,0,0,0,0|1,0,0]=3 16457 B18R2.274 Fc1ccc(cc1)COCc2ccc(nc2)Br 34a_100000210977_100009831999 [0,2,0,0,0,0|1,0,0]=3 16458 B18R2.274 Fc1ccc(cc1)COCc2ccc(nc2)Br 34a_100009816760_100000198546 [0,2,0,0,0,0|1,0,0]=3 16459 B18R2.274 Fc1ccc(cc1)COCc2ccc(nc2)Br 7a_100000210977_100009831999 [0,2,0,0,0,0|1,0,0]=3 16460 B18R2.274 Fc1ccc(cc1)COCc2ccc(nc2)Br 7a_100009816760_100000198546 [0,2,0,0,0,0|1,0,0]=3 16461 B18R2.274 Fc1ccc(cc1)COCc2ccc(nc2)Cl 34a_100000210977_100000735431 [0,2,0,0,0,0|1,0,0]=3 16462 B18R2.274 Fc1ccc(cc1)COCc2ccc(nc2)Cl 34a_100000755211_100000198546 [0,2,0,0,0,0|1,0,0]=3 16463 B18R2.274 Fc1ccc(cc1)COCc2ccc(nc2)Cl 7a_100000210977_100000735431 [0,2,0,0,0,0|1,0,0]=3 16464 B18R2.274 Fc1ccc(cc1)COCc2ccc(nc2)Cl 7a_100000755211_100000198546 [0,2,0,0,0,0|1,0,0]=3 16465 B18R2.274 Fc1ccc(cc1)COCc2ccc(nc2)F 34a_100000079959_100000198546 [0,2,0,0,0,0|1,0,0]=3 16466 B18R2.274 Fc1ccc(cc1)COCc2ccc(nc2)F 34a_100000210977_100000099788 [0,2,0,0,0,0|1,0,0]=3 16467 B18R2.274 Fc1ccc(cc1)COCc2ccc(nc2)F 7a_100000210977_100009820150 [0,2,0,0,0,0|1,0,0]=3 16468 B18R2.274 Fc1ccc(cc1)COCc2ccc(nn2)Cl 34a_100000210977_100016992710 [0,2,0,0,0,0|2,0,0]=4 16469 B18R2.274 Fc1ccc(cc1)COCc2ccc(nn2)Cl 7a_100000210977_100016992710 [0,2,0,0,0,0|2,0,0]=4 16470 B18R2.274 Fc1ccc(cc1)COCc2cnc(cn2)Cl 34a_100012002382_100000198546 [0,2,0,0,0,0|2,0,0]=4 16471 B18R2.274 Fc1ccc(cc1)COCc2cnc(nc2)Cl 34a_100009855073_100000198546 [0,2,0,0,0,0|2,0,0]=4 16472 B18R2.274 Fc1ccc(cc1)COCc2cnc(nc2)Cl 7a_100009855073_100000198546 [0,2,0,0,0,0|2,0,0]=4 16473 B18R2.274 Fc1ccc(cc1)COCc2ncc(cn2)Br 34a_100000210977_100010064664 [0,2,0,0,0,0|2,0,0]=4 16474 B18R2.274 Fc1ccc(cc1)COCc2ncc(cn2)Br 7a_100000210977_100010064664 [0,2,0,0,0,0|2,0,0]=4 16475 B18R2.274 Fc1ccc(cc1)CSCc2ccc(cc2)Br 62a_100000189115_100000187164 [0,2,0,0,0,0|0,1,0]=3 16476 B18R2.274 Fc1ccc(cc1)CSCc2ccc(cc2)Br 62a_100000198546_100000189115 [0,2,0,0,0,0|0,1,0]=3 16477 B18R2.274 Fc1ccc(cc1)CSCc2ccc(cc2)Cl 62a_100000187161_100000187164 [0,2,0,0,0,0|0,1,0]=3 16478 B18R2.274 Fc1ccc(cc1)CSCc2ccc(cc2)Cl 62a_100000198546_100000187161 [0,2,0,0,0,0|0,1,0]=3 16479 B18R2.274 Fc1ccc(cc1)CSCc2ccc(cc2)F 62a_100000198546_100000187164 [0,2,0,0,0,0|0,1,0]=3 16480 B18R2.274 Fc1ccc(cc1)CSCc2ccc(cc2)I 62a_100000189116_100000187164 [0,2,0,0,0,0|0,1,0]=3 16481 B18R2.274 Fc1ccc(cc1)CSCc2ccc(cc2)I 62a_100000198546_100000189116 [0,2,0,0,0,0|0,1,0]=3 16482 B18R2.274 Fc1ccc(cc1)CSCc2ccc(cn2)Br 62a_100000198546_100000702658 [0,2,0,0,0,0|1,1,0]=4 16483 B18R2.274 Fc1ccc(cc1)CSCc2ccc(cn2)Br 62a_100000702658_100000187164 [0,2,0,0,0,0|1,1,0]=4 16484 B18R2.274 Fc1ccc(cc1)CSCc2ccc(cn2)Cl 62a_100000198546_100000697101 [0,2,0,0,0,0|1,1,0]=4 16485 B18R2.274 Fc1ccc(cc1)CSCc2ccc(cn2)Cl 62a_100012066911_100000187164 [0,2,0,0,0,0|1,1,0]=4 16486 B18R2.274 Fc1ccc(cc1)CSCc2ccc(cn2)F 62a_100000198546_100000703193 [0,2,0,0,0,0|1,1,0]=4 16487 B18R2.274 Fc1ccc(cc1)CSCc2ccc(cn2)F 62a_100000703193_100000187164 [0,2,0,0,0,0|1,1,0]=4 16488 B18R2.274 Fc1ccc(cc1)CSCc2ccc(nc2)Br 62a_100000198546_100009831999 [0,2,0,0,0,0|1,1,0]=4 16489 B18R2.274 Fc1ccc(cc1)CSCc2ccc(nc2)Br 62a_100009831999_100000187164 [0,2,0,0,0,0|1,1,0]=4 16490 B18R2.274 Fc1ccc(cc1)CSCc2ccc(nc2)Cl 62a_100000198546_100000735431 [0,2,0,0,0,0|1,1,0]=4 16491 B18R2.274 Fc1ccc(cc1)CSCc2ccc(nc2)Cl 62a_100000735431_100000187164 [0,2,0,0,0,0|1,1,0]=4 16492 B18R2.274 Fc1ccc(cc1)CSCc2ccc(nc2)F 62a_100000198546_100000099788 [0,2,0,0,0,0|1,1,0]=4 16493 B18R2.274 Fc1ccc(cc1)CSCc2ccc(nc2)F 62a_100009820150_100000187164 [0,2,0,0,0,0|1,1,0]=4 16494 B18R2.274 Fc1ccc(cc1)NCCc2ccc(cc2)Br 34a_100000185862_100011740612 [0,2,0,0,0,0|2,0,0]=4 16495 B18R2.274 Fc1ccc(cc1)NCCc2ccc(cc2)Cl 34a_100000185862_100011713675 [0,2,0,0,0,0|2,0,0]=4 16496 B18R2.274 Fc1ccc(cc1)OCCc2ccc(cc2)Br 34a_100000210339_100011740612 [0,2,0,0,0,0|2,0,0]=4 16497 B18R2.274 Fc1ccc(cc1)OCCc2ccc(cc2)Cl 34a_100000210339_100011713675 [0,2,0,0,0,0|2,0,0]=4 16498 B18R2.274 Fc1ccc(cc1)SCCc2ccc(cc2)Br 62a_100000211213_100011740612 [0,2,0,0,0,0|2,0,0]=4 16499 B18R2.274 Fc1ccc(cc1)SCCc2ccc(cc2)Br 62a_100011740612_100000211213 [0,2,0,0,0,0|2,0,0]=4 16500 B18R2.274 Fc1ccc(cc1)SCCc2ccc(cc2)Cl 62a_100000211213_100011713675 [0,2,0,0,0,0|2,0,0]=4 16501 B18R2.274 Fc1ccc(cc1)SCCc2ccc(cc2)Cl 62a_100011713675_100000211213 [0,2,0,0,0,0|2,0,0]=4 16502 B18R2.274 Fc1ccc(cn1)CNCc2ccc(cc2)Br 2230a_100000101913_100011217064 [0,2,0,0,0,0|2,0,0]=4 16503 B18R2.274 Fc1ccc(cn1)CNCc2ccc(cc2)Br 2230a_100000174875_100009820150 [0,2,0,0,0,0|2,0,0]=4 16504 B18R2.274 Fc1ccc(cn1)CNCc2ccc(cc2)Br 270004a_100000101913_100000186029 [0,2,0,0,0,0|2,0,0]=4 16505 B18R2.274 Fc1ccc(cn1)CNCc2ccc(cc2)Br 34a_100000101913_100000189115 [0,2,0,0,0,0|2,0,0]=4 16506 B18R2.274 Fc1ccc(cn1)CNCc2ccc(cc2)Br 34a_100000174875_100000099788 [0,2,0,0,0,0|2,0,0]=4 16507 B18R2.274 Fc1ccc(cn1)CNCc2ccc(cc2)Cl 2230a_100000101913_100000694040 [0,2,0,0,0,0|2,0,0]=4 16508 B18R2.274 Fc1ccc(cn1)CNCc2ccc(cc2)Cl 2230a_100000174871_100009820150 [0,2,0,0,0,0|2,0,0]=4 16509 B18R2.274 Fc1ccc(cn1)CNCc2ccc(cc2)Cl 270004a_100000101913_100000189385 [0,2,0,0,0,0|2,0,0]=4 16510 B18R2.274 Fc1ccc(cn1)CNCc2ccc(cc2)Cl 34a_100000101913_100000694040 [0,2,0,0,0,0|2,0,0]=4 16511 B18R2.274 Fc1ccc(cn1)CNCc2ccc(cc2)Cl 34a_100000174871_100000099788 [0,2,0,0,0,0|2,0,0]=4 16512 B18R2.274 Fc1ccc(cn1)CNCc2ccc(cc2)I 2230a_100000101913_100000189116 [0,2,0,0,0,0|2,0,0]=4 16513 B18R2.274 Fc1ccc(cn1)CNCc2ccc(cc2)I 2230a_100016989417_100009820150 [0,2,0,0,0,0|2,0,0]=4 16514 B18R2.274 Fc1ccc(cn1)CNCc2ccc(cc2)I 34a_100000101913_100000189116 [0,2,0,0,0,0|2,0,0]=4 16515 B18R2.274 Fc1ccc(cn1)CNCc2ccc(cc2)I 34a_100016989417_100000099788 [0,2,0,0,0,0|2,0,0]=4 16516 B18R2.274 Fc1ccc(cn1)COCc2ccc(cc2)Br 34a_100000079959_100000189115 [0,2,0,0,0,0|1,0,0]=3 16517 B18R2.274 Fc1ccc(cn1)COCc2ccc(cc2)Br 34a_100000695286_100000099788 [0,2,0,0,0,0|1,0,0]=3 16518 B18R2.274 Fc1ccc(cn1)COCc2ccc(cc2)Cl 34a_100000079959_100000694040 [0,2,0,0,0,0|1,0,0]=3 16519 B18R2.274 Fc1ccc(cn1)COCc2ccc(cc2)Cl 34a_100000211118_100000099788 [0,2,0,0,0,0|1,0,0]=3 16520 B18R2.274 Fc1ccc(cn1)COCc2ccc(cc2)Cl 7a_100000211118_100009820150 [0,2,0,0,0,0|1,0,0]=3 16521 B18R2.274 Fc1ccc(cn1)COCc2ccc(cc2)I 34a_100000079959_100000189116 [0,2,0,0,0,0|1,0,0]=3 16522 B18R2.274 Fc1ccc(cn1)COCc2ccc(cc2)I 34a_100000690907_100000099788 [0,2,0,0,0,0|1,0,0]=3 16523 B18R2.274 Fc1ccc(cn1)COCc2ccc(cc2)I 7a_100000690907_100009820150 [0,2,0,0,0,0|1,0,0]=3 16524 B18R2.274 Fc1ccc(cn1)COCc2ccc(cn2)Br 34a_100000079959_100000702658 [0,2,0,0,0,0|2,0,0]=4 16525 B18R2.274 Fc1ccc(cn1)COCc2ccc(cn2)Br 34a_100000754261_100000099788 [0,2,0,0,0,0|2,0,0]=4 16526 B18R2.274 Fc1ccc(cn1)COCc2ccc(cn2)Cl 34a_100000079959_100012066911 [0,2,0,0,0,0|2,0,0]=4 16527 B18R2.274 Fc1ccc(cn1)COCc2ccc(cn2)Cl 34a_100000703999_100000099788 [0,2,0,0,0,0|2,0,0]=4 16528 B18R2.274 Fc1ccc(cn1)COCc2ccc(nc2)Br 34a_100000079959_100009831999 [0,2,0,0,0,0|2,0,0]=4 16529 B18R2.274 Fc1ccc(cn1)COCc2ccc(nc2)Br 34a_100009816760_100000099788 [0,2,0,0,0,0|2,0,0]=4 16530 B18R2.274 Fc1ccc(cn1)COCc2ccc(nc2)Br 7a_100009816760_100009820150 [0,2,0,0,0,0|2,0,0]=4 16531 B18R2.274 Fc1ccc(cn1)COCc2ccc(nc2)Cl 34a_100000079959_100000735431 [0,2,0,0,0,0|2,0,0]=4 16532 B18R2.274 Fc1ccc(cn1)COCc2ccc(nc2)Cl 34a_100000755211_100000099788 [0,2,0,0,0,0|2,0,0]=4 16533 B18R2.274 Fc1ccc(cn1)COCc2ccc(nc2)Cl 7a_100000755211_100009820150 [0,2,0,0,0,0|2,0,0]=4 16534 B18R2.274 Fc1ccc(cn1)COCc2ccc(nc2)F 34a_100000079959_100000099788 [0,2,0,0,0,0|2,0,0]=4 16535 B18R2.274 Fc1ccc(cn1)CSCc2ccc(cc2)Br 62a_100000189115_100000099788 [0,2,0,0,0,0|1,1,0]=4 16536 B18R2.274 Fc1ccc(cn1)CSCc2ccc(cc2)Br 62a_100009820150_100000189115 [0,2,0,0,0,0|1,1,0]=4 16537 B18R2.274 Fc1ccc(cn1)CSCc2ccc(cc2)Cl 62a_100000187161_100000099788 [0,2,0,0,0,0|1,1,0]=4 16538 B18R2.274 Fc1ccc(cn1)CSCc2ccc(cc2)Cl 62a_100009820150_100000187161 [0,2,0,0,0,0|1,1,0]=4 16539 B18R2.274 Fc1ccc(cn1)CSCc2ccc(cc2)I 62a_100000189116_100000099788 [0,2,0,0,0,0|1,1,0]=4 16540 B18R2.274 Fc1ccc(cn1)CSCc2ccc(cc2)I 62a_100009820150_100000189116 [0,2,0,0,0,0|1,1,0]=4 16541 B18R2.274 Fc1ccc(nc1)CNCc2ccc(cc2)Br 207a_100000174875_100011934744 [0,2,0,0,0,0|2,0,0]=4 16542 B18R2.274 Fc1ccc(nc1)CNCc2ccc(cc2)Br 2230a_100000174875_100000703193 [0,2,0,0,0,0|2,0,0]=4 16543 B18R2.274 Fc1ccc(nc1)CNCc2ccc(cc2)Br 270004a_100000174875_100011934744 [0,2,0,0,0,0|2,0,0]=4 16544 B18R2.274 Fc1ccc(nc1)CNCc2ccc(cc2)Br 34a_100000174875_100000703193 [0,2,0,0,0,0|2,0,0]=4 16545 B18R2.274 Fc1ccc(nc1)CNCc2ccc(cc2)Br 34a_100020620131_100000189115 [0,2,0,0,0,0|2,0,0]=4 16546 B18R2.274 Fc1ccc(nc1)CNCc2ccc(cc2)Cl 207a_100000174871_100011934744 [0,2,0,0,0,0|2,0,0]=4 16547 B18R2.274 Fc1ccc(nc1)CNCc2ccc(cc2)Cl 2230a_100000174871_100000703193 [0,2,0,0,0,0|2,0,0]=4 16548 B18R2.274 Fc1ccc(nc1)CNCc2ccc(cc2)Cl 270004a_100000174871_100011934744 [0,2,0,0,0,0|2,0,0]=4 16549 B18R2.274 Fc1ccc(nc1)CNCc2ccc(cc2)Cl 34a_100000174871_100000703193 [0,2,0,0,0,0|2,0,0]=4 16550 B18R2.274 Fc1ccc(nc1)CNCc2ccc(cc2)Cl 34a_100020620131_100000694040 [0,2,0,0,0,0|2,0,0]=4 16551 B18R2.274 Fc1ccc(nc1)CNCc2ccc(cc2)I 207a_100016989417_100011934744 [0,2,0,0,0,0|2,0,0]=4 16552 B18R2.274 Fc1ccc(nc1)CNCc2ccc(cc2)I 2230a_100016989417_100000703193 [0,2,0,0,0,0|2,0,0]=4 16553 B18R2.274 Fc1ccc(nc1)CNCc2ccc(cc2)I 270004a_100016989417_100011934744 [0,2,0,0,0,0|2,0,0]=4 16554 B18R2.274 Fc1ccc(nc1)CNCc2ccc(cc2)I 34a_100016989417_100000703193 [0,2,0,0,0,0|2,0,0]=4 16555 B18R2.274 Fc1ccc(nc1)CNCc2ccc(cc2)I 34a_100020620131_100000189116 [0,2,0,0,0,0|2,0,0]=4 16556 B18R2.274 Fc1ccc(nc1)COCc2ccc(cc2)Br 34a_100000695286_100000703193 [0,2,0,0,0,0|1,0,0]=3 16557 B18R2.274 Fc1ccc(nc1)COCc2ccc(cc2)Br 34a_100011999454_100000189115 [0,2,0,0,0,0|1,0,0]=3 16558 B18R2.274 Fc1ccc(nc1)COCc2ccc(cc2)Cl 34a_100000211118_100000703193 [0,2,0,0,0,0|1,0,0]=3 16559 B18R2.274 Fc1ccc(nc1)COCc2ccc(cc2)Cl 34a_100011999454_100000694040 [0,2,0,0,0,0|1,0,0]=3 16560 B18R2.274 Fc1ccc(nc1)COCc2ccc(cc2)Cl 7a_100000211118_100000703193 [0,2,0,0,0,0|1,0,0]=3 16561 B18R2.274 Fc1ccc(nc1)COCc2ccc(cc2)I 34a_100000690907_100000703193 [0,2,0,0,0,0|1,0,0]=3 16562 B18R2.274 Fc1ccc(nc1)COCc2ccc(cc2)I 34a_100011999454_100000189116 [0,2,0,0,0,0|1,0,0]=3 16563 B18R2.274 Fc1ccc(nc1)COCc2ccc(cc2)I 7a_100000690907_100000703193 [0,2,0,0,0,0|1,0,0]=3 16564 B18R2.274 Fc1ccc(nc1)COCc2ccc(cn2)Br 34a_100000754261_100000703193 [0,2,0,0,0,0|2,0,0]=4 16565 B18R2.274 Fc1ccc(nc1)COCc2ccc(cn2)Br 34a_100011999454_100000702658 [0,2,0,0,0,0|2,0,0]=4 16566 B18R2.274 Fc1ccc(nc1)COCc2ccc(cn2)Cl 34a_100000703999_100000703193 [0,2,0,0,0,0|2,0,0]=4 16567 B18R2.274 Fc1ccc(nc1)COCc2ccc(cn2)Cl 34a_100011999454_100012066911 [0,2,0,0,0,0|2,0,0]=4 16568 B18R2.274 Fc1ccc(nc1)COCc2ccc(cn2)F 34a_100011999454_100000703193 [0,2,0,0,0,0|2,0,0]=4 16569 B18R2.274 Fc1ccc(nc1)COCc2ccc(nc2)Br 34a_100009816760_100000703193 [0,2,0,0,0,0|2,0,0]=4 16570 B18R2.274 Fc1ccc(nc1)COCc2ccc(nc2)Br 34a_100011999454_100009831999 [0,2,0,0,0,0|2,0,0]=4 16571 B18R2.274 Fc1ccc(nc1)COCc2ccc(nc2)Br 7a_100009816760_100000703193 [0,2,0,0,0,0|2,0,0]=4 16572 B18R2.274 Fc1ccc(nc1)COCc2ccc(nc2)Cl 34a_100000755211_100000703193 [0,2,0,0,0,0|2,0,0]=4 16573 B18R2.274 Fc1ccc(nc1)COCc2ccc(nc2)Cl 34a_100011999454_100000735431 [0,2,0,0,0,0|2,0,0]=4 16574 B18R2.274 Fc1ccc(nc1)COCc2ccc(nc2)Cl 7a_100000755211_100000703193 [0,2,0,0,0,0|2,0,0]=4 16575 B18R2.274 Fc1ccc(nc1)COCc2ccc(nc2)F 34a_100000079959_100000703193 [0,2,0,0,0,0|2,0,0]=4 16576 B18R2.274 Fc1ccc(nc1)COCc2ccc(nc2)F 34a_100011999454_100000099788 [0,2,0,0,0,0|2,0,0]=4 16577 B18R2.274 Fc1ccc(nc1)CSCc2ccc(cc2)Br 62a_100000189115_100000703193 [0,2,0,0,0,0|1,1,0]=4 16578 B18R2.274 Fc1ccc(nc1)CSCc2ccc(cc2)Br 62a_100000703193_100000189115 [0,2,0,0,0,0|1,1,0]=4 16579 B18R2.274 Fc1ccc(nc1)CSCc2ccc(cc2)Cl 62a_100000187161_100000703193 [0,2,0,0,0,0|1,1,0]=4 16580 B18R2.274 Fc1ccc(nc1)CSCc2ccc(cc2)Cl 62a_100000703193_100000187161 [0,2,0,0,0,0|1,1,0]=4 16581 B18R2.274 Fc1ccc(nc1)CSCc2ccc(cc2)I 62a_100000189116_100000703193 [0,2,0,0,0,0|1,1,0]=4 16582 B18R2.274 Fc1ccc(nc1)CSCc2ccc(cc2)I 62a_100000703193_100000189116 [0,2,0,0,0,0|1,1,0]=4 16583 B18R2.274 Ic1ccc(cc1)CNCc2ccc(cc2)I 207a_100016989417_100000188517 [0,2,0,0,0,0|1,0,0]=3 16584 B18R2.274 Ic1ccc(cc1)CNCc2ccc(cc2)I 2230a_100016989417_100000189116 [0,2,0,0,0,0|1,0,0]=3 16585 B18R2.274 Ic1ccc(cc1)CNCc2ccc(cc2)I 34a_100016989417_100000189116 [0,2,0,0,0,0|1,0,0]=3 16586 B18R2.274 Ic1ccc(cc1)COCc2ccc(cc2)I 34a_100000690907_100000189116 [0,2,0,0,0,0|0,0,0]=2 16587 B18R2.274 Ic1ccc(cc1)COCc2ccc(cc2)I 7a_100000690907_100000189116 [0,2,0,0,0,0|0,0,0]=2 16588 B18R2.274 Ic1ccc(cc1)CSCc2ccc(cc2)I 62a_100000189116_100000189116 [0,2,0,0,0,0|0,1,0]=3 16589 B18R2.274 Nc1ccc(cc1)COCc2ccc(cc2)Br 34a_100011215238_100000189115 [0,2,0,0,0,0|0,0,0]=2 16590 B18R2.274 Nc1ccc(cc1)COCc2ccc(cc2)Cl 34a_100011215238_100000694040 [0,2,0,0,0,0|0,0,0]=2 16591 B18R2.274 Nc1ccc(cc1)COCc2ccc(cc2)F 34a_100011215238_100000198546 [0,2,0,0,0,0|0,0,0]=2 16592 B18R2.274 Nc1ccc(cc1)COCc2ccc(cc2)I 34a_100011215238_100000189116 [0,2,0,0,0,0|0,0,0]=2 16593 B18R2.274 Nc1ccc(cc1)COCc2ccc(cn2)Br 34a_100011215238_100000702658 [0,2,0,0,0,0|1,0,0]=3 16594 B18R2.274 Nc1ccc(cc1)COCc2ccc(cn2)Cl 34a_100011215238_100012066911 [0,2,0,0,0,0|1,0,0]=3 16595 B18R2.274 Nc1ccc(cc1)COCc2ccc(cn2)F 34a_100011215238_100000703193 [0,2,0,0,0,0|1,0,0]=3 16596 B18R2.274 Nc1ccc(cc1)COCc2ccc(nc2)Br 34a_100011215238_100009831999 [0,2,0,0,0,0|1,0,0]=3 16597 B18R2.274 Nc1ccc(cc1)COCc2ccc(nc2)Cl 34a_100011215238_100000735431 [0,2,0,0,0,0|1,0,0]=3 16598 B18R2.274 Nc1ccc(cc1)COCc2ccc(nc2)F 34a_100011215238_100000099788 [0,2,0,0,0,0|1,0,0]=3 16599 B18R2.274 Nc1ccc(cc1)COCc2ccc(nn2)Cl 34a_100011215238_100016992710 [0,2,0,0,0,0|2,0,0]=4 16600 B18R2.274 Nc1ccc(cc1)COCc2ncc(cn2)Br 34a_100011215238_100010064664 [0,2,0,0,0,0|2,0,0]=4 16601 B18R2.274 Nc1ccc(cc1)OCCc2ccc(cc2)Br 34a_100000185829_100011740612 [0,2,0,0,0,0|2,0,0]=4 16602 B18R2.274 Nc1ccc(cc1)OCCc2ccc(cc2)Cl 34a_100000185829_100011713675 [0,2,0,0,0,0|2,0,0]=4 16603 B18R2.274 Nc1ccc(cc1)OCCc2ccc(cc2)F 34a_100000185829_100011217392 [0,2,0,0,0,0|2,0,0]=4 16604 B18R2.274 Nc1ccc(cc1)SCCc2ccc(cc2)Br 62a_100000185761_100011740612 [0,2,0,0,0,0|2,0,0]=4 16605 B18R2.274 Nc1ccc(cc1)SCCc2ccc(cc2)Br 62a_100011740612_100000185761 [0,2,0,0,0,0|2,0,0]=4 16606 B18R2.274 Nc1ccc(cc1)SCCc2ccc(cc2)Cl 62a_100000185761_100011713675 [0,2,0,0,0,0|2,0,0]=4 16607 B18R2.274 Nc1ccc(cc1)SCCc2ccc(cc2)Cl 62a_100011713675_100000185761 [0,2,0,0,0,0|2,0,0]=4 16608 B18R2.274 Nc1ccc(cc1)SCCc2ccc(cc2)F 62a_100000185761_100011217392 [0,2,0,0,0,0|2,0,0]=4 16609 B18R2.274 Nc1ccc(cc1)SCCc2ccc(cc2)F 62a_100011217392_100000185761 [0,2,0,0,0,0|2,0,0]=4 16610 B18R2.274 Nc1ccc(cc1)SCCc2ccc(cc2)O 62a_100000185761_100009816426 [0,2,0,0,0,0|2,0,0]=4 16611 B18R2.274 Nc1ccc(cc1)SCCc2ccc(cc2)O 62a_100009816426_100000185761 [0,2,0,0,0,0|2,0,0]=4 16612 B18R2.274 Nc1ccc(cn1)COCc2ccc(cc2)Br 34a_100000704267_100000189115 [0,2,0,0,0,0|1,0,0]=3 16613 B18R2.274 Nc1ccc(cn1)COCc2ccc(cc2)Cl 34a_100000704267_100000694040 [0,2,0,0,0,0|1,0,0]=3 16614 B18R2.274 Nc1ccc(cn1)COCc2ccc(cc2)F 34a_100000704267_100000198546 [0,2,0,0,0,0|1,0,0]=3 16615 B18R2.274 Nc1ccc(cn1)COCc2ccc(cc2)I 34a_100000704267_100000189116 [0,2,0,0,0,0|1,0,0]=3 16616 B18R2.274 Nc1ccc(cn1)COCc2ccc(cn2)Br 34a_100000704267_100000702658 [0,2,0,0,0,0|2,0,0]=4 16617 B18R2.274 Nc1ccc(cn1)COCc2ccc(cn2)Cl 34a_100000704267_100012066911 [0,2,0,0,0,0|2,0,0]=4 16618 B18R2.274 Nc1ccc(cn1)COCc2ccc(cn2)F 34a_100000704267_100000703193 [0,2,0,0,0,0|2,0,0]=4 16619 B18R2.274 Nc1ccc(cn1)COCc2ccc(nc2)Br 34a_100000704267_100009831999 [0,2,0,0,0,0|2,0,0]=4 16620 B18R2.274 Nc1ccc(cn1)COCc2ccc(nc2)Cl 34a_100000704267_100000735431 [0,2,0,0,0,0|2,0,0]=4 16621 B18R2.274 Nc1ccc(cn1)COCc2ccc(nc2)F 34a_100000704267_100000099788 [0,2,0,0,0,0|2,0,0]=4 16622 B18R2.274 Nc1ccc(nc1)COCc2ccc(cc2)Br 34a_100011998161_100000189115 [0,2,0,0,0,0|1,0,0]=3 16623 B18R2.274 Nc1ccc(nc1)COCc2ccc(cc2)Cl 34a_100011998161_100000694040 [0,2,0,0,0,0|1,0,0]=3 16624 B18R2.274 Nc1ccc(nc1)COCc2ccc(cc2)F 34a_100011998161_100000198546 [0,2,0,0,0,0|1,0,0]=3 16625 B18R2.274 Nc1ccc(nc1)COCc2ccc(cc2)I 34a_100011998161_100000189116 [0,2,0,0,0,0|1,0,0]=3 16626 B18R2.274 Nc1ccc(nc1)COCc2ccc(cn2)Br 34a_100011998161_100000702658 [0,2,0,0,0,0|2,0,0]=4 16627 B18R2.274 Nc1ccc(nc1)COCc2ccc(cn2)Cl 34a_100011998161_100012066911 [0,2,0,0,0,0|2,0,0]=4 16628 B18R2.274 Nc1ccc(nc1)COCc2ccc(cn2)F 34a_100011998161_100000703193 [0,2,0,0,0,0|2,0,0]=4 16629 B18R2.274 Nc1ccc(nc1)COCc2ccc(nc2)Br 34a_100011998161_100009831999 [0,2,0,0,0,0|2,0,0]=4 16630 B18R2.274 Nc1ccc(nc1)COCc2ccc(nc2)Cl 34a_100011998161_100000735431 [0,2,0,0,0,0|2,0,0]=4 16631 B18R2.274 Nc1ccc(nc1)COCc2ccc(nc2)F 34a_100011998161_100000099788 [0,2,0,0,0,0|2,0,0]=4 16632 B18R2.274 O=c1ccc(c[nH]1)COCc2ccc(cc2)Br 34a_100011999846_100000189115 [0,2,0,0,0,0|1,0,0]=3 16633 B18R2.274 O=c1ccc(c[nH]1)COCc2ccc(cc2)Cl 34a_100011999846_100000694040 [0,2,0,0,0,0|1,0,0]=3 16634 B18R2.274 O=c1ccc(c[nH]1)COCc2ccc(cc2)F 34a_100011999846_100000198546 [0,2,0,0,0,0|1,0,0]=3 16635 B18R2.274 O=c1ccc(c[nH]1)COCc2ccc(cc2)I 34a_100011999846_100000189116 [0,2,0,0,0,0|1,0,0]=3 16636 B18R2.274 O=c1ccc(c[nH]1)COCc2ccc(cn2)Br 34a_100011999846_100000702658 [0,2,0,0,0,0|2,0,0]=4 16637 B18R2.274 O=c1ccc(c[nH]1)COCc2ccc(cn2)Cl 34a_100011999846_100012066911 [0,2,0,0,0,0|2,0,0]=4 16638 B18R2.274 O=c1ccc(c[nH]1)COCc2ccc(cn2)F 34a_100011999846_100000703193 [0,2,0,0,0,0|2,0,0]=4 16639 B18R2.274 O=c1ccc(c[nH]1)COCc2ccc(nc2)Br 34a_100011999846_100009831999 [0,2,0,0,0,0|2,0,0]=4 16640 B18R2.274 O=c1ccc(c[nH]1)COCc2ccc(nc2)Cl 34a_100011999846_100000735431 [0,2,0,0,0,0|2,0,0]=4 16641 B18R2.274 O=c1ccc(c[nH]1)COCc2ccc(nc2)F 34a_100011999846_100000099788 [0,2,0,0,0,0|2,0,0]=4 16642 B18R2.274 Oc1ccc(cc1)CCNc2ccc(cc2)Br 2230a_100000210018_100009816426 [0,2,0,0,0,0|2,0,0]=4 16643 B18R2.274 Oc1ccc(cc1)CCNc2ccc(cc2)Cl 2230a_100000210052_100009816426 [0,2,0,0,0,0|2,0,0]=4 16644 B18R2.274 Oc1ccc(cc1)CCOc2ccc(cc2)Br 7a_100000185759_100009816426 [0,2,0,0,0,0|2,0,0]=4 16645 B18R2.274 Oc1ccc(cc1)CCOc2ccc(cc2)Cl 7a_100000210216_100009816426 [0,2,0,0,0,0|2,0,0]=4 16646 B18R2.274 Oc1ccc(cc1)CCOc2ccc(cc2)I 7a_100000212066_100009816426 [0,2,0,0,0,0|2,0,0]=4 16647 B18R2.274 Oc1ccc(cc1)CCSc2ccc(cc2)Br 62a_100000752885_100009816426 [0,2,0,0,0,0|2,0,0]=4 16648 B18R2.274 Oc1ccc(cc1)CCSc2ccc(cc2)Br 62a_100009816426_100000752885 [0,2,0,0,0,0|2,0,0]=4 16649 B18R2.274 Oc1ccc(cc1)CCSc2ccc(cc2)Cl 62a_100000755918_100009816426 [0,2,0,0,0,0|2,0,0]=4 16650 B18R2.274 Oc1ccc(cc1)CCSc2ccc(cc2)Cl 62a_100009816426_100000755918 [0,2,0,0,0,0|2,0,0]=4 16651 B18R2.274 Oc1ccc(cc1)CCSc2ccc(cc2)F 62a_100000211213_100009816426 [0,2,0,0,0,0|2,0,0]=4 16652 B18R2.274 Oc1ccc(cc1)CCSc2ccc(cc2)F 62a_100009816426_100000211213 [0,2,0,0,0,0|2,0,0]=4 16653 B18R2.274 Oc1ccc(cc1)CCSc2ccc(cc2)O 62a_100009816426_100000185759 [0,2,0,0,0,0|2,0,0]=4 16654 B18R2.274 Oc1ccc(cc1)CNCc2ccc(cc2)Br 34a_100000185549_100000189115 [0,2,0,0,0,0|1,0,0]=3 16655 B18R2.274 Oc1ccc(cc1)CNCc2ccc(cc2)Cl 34a_100000185549_100000694040 [0,2,0,0,0,0|1,0,0]=3 16656 B18R2.274 Oc1ccc(cc1)CNCc2ccc(cc2)F 34a_100000185549_100000198546 [0,2,0,0,0,0|1,0,0]=3 16657 B18R2.274 Oc1ccc(cc1)CNCc2ccc(cc2)I 34a_100000185549_100000189116 [0,2,0,0,0,0|1,0,0]=3 16658 B18R2.274 Oc1ccc(cc1)CNCc2ccc(cn2)Br 34a_100000185549_100000702658 [0,2,0,0,0,0|2,0,0]=4 16659 B18R2.274 Oc1ccc(cc1)CNCc2ccc(cn2)Cl 34a_100000185549_100012066911 [0,2,0,0,0,0|2,0,0]=4 16660 B18R2.274 Oc1ccc(cc1)CNCc2ccc(cn2)F 34a_100000185549_100000703193 [0,2,0,0,0,0|2,0,0]=4 16661 B18R2.274 Oc1ccc(cc1)CNCc2ccc(nc2)Br 34a_100000185549_100009831999 [0,2,0,0,0,0|2,0,0]=4 16662 B18R2.274 Oc1ccc(cc1)CNCc2ccc(nc2)Cl 34a_100000185549_100000735431 [0,2,0,0,0,0|2,0,0]=4 16663 B18R2.274 Oc1ccc(cc1)CNCc2ccc(nc2)F 34a_100000185549_100000099788 [0,2,0,0,0,0|2,0,0]=4 16664 B18R2.274 Oc1ccc(cc1)NCCc2ccc(cc2)Br 34a_100000185829_100011740612 [0,2,0,0,0,0|2,0,0]=4 16665 B18R2.274 Oc1ccc(cc1)NCCc2ccc(cc2)Cl 34a_100000185829_100011713675 [0,2,0,0,0,0|2,0,0]=4 16666 B18R2.274 Oc1ccc(cc1)NCCc2ccc(cc2)F 34a_100000185829_100011217392 [0,2,0,0,0,0|2,0,0]=4 16667 B18R2.274 Oc1ccc(cc1)SCCc2ccc(cc2)Br 62a_100011740612_100000185759 [0,2,0,0,0,0|2,0,0]=4 16668 B18R2.274 Oc1ccc(cc1)SCCc2ccc(cc2)Cl 62a_100011713675_100000185759 [0,2,0,0,0,0|2,0,0]=4 16669 B18R2.274 Oc1ccc(cc1)SCCc2ccc(cc2)F 62a_100011217392_100000185759 [0,2,0,0,0,0|2,0,0]=4 16670 B18R2.274 Oc1ccc(cn1)CNCc2ccc(cc2)Br 207a_100000174875_100011361521 [0,2,0,0,0,0|2,0,0]=4 16671 B18R2.274 Oc1ccc(cn1)CNCc2ccc(cc2)Br 2230a_100000757128_100011217064 [0,2,0,0,0,0|2,0,0]=4 16672 B18R2.274 Oc1ccc(cn1)CNCc2ccc(cc2)Cl 207a_100000174871_100011361521 [0,2,0,0,0,0|2,0,0]=4 16673 B18R2.274 Oc1ccc(cn1)CNCc2ccc(cc2)Cl 2230a_100000757128_100000694040 [0,2,0,0,0,0|2,0,0]=4 16674 B18R2.274 Oc1ccc(cn1)CNCc2ccc(cc2)F 207a_100000174882_100011361521 [0,2,0,0,0,0|2,0,0]=4 16675 B18R2.274 Oc1ccc(cn1)CNCc2ccc(cc2)F 2230a_100000757128_100000198546 [0,2,0,0,0,0|2,0,0]=4 16676 B18R2.274 Oc1ccc(cn1)CNCc2ccc(cc2)I 207a_100016989417_100011361521 [0,2,0,0,0,0|2,0,0]=4 16677 B18R2.274 Oc1ccc(cn1)CNCc2ccc(cc2)I 2230a_100000757128_100000189116 [0,2,0,0,0,0|2,0,0]=4 16678 B18R2.274 [O-][n+]1ccc(cc1)COCc2ccc(cc2)Br 34a_100000031831_100000189115 [0,2,0,0,0,0|1,0,0]=3 16679 B18R2.274 [O-][n+]1ccc(cc1)COCc2ccc(cc2)Br 7a_100000031831_100011217064 [0,2,0,0,0,0|1,0,0]=3 16680 B18R2.274 [O-][n+]1ccc(cc1)COCc2ccc(cc2)Cl 34a_100000031831_100000694040 [0,2,0,0,0,0|1,0,0]=3 16681 B18R2.274 [O-][n+]1ccc(cc1)COCc2ccc(cc2)Cl 7a_100000031831_100000187161 [0,2,0,0,0,0|1,0,0]=3 16682 B18R2.274 [O-][n+]1ccc(cc1)COCc2ccc(cc2)F 34a_100000031831_100000198546 [0,2,0,0,0,0|1,0,0]=3 16683 B18R2.274 [O-][n+]1ccc(cc1)COCc2ccc(cc2)F 7a_100000031831_100000198546 [0,2,0,0,0,0|1,0,0]=3 16684 B18R2.274 [O-][n+]1ccc(cc1)COCc2ccc(cc2)I 34a_100000031831_100000189116 [0,2,0,0,0,0|1,0,0]=3 16685 B18R2.274 [O-][n+]1ccc(cc1)COCc2ccc(cc2)I 7a_100000031831_100000189116 [0,2,0,0,0,0|1,0,0]=3 16686 B18R2.274 [O-][n+]1ccc(cc1)COCc2ccc(cn2)Br 34a_100000031831_100000702658 [0,2,0,0,0,0|2,0,0]=4 16687 B18R2.274 [O-][n+]1ccc(cc1)COCc2ccc(cn2)Br 7a_100000031831_100000702658 [0,2,0,0,0,0|2,0,0]=4 16688 B18R2.274 [O-][n+]1ccc(cc1)COCc2ccc(cn2)Cl 34a_100000031831_100012066911 [0,2,0,0,0,0|2,0,0]=4 16689 B18R2.274 [O-][n+]1ccc(cc1)COCc2ccc(cn2)Cl 7a_100000031831_100012066911 [0,2,0,0,0,0|2,0,0]=4 16690 B18R2.274 [O-][n+]1ccc(cc1)COCc2ccc(cn2)F 34a_100000031831_100000703193 [0,2,0,0,0,0|2,0,0]=4 16691 B18R2.274 [O-][n+]1ccc(cc1)COCc2ccc(cn2)F 7a_100000031831_100000703193 [0,2,0,0,0,0|2,0,0]=4 16692 B18R2.274 [O-][n+]1ccc(cc1)COCc2ccc(nc2)Br 34a_100000031831_100009831999 [0,2,0,0,0,0|2,0,0]=4 16693 B18R2.274 [O-][n+]1ccc(cc1)COCc2ccc(nc2)Br 7a_100000031831_100009831999 [0,2,0,0,0,0|2,0,0]=4 16694 B18R2.274 [O-][n+]1ccc(cc1)COCc2ccc(nc2)Cl 34a_100000031831_100000735431 [0,2,0,0,0,0|2,0,0]=4 16695 B18R2.274 [O-][n+]1ccc(cc1)COCc2ccc(nc2)Cl 7a_100000031831_100000735431 [0,2,0,0,0,0|2,0,0]=4 16696 B18R2.274 [O-][n+]1ccc(cc1)COCc2ccc(nc2)F 34a_100000031831_100000099788 [0,2,0,0,0,0|2,0,0]=4 16697 B18R2.274 [O-][n+]1ccc(cc1)COCc2ccc(nc2)F 7a_100000031831_100009820150 [0,2,0,0,0,0|2,0,0]=4 16698 B18R2.4060 Brc1cc(ccc1CNCc2ccccc2)I 207a_100015324214_100010185650 [0,2,0,0,0,0|1,0,0]=3 16699 B18R2.4060 Brc1cc(ccc1CNCc2ccccc2)I 2230a_100015324214_100010146610 [0,2,0,0,0,0|1,0,0]=3 16700 B18R2.4060 Brc1cc(ccc1CNCc2ccccc2)I 34a_100015324214_100010146610 [0,2,0,0,0,0|1,0,0]=3 16701 B18R2.4060 Brc1cc(ccc1CNCc2cccnc2)I 207a_100000210453_100010185650 [0,2,0,0,0,0|2,0,0]=4 16702 B18R2.4060 Brc1cc(ccc1COCc2ccccc2)I 34a_100000210790_100010146610 [0,2,0,0,0,0|0,0,0]=2 16703 B18R2.4060 Brc1cc(ccc1COCc2ccccc2)I 7a_100000210790_100010146610 [0,2,0,0,0,0|0,0,0]=2 16704 B18R2.4060 Brc1cc(ccc1COCc2ccccc2)I 7a_100010240206_100000211182 [0,2,0,0,0,0|0,0,0]=2 16705 B18R2.4060 Brc1cc(ccc1COCc2ccccn2)I 7a_100010240206_100000721315 [0,2,0,0,0,0|1,0,0]=3 16706 B18R2.4060 Brc1cc(ccc1COCc2cccnc2)I 7a_100010240206_100000741622 [0,2,0,0,0,0|1,0,0]=3 16707 B18R2.4060 Brc1cc(ccc1COCc2cccnn2)I 7a_100010240206_100016990269 [0,2,0,0,0,0|2,0,0]=4 16708 B18R2.4060 Brc1cc(ccc1COCc2ccncc2)I 7a_100010240206_100015193705 [0,2,0,0,0,0|1,0,0]=3 16709 B18R2.4060 Brc1cc(ccc1COCc2cnccn2)I 7a_100010240206_100016995436 [0,2,0,0,0,0|2,0,0]=4 16710 B18R2.4060 Brc1cc(ccc1COCc2cncnc2)I 7a_100010240206_100015196519 [0,2,0,0,0,0|2,0,0]=4 16711 B18R2.4060 Brc1cc(ccc1COCc2ncccn2)I 7a_100010240206_100000703007 [0,2,0,0,0,0|2,0,0]=4 16712 B18R2.4060 Brc1cc(ccc1CSCc2ccccc2)I 62a_100000211182_100010146610 [0,2,0,0,0,0|0,1,0]=3 16713 B18R2.4060 Brc1cc(ccc1CSCc2ccccc2)I 62a_100010146610_100015291786 [0,2,0,0,0,0|0,1,0]=3 16714 B18R2.4060 Brc1cc(ccc1CSCc2ccccn2)I 62a_100000721315_100010146610 [0,2,0,0,0,0|1,1,0]=4 16715 B18R2.4060 Brc1cc(ccc1CSCc2ccccn2)I 62a_100010146610_100000721315 [0,2,0,0,0,0|1,1,0]=4 16716 B18R2.4060 Brc1cc(ccc1CSCc2cccnc2)I 62a_100000741622_100010146610 [0,2,0,0,0,0|1,1,0]=4 16717 B18R2.4060 Brc1cc(ccc1CSCc2cccnc2)I 62a_100010146610_100000741622 [0,2,0,0,0,0|1,1,0]=4 16718 B18R2.4060 Brc1cc(ccc1CSCc2ccncc2)I 62a_100010146610_100015193705 [0,2,0,0,0,0|1,1,0]=4 16719 B18R2.4060 Brc1cc(ccc1CSCc2ccncc2)I 62a_100015193705_100010146610 [0,2,0,0,0,0|1,1,0]=4 16720 B18R2.4060 Brc1cc(ccc1OCCc2ccccc2)I 34a_100012361655_100000765856 [0,2,0,0,0,0|2,0,0]=4 16721 B18R2.4060 Brc1cc(ccc1OCCc2ccccc2)I 7a_100012361655_100000765856 [0,2,0,0,0,0|2,0,0]=4 16722 B18R2.4060 Brc1ccc(c(c1)Br)C=CCc2ccccc2 271570a_200016263579_100011484698 [0,2,0,0,0,0|1,0,1]=4 16723 B18R2.4060 Brc1ccc(c(c1)Br)CNCc2ccccc2 207a_100015324214_100012351556 [0,2,0,0,0,0|1,0,0]=3 16724 B18R2.4060 Brc1ccc(c(c1)Br)CNCc2ccccc2 2230a_100015324214_200012351560 [0,2,0,0,0,0|1,0,0]=3 16725 B18R2.4060 Brc1ccc(c(c1)Br)CNCc2ccccc2 270004a_100015324214_100012351556 [0,2,0,0,0,0|1,0,0]=3 16726 B18R2.4060 Brc1ccc(c(c1)Br)CNCc2ccccc2 34a_100015324214_200012351560 [0,2,0,0,0,0|1,0,0]=3 16727 B18R2.4060 Brc1ccc(c(c1)Br)CNCc2ccccn2 270004a_100000210449_100012351556 [0,2,0,0,0,0|2,0,0]=4 16728 B18R2.4060 Brc1ccc(c(c1)Br)CNCc2cccnc2 207a_100000210453_100012351556 [0,2,0,0,0,0|2,0,0]=4 16729 B18R2.4060 Brc1ccc(c(c1)Br)CNCc2cccnc2 270004a_100000210453_100012351556 [0,2,0,0,0,0|2,0,0]=4 16730 B18R2.4060 Brc1ccc(c(c1)Br)COCc2ccccc2 34a_100000210790_200012351560 [0,2,0,0,0,0|0,0,0]=2 16731 B18R2.4060 Brc1ccc(c(c1)Br)COCc2ccccc2 34a_100012357508_100015291786 [0,2,0,0,0,0|0,0,0]=2 16732 B18R2.4060 Brc1ccc(c(c1)Br)COCc2ccccc2 7a_100000210790_200012351560 [0,2,0,0,0,0|0,0,0]=2 16733 B18R2.4060 Brc1ccc(c(c1)Br)COCc2ccccc2 7a_100012357508_100000211182 [0,2,0,0,0,0|0,0,0]=2 16734 B18R2.4060 Brc1ccc(c(c1)Br)COCc2ccccn2 34a_100012357508_100000721315 [0,2,0,0,0,0|1,0,0]=3 16735 B18R2.4060 Brc1ccc(c(c1)Br)COCc2ccccn2 7a_100012357508_100000721315 [0,2,0,0,0,0|1,0,0]=3 16736 B18R2.4060 Brc1ccc(c(c1)Br)COCc2cccnc2 34a_100012357508_100000733263 [0,2,0,0,0,0|1,0,0]=3 16737 B18R2.4060 Brc1ccc(c(c1)Br)COCc2cccnc2 7a_100012357508_100000741622 [0,2,0,0,0,0|1,0,0]=3 16738 B18R2.4060 Brc1ccc(c(c1)Br)COCc2cccnn2 34a_100012357508_100016990269 [0,2,0,0,0,0|2,0,0]=4 16739 B18R2.4060 Brc1ccc(c(c1)Br)COCc2cccnn2 7a_100012357508_100016990269 [0,2,0,0,0,0|2,0,0]=4 16740 B18R2.4060 Brc1ccc(c(c1)Br)COCc2ccncc2 7a_100012357508_100015193705 [0,2,0,0,0,0|1,0,0]=3 16741 B18R2.4060 Brc1ccc(c(c1)Br)COCc2cnccn2 34a_100012357508_100016995436 [0,2,0,0,0,0|2,0,0]=4 16742 B18R2.4060 Brc1ccc(c(c1)Br)COCc2cnccn2 7a_100012357508_100016995436 [0,2,0,0,0,0|2,0,0]=4 16743 B18R2.4060 Brc1ccc(c(c1)Br)COCc2cncnc2 34a_100012357508_100015196519 [0,2,0,0,0,0|2,0,0]=4 16744 B18R2.4060 Brc1ccc(c(c1)Br)COCc2cncnc2 7a_100012357508_100015196519 [0,2,0,0,0,0|2,0,0]=4 16745 B18R2.4060 Brc1ccc(c(c1)Br)COCc2ncccn2 34a_100012357508_100000703007 [0,2,0,0,0,0|2,0,0]=4 16746 B18R2.4060 Brc1ccc(c(c1)Br)COCc2ncccn2 7a_100012357508_100000703007 [0,2,0,0,0,0|2,0,0]=4 16747 B18R2.4060 Brc1ccc(c(c1)Br)CSCc2ccccc2 62a_100000211182_200012351560 [0,2,0,0,0,0|0,1,0]=3 16748 B18R2.4060 Brc1ccc(c(c1)Br)CSCc2ccccc2 62a_200012351560_100015291786 [0,2,0,0,0,0|0,1,0]=3 16749 B18R2.4060 Brc1ccc(c(c1)Br)CSCc2ccccn2 62a_100000721315_200012351560 [0,2,0,0,0,0|1,1,0]=4 16750 B18R2.4060 Brc1ccc(c(c1)Br)CSCc2ccccn2 62a_200012351560_100000721315 [0,2,0,0,0,0|1,1,0]=4 16751 B18R2.4060 Brc1ccc(c(c1)Br)CSCc2cccnc2 62a_100000741622_200012351560 [0,2,0,0,0,0|1,1,0]=4 16752 B18R2.4060 Brc1ccc(c(c1)Br)CSCc2cccnc2 62a_200012351560_100000741622 [0,2,0,0,0,0|1,1,0]=4 16753 B18R2.4060 Brc1ccc(c(c1)Br)CSCc2ccncc2 62a_100015193705_200012351560 [0,2,0,0,0,0|1,1,0]=4 16754 B18R2.4060 Brc1ccc(c(c1)Br)CSCc2ccncc2 62a_200012351560_100015193705 [0,2,0,0,0,0|1,1,0]=4 16755 B18R2.4060 Brc1ccc(c(c1)Br)NCCc2ccccc2 34a_100000211012_100000765856 [0,2,0,0,0,0|2,0,0]=4 16756 B18R2.4060 Brc1ccc(c(c1)Br)OCCc2ccccc2 34a_100000188717_100000765856 [0,2,0,0,0,0|2,0,0]=4 16757 B18R2.4060 Brc1ccc(c(c1)Br)OCCc2ccccc2 7a_100000188717_100000765856 [0,2,0,0,0,0|2,0,0]=4 16758 B18R2.4060 Brc1ccc(c(c1)Br)SCCc2ccccc2 62a_100000765856_100011484698 [0,2,0,0,0,0|2,0,0]=4 16759 B18R2.4060 Brc1ccc(c(c1)Br)SCCc2ccccc2 62a_100011484698_100011218657 [0,2,0,0,0,0|2,0,0]=4 16760 B18R2.4060 Brc1ccc(c(c1)I)CNCc2ccccc2 207a_100015324214_100010146562 [0,2,0,0,0,0|1,0,0]=3 16761 B18R2.4060 Brc1ccc(c(c1)I)CNCc2ccccc2 2230a_100015324214_100010146615 [0,2,0,0,0,0|1,0,0]=3 16762 B18R2.4060 Brc1ccc(c(c1)I)CNCc2ccccc2 270004a_100015324214_100010146562 [0,2,0,0,0,0|1,0,0]=3 16763 B18R2.4060 Brc1ccc(c(c1)I)CNCc2ccccc2 34a_100015324214_100010146615 [0,2,0,0,0,0|1,0,0]=3 16764 B18R2.4060 Brc1ccc(c(c1)I)CNCc2ccccn2 270004a_100000210449_100010146562 [0,2,0,0,0,0|2,0,0]=4 16765 B18R2.4060 Brc1ccc(c(c1)I)CNCc2cccnc2 207a_100000210453_100010146562 [0,2,0,0,0,0|2,0,0]=4 16766 B18R2.4060 Brc1ccc(c(c1)I)CNCc2cccnc2 270004a_100000210453_100010146562 [0,2,0,0,0,0|2,0,0]=4 16767 B18R2.4060 Brc1ccc(c(c1)I)COCc2ccccc2 34a_100000210790_100010146615 [0,2,0,0,0,0|0,0,0]=2 16768 B18R2.4060 Brc1ccc(c(c1)I)COCc2ccccc2 7a_100000210790_100010146615 [0,2,0,0,0,0|0,0,0]=2 16769 B18R2.4060 Brc1ccc(c(c1)I)COCc2ccccc2 7a_100010146605_100000211182 [0,2,0,0,0,0|0,0,0]=2 16770 B18R2.4060 Brc1ccc(c(c1)I)COCc2ccccn2 7a_100010146605_100000721315 [0,2,0,0,0,0|1,0,0]=3 16771 B18R2.4060 Brc1ccc(c(c1)I)COCc2cccnc2 7a_100010146605_100000741622 [0,2,0,0,0,0|1,0,0]=3 16772 B18R2.4060 Brc1ccc(c(c1)I)COCc2cccnn2 7a_100010146605_100016990269 [0,2,0,0,0,0|2,0,0]=4 16773 B18R2.4060 Brc1ccc(c(c1)I)COCc2ccncc2 7a_100010146605_100015193705 [0,2,0,0,0,0|1,0,0]=3 16774 B18R2.4060 Brc1ccc(c(c1)I)COCc2cnccn2 7a_100010146605_100016995436 [0,2,0,0,0,0|2,0,0]=4 16775 B18R2.4060 Brc1ccc(c(c1)I)COCc2cncnc2 7a_100010146605_100015196519 [0,2,0,0,0,0|2,0,0]=4 16776 B18R2.4060 Brc1ccc(c(c1)I)COCc2ncccn2 7a_100010146605_100000703007 [0,2,0,0,0,0|2,0,0]=4 16777 B18R2.4060 Brc1ccc(c(c1)I)CSCc2ccccc2 62a_100000211182_100010146615 [0,2,0,0,0,0|0,1,0]=3 16778 B18R2.4060 Brc1ccc(c(c1)I)CSCc2ccccc2 62a_100010146615_100015291786 [0,2,0,0,0,0|0,1,0]=3 16779 B18R2.4060 Brc1ccc(c(c1)I)CSCc2ccccn2 62a_100000721315_100010146615 [0,2,0,0,0,0|1,1,0]=4 16780 B18R2.4060 Brc1ccc(c(c1)I)CSCc2ccccn2 62a_100010146615_100000721315 [0,2,0,0,0,0|1,1,0]=4 16781 B18R2.4060 Brc1ccc(c(c1)I)CSCc2cccnc2 62a_100000741622_100010146615 [0,2,0,0,0,0|1,1,0]=4 16782 B18R2.4060 Brc1ccc(c(c1)I)CSCc2cccnc2 62a_100010146615_100000741622 [0,2,0,0,0,0|1,1,0]=4 16783 B18R2.4060 Brc1ccc(c(c1)I)CSCc2ccncc2 62a_100010146615_100015193705 [0,2,0,0,0,0|1,1,0]=4 16784 B18R2.4060 Brc1ccc(c(c1)I)CSCc2ccncc2 62a_100015193705_100010146615 [0,2,0,0,0,0|1,1,0]=4 16785 B18R2.4060 Brc1ccc(c(c1)I)NCCc2ccccc2 34a_100000187925_100000765856 [0,2,0,0,0,0|2,0,0]=4 16786 B18R2.4060 Brc1ccc(c(c1)I)OCCc2ccccc2 34a_100012355227_100000765856 [0,2,0,0,0,0|2,0,0]=4 16787 B18R2.4060 Brc1ccc(c(c1)I)OCCc2ccccc2 7a_100012355227_100000765856 [0,2,0,0,0,0|2,0,0]=4 16788 B18R2.4060 Brc1ccc(c(n1)Br)COCc2ccccc2 34a_200010005763_100015291786 [0,2,0,0,0,0|1,0,0]=3 16789 B18R2.4060 Brc1ccc(c(n1)Br)COCc2ccccc2 7a_200010005763_100000211182 [0,2,0,0,0,0|1,0,0]=3 16790 B18R2.4060 Brc1ccc(c(n1)Br)COCc2ccccn2 34a_200010005763_100000721315 [0,2,0,0,0,0|2,0,0]=4 16791 B18R2.4060 Brc1ccc(c(n1)Br)COCc2ccccn2 7a_200010005763_100000721315 [0,2,0,0,0,0|2,0,0]=4 16792 B18R2.4060 Brc1ccc(c(n1)Br)COCc2cccnc2 34a_200010005763_100000733263 [0,2,0,0,0,0|2,0,0]=4 16793 B18R2.4060 Brc1ccc(c(n1)Br)COCc2cccnc2 7a_200010005763_100000741622 [0,2,0,0,0,0|2,0,0]=4 16794 B18R2.4060 Brc1ccc(c(n1)Br)COCc2ccncc2 7a_200010005763_100015193705 [0,2,0,0,0,0|2,0,0]=4 16795 B18R2.4060 Brc1cnc(c(c1)Br)CNCc2ccccc2 207a_100015324214_100000688198 [0,2,0,0,0,0|2,0,0]=4 16796 B18R2.4060 Brc1cnc(c(c1)Br)CNCc2ccccc2 270004a_100015324214_100000688198 [0,2,0,0,0,0|2,0,0]=4 16797 B18R2.4060 Brc1cnc(c(c1)Br)COCc2ccccc2 34a_100012354961_100015291786 [0,2,0,0,0,0|1,0,0]=3 16798 B18R2.4060 Brc1cnc(c(c1)Br)COCc2ccccc2 7a_100012354961_100000211182 [0,2,0,0,0,0|1,0,0]=3 16799 B18R2.4060 Brc1cnc(c(c1)Br)COCc2ccccn2 34a_100012354961_100000721315 [0,2,0,0,0,0|2,0,0]=4 16800 B18R2.4060 Brc1cnc(c(c1)Br)COCc2ccccn2 7a_100012354961_100000721315 [0,2,0,0,0,0|2,0,0]=4 16801 B18R2.4060 Brc1cnc(c(c1)Br)COCc2cccnc2 34a_100012354961_100000733263 [0,2,0,0,0,0|2,0,0]=4 16802 B18R2.4060 Brc1cnc(c(c1)Br)COCc2cccnc2 7a_100012354961_100000741622 [0,2,0,0,0,0|2,0,0]=4 16803 B18R2.4060 Brc1cnc(c(c1)Br)COCc2ccncc2 7a_100012354961_100015193705 [0,2,0,0,0,0|2,0,0]=4 16804 B18R2.4060 Cc1cc(c(cn1)CNCc2ccccc2)C 207a_100015324214_200009869383 [0,2,0,0,0,0|2,0,0]=4 16805 B18R2.4060 Cc1cc(c(cn1)CNCc2ccccc2)C 270004a_100015324214_200009869383 [0,2,0,0,0,0|2,0,0]=4 16806 B18R2.4060 Cc1cc(c(cn1)COCc2ccccc2)N 34a_200012022818_100015291786 [0,2,0,0,0,0|1,0,0]=3 16807 B18R2.4060 Cc1cc(c(cn1)COCc2ccccn2)N 34a_200012022818_100000721315 [0,2,0,0,0,0|2,0,0]=4 16808 B18R2.4060 Cc1cc(c(cn1)COCc2cccnc2)N 34a_200012022818_100000733263 [0,2,0,0,0,0|2,0,0]=4 16809 B18R2.4060 Cc1cc(ccc1C=CCc2ccccc2)Br 271570a_200016263579_100000701812 [0,2,0,0,0,0|1,0,1]=4 16810 B18R2.4060 Cc1cc(ccc1C=CCc2ccccc2)Cl 271570a_200016263579_100011219607 [0,2,0,0,0,0|1,0,1]=4 16811 B18R2.4060 Cc1cc(ccc1C=CCc2ccccc2)F 271570a_200016263579_100011205405 [0,2,0,0,0,0|1,0,1]=4 16812 B18R2.4060 Cc1cc(ccc1C=CCc2ccccc2)N 271570a_200016263579_100000210723 [0,2,0,0,0,0|1,0,1]=4 16813 B18R2.4060 Cc1cc(ccc1C=CCc2ccccc2)O 271570a_200016263579_100000729255 [0,2,0,0,0,0|1,0,1]=4 16814 B18R2.4060 Cc1cc(ccc1CNCc2ccccc2)Br 207a_100000753881_100015611070 [0,2,0,0,0,0|1,0,0]=3 16815 B18R2.4060 Cc1cc(ccc1CNCc2ccccc2)Br 207a_100015324214_100000687586 [0,2,0,0,0,0|1,0,0]=3 16816 B18R2.4060 Cc1cc(ccc1CNCc2ccccc2)Br 2230a_100015324214_100000708836 [0,2,0,0,0,0|1,0,0]=3 16817 B18R2.4060 Cc1cc(ccc1CNCc2ccccc2)Br 270004a_100000753881_100015611070 [0,2,0,0,0,0|1,0,0]=3 16818 B18R2.4060 Cc1cc(ccc1CNCc2ccccc2)Br 270004a_100015324214_100000687586 [0,2,0,0,0,0|1,0,0]=3 16819 B18R2.4060 Cc1cc(ccc1CNCc2ccccc2)Br 34a_100000753881_100015291786 [0,2,0,0,0,0|1,0,0]=3 16820 B18R2.4060 Cc1cc(ccc1CNCc2ccccc2)Br 34a_100015324214_100000708836 [0,2,0,0,0,0|1,0,0]=3 16821 B18R2.4060 Cc1cc(ccc1CNCc2ccccc2)Cl 207a_100015324214_100000766358 [0,2,0,0,0,0|1,0,0]=3 16822 B18R2.4060 Cc1cc(ccc1CNCc2ccccc2)Cl 207a_103436540063_100015611070 [0,2,0,0,0,0|1,0,0]=3 16823 B18R2.4060 Cc1cc(ccc1CNCc2ccccc2)Cl 2230a_100015324214_100012361307 [0,2,0,0,0,0|1,0,0]=3 16824 B18R2.4060 Cc1cc(ccc1CNCc2ccccc2)Cl 270004a_100015324214_100000766358 [0,2,0,0,0,0|1,0,0]=3 16825 B18R2.4060 Cc1cc(ccc1CNCc2ccccc2)Cl 270004a_103436540063_100015611070 [0,2,0,0,0,0|1,0,0]=3 16826 B18R2.4060 Cc1cc(ccc1CNCc2ccccc2)Cl 34a_100015324214_100012361307 [0,2,0,0,0,0|1,0,0]=3 16827 B18R2.4060 Cc1cc(ccc1CNCc2ccccc2)Cl 34a_103436540063_100015291786 [0,2,0,0,0,0|1,0,0]=3 16828 B18R2.4060 Cc1cc(ccc1CNCc2ccccc2)F 207a_100015324214_100000745986 [0,2,0,0,0,0|1,0,0]=3 16829 B18R2.4060 Cc1cc(ccc1CNCc2ccccc2)F 207a_100137329023_100015611070 [0,2,0,0,0,0|1,0,0]=3 16830 B18R2.4060 Cc1cc(ccc1CNCc2ccccc2)F 2230a_100015324214_100000700533 [0,2,0,0,0,0|1,0,0]=3 16831 B18R2.4060 Cc1cc(ccc1CNCc2ccccc2)F 270004a_100015324214_100000745986 [0,2,0,0,0,0|1,0,0]=3 16832 B18R2.4060 Cc1cc(ccc1CNCc2ccccc2)F 270004a_100137329023_100015611070 [0,2,0,0,0,0|1,0,0]=3 16833 B18R2.4060 Cc1cc(ccc1CNCc2ccccc2)F 34a_100015324214_100000700533 [0,2,0,0,0,0|1,0,0]=3 16834 B18R2.4060 Cc1cc(ccc1CNCc2ccccc2)F 34a_100137329023_100015291786 [0,2,0,0,0,0|1,0,0]=3 16835 B18R2.4060 Cc1cc(ccc1CNCc2ccccn2)Br 207a_100000753881_100000209966 [0,2,0,0,0,0|2,0,0]=4 16836 B18R2.4060 Cc1cc(ccc1CNCc2ccccn2)Br 270004a_100000210449_100000687586 [0,2,0,0,0,0|2,0,0]=4 16837 B18R2.4060 Cc1cc(ccc1CNCc2ccccn2)Br 270004a_100000753881_100000209966 [0,2,0,0,0,0|2,0,0]=4 16838 B18R2.4060 Cc1cc(ccc1CNCc2ccccn2)Br 34a_100000753881_100000721315 [0,2,0,0,0,0|2,0,0]=4 16839 B18R2.4060 Cc1cc(ccc1CNCc2ccccn2)Cl 207a_103436540063_100000209966 [0,2,0,0,0,0|2,0,0]=4 16840 B18R2.4060 Cc1cc(ccc1CNCc2ccccn2)Cl 270004a_100000210449_100000766358 [0,2,0,0,0,0|2,0,0]=4 16841 B18R2.4060 Cc1cc(ccc1CNCc2ccccn2)Cl 270004a_103436540063_100000209966 [0,2,0,0,0,0|2,0,0]=4 16842 B18R2.4060 Cc1cc(ccc1CNCc2ccccn2)Cl 34a_103436540063_100000721315 [0,2,0,0,0,0|2,0,0]=4 16843 B18R2.4060 Cc1cc(ccc1CNCc2ccccn2)F 207a_100137329023_100000209966 [0,2,0,0,0,0|2,0,0]=4 16844 B18R2.4060 Cc1cc(ccc1CNCc2ccccn2)F 270004a_100000210449_100000745986 [0,2,0,0,0,0|2,0,0]=4 16845 B18R2.4060 Cc1cc(ccc1CNCc2ccccn2)F 270004a_100137329023_100000209966 [0,2,0,0,0,0|2,0,0]=4 16846 B18R2.4060 Cc1cc(ccc1CNCc2ccccn2)F 34a_100137329023_100000721315 [0,2,0,0,0,0|2,0,0]=4 16847 B18R2.4060 Cc1cc(ccc1CNCc2cccnc2)Br 207a_100000210453_100000687586 [0,2,0,0,0,0|2,0,0]=4 16848 B18R2.4060 Cc1cc(ccc1CNCc2cccnc2)Br 207a_100000753881_100000209961 [0,2,0,0,0,0|2,0,0]=4 16849 B18R2.4060 Cc1cc(ccc1CNCc2cccnc2)Br 270004a_100000210453_100000687586 [0,2,0,0,0,0|2,0,0]=4 16850 B18R2.4060 Cc1cc(ccc1CNCc2cccnc2)Br 270004a_100000753881_100000209961 [0,2,0,0,0,0|2,0,0]=4 16851 B18R2.4060 Cc1cc(ccc1CNCc2cccnc2)Br 34a_100000753881_100000733263 [0,2,0,0,0,0|2,0,0]=4 16852 B18R2.4060 Cc1cc(ccc1CNCc2cccnc2)Cl 207a_100000210453_100000766358 [0,2,0,0,0,0|2,0,0]=4 16853 B18R2.4060 Cc1cc(ccc1CNCc2cccnc2)Cl 207a_103436540063_100000209961 [0,2,0,0,0,0|2,0,0]=4 16854 B18R2.4060 Cc1cc(ccc1CNCc2cccnc2)Cl 270004a_100000210453_100000766358 [0,2,0,0,0,0|2,0,0]=4 16855 B18R2.4060 Cc1cc(ccc1CNCc2cccnc2)Cl 270004a_103436540063_100000209961 [0,2,0,0,0,0|2,0,0]=4 16856 B18R2.4060 Cc1cc(ccc1CNCc2cccnc2)Cl 34a_103436540063_100000733263 [0,2,0,0,0,0|2,0,0]=4 16857 B18R2.4060 Cc1cc(ccc1CNCc2cccnc2)F 207a_100000210453_100000745986 [0,2,0,0,0,0|2,0,0]=4 16858 B18R2.4060 Cc1cc(ccc1CNCc2cccnc2)F 207a_100137329023_100000209961 [0,2,0,0,0,0|2,0,0]=4 16859 B18R2.4060 Cc1cc(ccc1CNCc2cccnc2)F 270004a_100000210453_100000745986 [0,2,0,0,0,0|2,0,0]=4 16860 B18R2.4060 Cc1cc(ccc1CNCc2cccnc2)F 270004a_100137329023_100000209961 [0,2,0,0,0,0|2,0,0]=4 16861 B18R2.4060 Cc1cc(ccc1CNCc2cccnc2)F 34a_100137329023_100000733263 [0,2,0,0,0,0|2,0,0]=4 16862 B18R2.4060 Cc1cc(ccc1CNCc2ccncc2)Br 207a_100000753881_100000186114 [0,2,0,0,0,0|2,0,0]=4 16863 B18R2.4060 Cc1cc(ccc1CNCc2ccncc2)Cl 207a_103436540063_100000186114 [0,2,0,0,0,0|2,0,0]=4 16864 B18R2.4060 Cc1cc(ccc1CNCc2ccncc2)F 207a_100137329023_100000186114 [0,2,0,0,0,0|2,0,0]=4 16865 B18R2.4060 Cc1cc(ccc1COCc2ccccc2)Br 34a_100000210790_100000708836 [0,2,0,0,0,0|0,0,0]=2 16866 B18R2.4060 Cc1cc(ccc1COCc2ccccc2)Br 34a_100000748258_100015291786 [0,2,0,0,0,0|0,0,0]=2 16867 B18R2.4060 Cc1cc(ccc1COCc2ccccc2)Br 7a_100000210790_100000708836 [0,2,0,0,0,0|0,0,0]=2 16868 B18R2.4060 Cc1cc(ccc1COCc2ccccc2)Br 7a_100000748258_100000211182 [0,2,0,0,0,0|0,0,0]=2 16869 B18R2.4060 Cc1cc(ccc1COCc2ccccc2)Cl 34a_100000210790_100012361307 [0,2,0,0,0,0|0,0,0]=2 16870 B18R2.4060 Cc1cc(ccc1COCc2ccccc2)Cl 34a_100000702939_100015291786 [0,2,0,0,0,0|0,0,0]=2 16871 B18R2.4060 Cc1cc(ccc1COCc2ccccc2)Cl 7a_100000210790_100012361307 [0,2,0,0,0,0|0,0,0]=2 16872 B18R2.4060 Cc1cc(ccc1COCc2ccccc2)Cl 7a_100000702939_100000211182 [0,2,0,0,0,0|0,0,0]=2 16873 B18R2.4060 Cc1cc(ccc1COCc2ccccc2)F 34a_100000210790_100000700533 [0,2,0,0,0,0|0,0,0]=2 16874 B18R2.4060 Cc1cc(ccc1COCc2ccccc2)F 34a_100000700136_100015291786 [0,2,0,0,0,0|0,0,0]=2 16875 B18R2.4060 Cc1cc(ccc1COCc2ccccc2)F 7a_100000210790_100000700533 [0,2,0,0,0,0|0,0,0]=2 16876 B18R2.4060 Cc1cc(ccc1COCc2ccccc2)F 7a_100000700136_100000211182 [0,2,0,0,0,0|0,0,0]=2 16877 B18R2.4060 Cc1cc(ccc1COCc2ccccc2)N 34a_100000102464_100015291786 [0,2,0,0,0,0|0,0,0]=2 16878 B18R2.4060 Cc1cc(ccc1COCc2ccccc2)N 7a_100000102464_100000211182 [0,2,0,0,0,0|0,0,0]=2 16879 B18R2.4060 Cc1cc(ccc1COCc2ccccn2)Br 34a_100000748258_100000721315 [0,2,0,0,0,0|1,0,0]=3 16880 B18R2.4060 Cc1cc(ccc1COCc2ccccn2)Br 7a_100000748258_100000721315 [0,2,0,0,0,0|1,0,0]=3 16881 B18R2.4060 Cc1cc(ccc1COCc2ccccn2)Cl 34a_100000702939_100000721315 [0,2,0,0,0,0|1,0,0]=3 16882 B18R2.4060 Cc1cc(ccc1COCc2ccccn2)Cl 7a_100000702939_100000721315 [0,2,0,0,0,0|1,0,0]=3 16883 B18R2.4060 Cc1cc(ccc1COCc2ccccn2)F 34a_100000700136_100000721315 [0,2,0,0,0,0|1,0,0]=3 16884 B18R2.4060 Cc1cc(ccc1COCc2ccccn2)F 7a_100000700136_100000721315 [0,2,0,0,0,0|1,0,0]=3 16885 B18R2.4060 Cc1cc(ccc1COCc2ccccn2)N 34a_100000102464_100000721315 [0,2,0,0,0,0|1,0,0]=3 16886 B18R2.4060 Cc1cc(ccc1COCc2ccccn2)N 7a_100000102464_100000721315 [0,2,0,0,0,0|1,0,0]=3 16887 B18R2.4060 Cc1cc(ccc1COCc2cccnc2)Br 34a_100000748258_100000733263 [0,2,0,0,0,0|1,0,0]=3 16888 B18R2.4060 Cc1cc(ccc1COCc2cccnc2)Br 7a_100000748258_100000741622 [0,2,0,0,0,0|1,0,0]=3 16889 B18R2.4060 Cc1cc(ccc1COCc2cccnc2)Cl 34a_100000702939_100000733263 [0,2,0,0,0,0|1,0,0]=3 16890 B18R2.4060 Cc1cc(ccc1COCc2cccnc2)Cl 7a_100000702939_100000741622 [0,2,0,0,0,0|1,0,0]=3 16891 B18R2.4060 Cc1cc(ccc1COCc2cccnc2)F 34a_100000700136_100000733263 [0,2,0,0,0,0|1,0,0]=3 16892 B18R2.4060 Cc1cc(ccc1COCc2cccnc2)F 7a_100000700136_100000741622 [0,2,0,0,0,0|1,0,0]=3 16893 B18R2.4060 Cc1cc(ccc1COCc2cccnc2)N 34a_100000102464_100000733263 [0,2,0,0,0,0|1,0,0]=3 16894 B18R2.4060 Cc1cc(ccc1COCc2cccnc2)N 7a_100000102464_100000741622 [0,2,0,0,0,0|1,0,0]=3 16895 B18R2.4060 Cc1cc(ccc1COCc2cccnn2)Br 34a_100000748258_100016990269 [0,2,0,0,0,0|2,0,0]=4 16896 B18R2.4060 Cc1cc(ccc1COCc2cccnn2)Br 7a_100000748258_100016990269 [0,2,0,0,0,0|2,0,0]=4 16897 B18R2.4060 Cc1cc(ccc1COCc2cccnn2)Cl 34a_100000702939_100016990269 [0,2,0,0,0,0|2,0,0]=4 16898 B18R2.4060 Cc1cc(ccc1COCc2cccnn2)Cl 7a_100000702939_100016990269 [0,2,0,0,0,0|2,0,0]=4 16899 B18R2.4060 Cc1cc(ccc1COCc2cccnn2)F 34a_100000700136_100016990269 [0,2,0,0,0,0|2,0,0]=4 16900 B18R2.4060 Cc1cc(ccc1COCc2cccnn2)F 7a_100000700136_100016990269 [0,2,0,0,0,0|2,0,0]=4 16901 B18R2.4060 Cc1cc(ccc1COCc2cccnn2)N 34a_100000102464_100016990269 [0,2,0,0,0,0|2,0,0]=4 16902 B18R2.4060 Cc1cc(ccc1COCc2cccnn2)N 7a_100000102464_100016990269 [0,2,0,0,0,0|2,0,0]=4 16903 B18R2.4060 Cc1cc(ccc1COCc2ccncc2)Br 7a_100000748258_100015193705 [0,2,0,0,0,0|1,0,0]=3 16904 B18R2.4060 Cc1cc(ccc1COCc2ccncc2)Cl 7a_100000702939_100015193705 [0,2,0,0,0,0|1,0,0]=3 16905 B18R2.4060 Cc1cc(ccc1COCc2ccncc2)F 7a_100000700136_100015193705 [0,2,0,0,0,0|1,0,0]=3 16906 B18R2.4060 Cc1cc(ccc1COCc2ccncc2)N 7a_100000102464_100015193705 [0,2,0,0,0,0|1,0,0]=3 16907 B18R2.4060 Cc1cc(ccc1COCc2cnccn2)Br 34a_100000748258_100016995436 [0,2,0,0,0,0|2,0,0]=4 16908 B18R2.4060 Cc1cc(ccc1COCc2cnccn2)Br 7a_100000748258_100016995436 [0,2,0,0,0,0|2,0,0]=4 16909 B18R2.4060 Cc1cc(ccc1COCc2cnccn2)Cl 34a_100000702939_100016995436 [0,2,0,0,0,0|2,0,0]=4 16910 B18R2.4060 Cc1cc(ccc1COCc2cnccn2)Cl 7a_100000702939_100016995436 [0,2,0,0,0,0|2,0,0]=4 16911 B18R2.4060 Cc1cc(ccc1COCc2cnccn2)F 34a_100000700136_100016995436 [0,2,0,0,0,0|2,0,0]=4 16912 B18R2.4060 Cc1cc(ccc1COCc2cnccn2)F 7a_100000700136_100016995436 [0,2,0,0,0,0|2,0,0]=4 16913 B18R2.4060 Cc1cc(ccc1COCc2cnccn2)N 34a_100000102464_100016995436 [0,2,0,0,0,0|2,0,0]=4 16914 B18R2.4060 Cc1cc(ccc1COCc2cnccn2)N 7a_100000102464_100016995436 [0,2,0,0,0,0|2,0,0]=4 16915 B18R2.4060 Cc1cc(ccc1COCc2cncnc2)Br 34a_100000748258_100015196519 [0,2,0,0,0,0|2,0,0]=4 16916 B18R2.4060 Cc1cc(ccc1COCc2cncnc2)Br 7a_100000748258_100015196519 [0,2,0,0,0,0|2,0,0]=4 16917 B18R2.4060 Cc1cc(ccc1COCc2cncnc2)Cl 34a_100000702939_100015196519 [0,2,0,0,0,0|2,0,0]=4 16918 B18R2.4060 Cc1cc(ccc1COCc2cncnc2)Cl 7a_100000702939_100015196519 [0,2,0,0,0,0|2,0,0]=4 16919 B18R2.4060 Cc1cc(ccc1COCc2cncnc2)F 34a_100000700136_100015196519 [0,2,0,0,0,0|2,0,0]=4 16920 B18R2.4060 Cc1cc(ccc1COCc2cncnc2)F 7a_100000700136_100015196519 [0,2,0,0,0,0|2,0,0]=4 16921 B18R2.4060 Cc1cc(ccc1COCc2cncnc2)N 34a_100000102464_100015196519 [0,2,0,0,0,0|2,0,0]=4 16922 B18R2.4060 Cc1cc(ccc1COCc2cncnc2)N 7a_100000102464_100015196519 [0,2,0,0,0,0|2,0,0]=4 16923 B18R2.4060 Cc1cc(ccc1COCc2ncccn2)Br 34a_100000748258_100000703007 [0,2,0,0,0,0|2,0,0]=4 16924 B18R2.4060 Cc1cc(ccc1COCc2ncccn2)Br 7a_100000748258_100000703007 [0,2,0,0,0,0|2,0,0]=4 16925 B18R2.4060 Cc1cc(ccc1COCc2ncccn2)Cl 34a_100000702939_100000703007 [0,2,0,0,0,0|2,0,0]=4 16926 B18R2.4060 Cc1cc(ccc1COCc2ncccn2)Cl 7a_100000702939_100000703007 [0,2,0,0,0,0|2,0,0]=4 16927 B18R2.4060 Cc1cc(ccc1COCc2ncccn2)F 34a_100000700136_100000703007 [0,2,0,0,0,0|2,0,0]=4 16928 B18R2.4060 Cc1cc(ccc1COCc2ncccn2)F 7a_100000700136_100000703007 [0,2,0,0,0,0|2,0,0]=4 16929 B18R2.4060 Cc1cc(ccc1COCc2ncccn2)N 34a_100000102464_100000703007 [0,2,0,0,0,0|2,0,0]=4 16930 B18R2.4060 Cc1cc(ccc1COCc2ncccn2)N 7a_100000102464_100000703007 [0,2,0,0,0,0|2,0,0]=4 16931 B18R2.4060 Cc1cc(ccc1CSCc2ccccc2)Br 62a_100000211182_100000708836 [0,2,0,0,0,0|0,1,0]=3 16932 B18R2.4060 Cc1cc(ccc1CSCc2ccccc2)Br 62a_100000708836_100015291786 [0,2,0,0,0,0|0,1,0]=3 16933 B18R2.4060 Cc1cc(ccc1CSCc2ccccc2)Cl 62a_100000211182_100012361307 [0,2,0,0,0,0|0,1,0]=3 16934 B18R2.4060 Cc1cc(ccc1CSCc2ccccc2)Cl 62a_100012361307_100015291786 [0,2,0,0,0,0|0,1,0]=3 16935 B18R2.4060 Cc1cc(ccc1CSCc2ccccc2)F 62a_100000211182_100000700533 [0,2,0,0,0,0|0,1,0]=3 16936 B18R2.4060 Cc1cc(ccc1CSCc2ccccc2)F 62a_100000700533_100015291786 [0,2,0,0,0,0|0,1,0]=3 16937 B18R2.4060 Cc1cc(ccc1CSCc2ccccn2)Br 62a_100000708836_100000721315 [0,2,0,0,0,0|1,1,0]=4 16938 B18R2.4060 Cc1cc(ccc1CSCc2ccccn2)Br 62a_100000721315_100000708836 [0,2,0,0,0,0|1,1,0]=4 16939 B18R2.4060 Cc1cc(ccc1CSCc2ccccn2)Cl 62a_100000721315_100012361307 [0,2,0,0,0,0|1,1,0]=4 16940 B18R2.4060 Cc1cc(ccc1CSCc2ccccn2)Cl 62a_100012361307_100000721315 [0,2,0,0,0,0|1,1,0]=4 16941 B18R2.4060 Cc1cc(ccc1CSCc2ccccn2)F 62a_100000700533_100000721315 [0,2,0,0,0,0|1,1,0]=4 16942 B18R2.4060 Cc1cc(ccc1CSCc2ccccn2)F 62a_100000721315_100000700533 [0,2,0,0,0,0|1,1,0]=4 16943 B18R2.4060 Cc1cc(ccc1CSCc2cccnc2)Br 62a_100000708836_100000741622 [0,2,0,0,0,0|1,1,0]=4 16944 B18R2.4060 Cc1cc(ccc1CSCc2cccnc2)Br 62a_100000741622_100000708836 [0,2,0,0,0,0|1,1,0]=4 16945 B18R2.4060 Cc1cc(ccc1CSCc2cccnc2)Cl 62a_100000741622_100012361307 [0,2,0,0,0,0|1,1,0]=4 16946 B18R2.4060 Cc1cc(ccc1CSCc2cccnc2)Cl 62a_100012361307_100000741622 [0,2,0,0,0,0|1,1,0]=4 16947 B18R2.4060 Cc1cc(ccc1CSCc2cccnc2)F 62a_100000700533_100000741622 [0,2,0,0,0,0|1,1,0]=4 16948 B18R2.4060 Cc1cc(ccc1CSCc2cccnc2)F 62a_100000741622_100000700533 [0,2,0,0,0,0|1,1,0]=4 16949 B18R2.4060 Cc1cc(ccc1CSCc2ccncc2)Br 62a_100000708836_100015193705 [0,2,0,0,0,0|1,1,0]=4 16950 B18R2.4060 Cc1cc(ccc1CSCc2ccncc2)Br 62a_100015193705_100000708836 [0,2,0,0,0,0|1,1,0]=4 16951 B18R2.4060 Cc1cc(ccc1CSCc2ccncc2)Cl 62a_100012361307_100015193705 [0,2,0,0,0,0|1,1,0]=4 16952 B18R2.4060 Cc1cc(ccc1CSCc2ccncc2)Cl 62a_100015193705_100012361307 [0,2,0,0,0,0|1,1,0]=4 16953 B18R2.4060 Cc1cc(ccc1CSCc2ccncc2)F 62a_100000700533_100015193705 [0,2,0,0,0,0|1,1,0]=4 16954 B18R2.4060 Cc1cc(ccc1CSCc2ccncc2)F 62a_100015193705_100000700533 [0,2,0,0,0,0|1,1,0]=4 16955 B18R2.4060 Cc1cc(ccc1NCCc2ccccc2)Br 34a_100000211769_100000765856 [0,2,0,0,0,0|2,0,0]=4 16956 B18R2.4060 Cc1cc(ccc1NCCc2ccccc2)Br 7a_100000211769_100000765856 [0,2,0,0,0,0|2,0,0]=4 16957 B18R2.4060 Cc1cc(ccc1NCCc2ccccc2)Cl 34a_100000210418_100000765856 [0,2,0,0,0,0|2,0,0]=4 16958 B18R2.4060 Cc1cc(ccc1NCCc2ccccc2)Cl 7a_100000210418_100000765856 [0,2,0,0,0,0|2,0,0]=4 16959 B18R2.4060 Cc1cc(ccc1NCCc2ccccc2)F 34a_100000211637_100000765856 [0,2,0,0,0,0|2,0,0]=4 16960 B18R2.4060 Cc1cc(ccc1NCCc2ccccc2)F 7a_100000211637_100000765856 [0,2,0,0,0,0|2,0,0]=4 16961 B18R2.4060 Cc1cc(ccc1NCCc2ccccc2)I 34a_100000184554_100000765856 [0,2,0,0,0,0|2,0,0]=4 16962 B18R2.4060 Cc1cc(ccc1NCCc2ccccc2)I 7a_100000184554_100000765856 [0,2,0,0,0,0|2,0,0]=4 16963 B18R2.4060 Cc1cc(ccc1NCCc2ccccc2)O 34a_100000756630_100000765856 [0,2,0,0,0,0|2,0,0]=4 16964 B18R2.4060 Cc1cc(ccc1OCCc2ccccc2)Br 34a_100000186361_100000765856 [0,2,0,0,0,0|2,0,0]=4 16965 B18R2.4060 Cc1cc(ccc1OCCc2ccccc2)Br 7a_100000186361_100000765856 [0,2,0,0,0,0|2,0,0]=4 16966 B18R2.4060 Cc1cc(ccc1OCCc2ccccc2)Cl 34a_100000211091_100000765856 [0,2,0,0,0,0|2,0,0]=4 16967 B18R2.4060 Cc1cc(ccc1OCCc2ccccc2)Cl 7a_100000211091_100000765856 [0,2,0,0,0,0|2,0,0]=4 16968 B18R2.4060 Cc1cc(ccc1OCCc2ccccc2)F 34a_100000764316_100000765856 [0,2,0,0,0,0|2,0,0]=4 16969 B18R2.4060 Cc1cc(ccc1OCCc2ccccc2)F 7a_100000764316_100000765856 [0,2,0,0,0,0|2,0,0]=4 16970 B18R2.4060 Cc1cc(ccc1OCCc2ccccc2)I 34a_100011218673_100000765856 [0,2,0,0,0,0|2,0,0]=4 16971 B18R2.4060 Cc1cc(ccc1OCCc2ccccc2)I 7a_100011218673_100000765856 [0,2,0,0,0,0|2,0,0]=4 16972 B18R2.4060 Cc1cc(ccc1OCCc2ccccc2)N 34a_100011218179_100000765856 [0,2,0,0,0,0|2,0,0]=4 16973 B18R2.4060 Cc1cc(ccc1OCCc2ccccc2)N 7a_100011218179_100000765856 [0,2,0,0,0,0|2,0,0]=4 16974 B18R2.4060 Cc1cc(ccc1SCCc2ccccc2)Br 62a_100000701812_100011218657 [0,2,0,0,0,0|2,0,0]=4 16975 B18R2.4060 Cc1cc(ccc1SCCc2ccccc2)Br 62a_100000765856_100000701812 [0,2,0,0,0,0|2,0,0]=4 16976 B18R2.4060 Cc1cc(ccc1SCCc2ccccc2)Cl 62a_100000765856_100011219607 [0,2,0,0,0,0|2,0,0]=4 16977 B18R2.4060 Cc1cc(ccc1SCCc2ccccc2)Cl 62a_100011219607_100011218657 [0,2,0,0,0,0|2,0,0]=4 16978 B18R2.4060 Cc1cc(ccc1SCCc2ccccc2)F 62a_100000765856_100011205405 [0,2,0,0,0,0|2,0,0]=4 16979 B18R2.4060 Cc1cc(ccc1SCCc2ccccc2)F 62a_100011205405_100011218657 [0,2,0,0,0,0|2,0,0]=4 16980 B18R2.4060 Cc1cc(ccc1SCCc2ccccc2)N 62a_100000210723_100011218657 [0,2,0,0,0,0|2,0,0]=4 16981 B18R2.4060 Cc1cc(ccc1SCCc2ccccc2)N 62a_100000765856_100000210723 [0,2,0,0,0,0|2,0,0]=4 16982 B18R2.4060 Cc1cc(ccc1SCCc2ccccc2)O 62a_100000765856_100000690111 [0,2,0,0,0,0|2,0,0]=4 16983 B18R2.4060 Cc1cc(cnc1CNCc2ccccc2)Br 207a_100015324214_100010185443 [0,2,0,0,0,0|2,0,0]=4 16984 B18R2.4060 Cc1cc(cnc1CNCc2ccccc2)Br 270004a_100015324214_100010185443 [0,2,0,0,0,0|2,0,0]=4 16985 B18R2.4060 Cc1cc(cnc1CNCc2ccccc2)Cl 207a_100015324214_200009887756 [0,2,0,0,0,0|2,0,0]=4 16986 B18R2.4060 Cc1cc(cnc1CNCc2ccccc2)Cl 270004a_100015324214_200009887756 [0,2,0,0,0,0|2,0,0]=4 16987 B18R2.4060 Cc1cc(cnc1COCc2ccccc2)Br 34a_100010116297_100015291786 [0,2,0,0,0,0|1,0,0]=3 16988 B18R2.4060 Cc1cc(cnc1COCc2ccccc2)Br 7a_100010116297_100000211182 [0,2,0,0,0,0|1,0,0]=3 16989 B18R2.4060 Cc1cc(cnc1COCc2ccccn2)Br 34a_100010116297_100000721315 [0,2,0,0,0,0|2,0,0]=4 16990 B18R2.4060 Cc1cc(cnc1COCc2ccccn2)Br 7a_100010116297_100000721315 [0,2,0,0,0,0|2,0,0]=4 16991 B18R2.4060 Cc1cc(cnc1COCc2cccnc2)Br 34a_100010116297_100000733263 [0,2,0,0,0,0|2,0,0]=4 16992 B18R2.4060 Cc1cc(cnc1COCc2cccnc2)Br 7a_100010116297_100000741622 [0,2,0,0,0,0|2,0,0]=4 16993 B18R2.4060 Cc1cc(cnc1COCc2ccncc2)Br 7a_100010116297_100015193705 [0,2,0,0,0,0|2,0,0]=4 16994 B18R2.4060 Cc1cc(ncc1CNCc2ccccc2)F 2230a_100015324214_100010382440 [0,2,0,0,0,0|2,0,0]=4 16995 B18R2.4060 Cc1cc(ncc1CNCc2ccccc2)F 34a_100015324214_100010382440 [0,2,0,0,0,0|2,0,0]=4 16996 B18R2.4060 Cc1cc(ncc1COCc2ccccc2)Cl 34a_100010277336_100015291786 [0,2,0,0,0,0|1,0,0]=3 16997 B18R2.4060 Cc1cc(ncc1COCc2ccccc2)Cl 7a_100010277336_100000211182 [0,2,0,0,0,0|1,0,0]=3 16998 B18R2.4060 Cc1cc(ncc1COCc2ccccc2)F 34a_100000210790_100010382440 [0,2,0,0,0,0|1,0,0]=3 16999 B18R2.4060 Cc1cc(ncc1COCc2ccccc2)F 7a_100000210790_100010382440 [0,2,0,0,0,0|1,0,0]=3 17000 B18R2.4060 Cc1cc(ncc1COCc2ccccn2)Cl 34a_100010277336_100000721315 [0,2,0,0,0,0|2,0,0]=4 17001 B18R2.4060 Cc1cc(ncc1COCc2ccccn2)Cl 7a_100010277336_100000721315 [0,2,0,0,0,0|2,0,0]=4 17002 B18R2.4060 Cc1cc(ncc1COCc2cccnc2)Cl 34a_100010277336_100000733263 [0,2,0,0,0,0|2,0,0]=4 17003 B18R2.4060 Cc1cc(ncc1COCc2cccnc2)Cl 7a_100010277336_100000741622 [0,2,0,0,0,0|2,0,0]=4 17004 B18R2.4060 Cc1cc(ncc1COCc2ccncc2)Cl 7a_100010277336_100015193705 [0,2,0,0,0,0|2,0,0]=4 17005 B18R2.4060 Cc1cc(ncc1CSCc2ccccc2)F 62a_100000211182_100010382440 [0,2,0,0,0,0|1,1,0]=4 17006 B18R2.4060 Cc1cc(ncc1CSCc2ccccc2)F 62a_100010382440_100015291786 [0,2,0,0,0,0|1,1,0]=4 17007 B18R2.4060 Cc1ccc(c(c1)Br)C=CCc2ccccc2 271570a_200016263579_100009813563 [0,2,0,0,0,0|1,0,1]=4 17008 B18R2.4060 Cc1ccc(c(c1)Br)CNCc2ccccc2 207a_100015324214_100000692596 [0,2,0,0,0,0|1,0,0]=3 17009 B18R2.4060 Cc1ccc(c(c1)Br)CNCc2ccccc2 270004a_100015324214_100000692596 [0,2,0,0,0,0|1,0,0]=3 17010 B18R2.4060 Cc1ccc(c(c1)Br)CNCc2ccccn2 270004a_100000210449_100000692596 [0,2,0,0,0,0|2,0,0]=4 17011 B18R2.4060 Cc1ccc(c(c1)Br)CNCc2cccnc2 207a_100000210453_100000692596 [0,2,0,0,0,0|2,0,0]=4 17012 B18R2.4060 Cc1ccc(c(c1)Br)CNCc2cccnc2 270004a_100000210453_100000692596 [0,2,0,0,0,0|2,0,0]=4 17013 B18R2.4060 Cc1ccc(c(c1)Br)NCCc2ccccc2 34a_100000210942_100000765856 [0,2,0,0,0,0|2,0,0]=4 17014 B18R2.4060 Cc1ccc(c(c1)Br)OCCc2ccccc2 34a_100000210800_100000765856 [0,2,0,0,0,0|2,0,0]=4 17015 B18R2.4060 Cc1ccc(c(c1)Br)OCCc2ccccc2 7a_100000210800_100000765856 [0,2,0,0,0,0|2,0,0]=4 17016 B18R2.4060 Cc1ccc(c(c1)Br)SCCc2ccccc2 62a_100000765856_100009813563 [0,2,0,0,0,0|2,0,0]=4 17017 B18R2.4060 Cc1ccc(c(c1)Br)SCCc2ccccc2 62a_100009813563_100011218657 [0,2,0,0,0,0|2,0,0]=4 17018 B18R2.4060 Cc1ccc(c(c1)C)C=CCc2ccccc2 271570a_200016263579_100011217332 [0,2,0,0,0,0|1,0,1]=4 17019 B18R2.4060 Cc1ccc(c(c1)C)CNCc2ccccc2 207a_100000737523_100015611070 [0,2,0,0,0,0|1,0,0]=3 17020 B18R2.4060 Cc1ccc(c(c1)C)CNCc2ccccc2 207a_100015324214_100000211342 [0,2,0,0,0,0|1,0,0]=3 17021 B18R2.4060 Cc1ccc(c(c1)C)CNCc2ccccc2 2230a_100015324214_100011219618 [0,2,0,0,0,0|1,0,0]=3 17022 B18R2.4060 Cc1ccc(c(c1)C)CNCc2ccccc2 270004a_100000737523_100015611070 [0,2,0,0,0,0|1,0,0]=3 17023 B18R2.4060 Cc1ccc(c(c1)C)CNCc2ccccc2 270004a_100015324214_100000211342 [0,2,0,0,0,0|1,0,0]=3 17024 B18R2.4060 Cc1ccc(c(c1)C)CNCc2ccccc2 34a_100000737523_100015291786 [0,2,0,0,0,0|1,0,0]=3 17025 B18R2.4060 Cc1ccc(c(c1)C)CNCc2ccccc2 34a_100015324214_100011219618 [0,2,0,0,0,0|1,0,0]=3 17026 B18R2.4060 Cc1ccc(c(c1)C)CNCc2ccccn2 207a_100000737523_100000209966 [0,2,0,0,0,0|2,0,0]=4 17027 B18R2.4060 Cc1ccc(c(c1)C)CNCc2ccccn2 270004a_100000210449_100000211342 [0,2,0,0,0,0|2,0,0]=4 17028 B18R2.4060 Cc1ccc(c(c1)C)CNCc2ccccn2 270004a_100000737523_100000209966 [0,2,0,0,0,0|2,0,0]=4 17029 B18R2.4060 Cc1ccc(c(c1)C)CNCc2ccccn2 34a_100000737523_100000721315 [0,2,0,0,0,0|2,0,0]=4 17030 B18R2.4060 Cc1ccc(c(c1)C)CNCc2cccnc2 207a_100000210453_100000211342 [0,2,0,0,0,0|2,0,0]=4 17031 B18R2.4060 Cc1ccc(c(c1)C)CNCc2cccnc2 207a_100000737523_100000209961 [0,2,0,0,0,0|2,0,0]=4 17032 B18R2.4060 Cc1ccc(c(c1)C)CNCc2cccnc2 270004a_100000210453_100000211342 [0,2,0,0,0,0|2,0,0]=4 17033 B18R2.4060 Cc1ccc(c(c1)C)CNCc2cccnc2 270004a_100000737523_100000209961 [0,2,0,0,0,0|2,0,0]=4 17034 B18R2.4060 Cc1ccc(c(c1)C)CNCc2cccnc2 34a_100000737523_100000733263 [0,2,0,0,0,0|2,0,0]=4 17035 B18R2.4060 Cc1ccc(c(c1)C)CNCc2ccncc2 207a_100000737523_100000186114 [0,2,0,0,0,0|2,0,0]=4 17036 B18R2.4060 Cc1ccc(c(c1)C)COCc2ccccc2 34a_100000210790_100011219618 [0,2,0,0,0,0|0,0,0]=2 17037 B18R2.4060 Cc1ccc(c(c1)C)COCc2ccccc2 34a_100011215341_100015291786 [0,2,0,0,0,0|0,0,0]=2 17038 B18R2.4060 Cc1ccc(c(c1)C)COCc2ccccc2 7a_100000210790_100011219618 [0,2,0,0,0,0|0,0,0]=2 17039 B18R2.4060 Cc1ccc(c(c1)C)COCc2ccccc2 7a_100011215341_100000211182 [0,2,0,0,0,0|0,0,0]=2 17040 B18R2.4060 Cc1ccc(c(c1)C)COCc2ccccn2 34a_100011215341_100000721315 [0,2,0,0,0,0|1,0,0]=3 17041 B18R2.4060 Cc1ccc(c(c1)C)COCc2ccccn2 7a_100011215341_100000721315 [0,2,0,0,0,0|1,0,0]=3 17042 B18R2.4060 Cc1ccc(c(c1)C)COCc2cccnc2 34a_100011215341_100000733263 [0,2,0,0,0,0|1,0,0]=3 17043 B18R2.4060 Cc1ccc(c(c1)C)COCc2cccnc2 7a_100011215341_100000741622 [0,2,0,0,0,0|1,0,0]=3 17044 B18R2.4060 Cc1ccc(c(c1)C)COCc2cccnn2 34a_100011215341_100016990269 [0,2,0,0,0,0|2,0,0]=4 17045 B18R2.4060 Cc1ccc(c(c1)C)COCc2cccnn2 7a_100011215341_100016990269 [0,2,0,0,0,0|2,0,0]=4 17046 B18R2.4060 Cc1ccc(c(c1)C)COCc2ccncc2 7a_100011215341_100015193705 [0,2,0,0,0,0|1,0,0]=3 17047 B18R2.4060 Cc1ccc(c(c1)C)COCc2cnccn2 34a_100011215341_100016995436 [0,2,0,0,0,0|2,0,0]=4 17048 B18R2.4060 Cc1ccc(c(c1)C)COCc2cnccn2 7a_100011215341_100016995436 [0,2,0,0,0,0|2,0,0]=4 17049 B18R2.4060 Cc1ccc(c(c1)C)COCc2cncnc2 34a_100011215341_100015196519 [0,2,0,0,0,0|2,0,0]=4 17050 B18R2.4060 Cc1ccc(c(c1)C)COCc2cncnc2 7a_100011215341_100015196519 [0,2,0,0,0,0|2,0,0]=4 17051 B18R2.4060 Cc1ccc(c(c1)C)COCc2ncccn2 34a_100011215341_100000703007 [0,2,0,0,0,0|2,0,0]=4 17052 B18R2.4060 Cc1ccc(c(c1)C)COCc2ncccn2 7a_100011215341_100000703007 [0,2,0,0,0,0|2,0,0]=4 17053 B18R2.4060 Cc1ccc(c(c1)C)CSCc2ccccc2 62a_100000211182_100011219618 [0,2,0,0,0,0|0,1,0]=3 17054 B18R2.4060 Cc1ccc(c(c1)C)CSCc2ccccc2 62a_100011219618_100015291786 [0,2,0,0,0,0|0,1,0]=3 17055 B18R2.4060 Cc1ccc(c(c1)C)CSCc2ccccn2 62a_100000721315_100011219618 [0,2,0,0,0,0|1,1,0]=4 17056 B18R2.4060 Cc1ccc(c(c1)C)CSCc2ccccn2 62a_100011219618_100000721315 [0,2,0,0,0,0|1,1,0]=4 17057 B18R2.4060 Cc1ccc(c(c1)C)CSCc2cccnc2 62a_100000741622_100011219618 [0,2,0,0,0,0|1,1,0]=4 17058 B18R2.4060 Cc1ccc(c(c1)C)CSCc2cccnc2 62a_100011219618_100000741622 [0,2,0,0,0,0|1,1,0]=4 17059 B18R2.4060 Cc1ccc(c(c1)C)CSCc2ccncc2 62a_100011219618_100015193705 [0,2,0,0,0,0|1,1,0]=4 17060 B18R2.4060 Cc1ccc(c(c1)C)CSCc2ccncc2 62a_100015193705_100011219618 [0,2,0,0,0,0|1,1,0]=4 17061 B18R2.4060 Cc1ccc(c(c1)C)NCCc2ccccc2 34a_100000736561_100000765856 [0,2,0,0,0,0|2,0,0]=4 17062 B18R2.4060 Cc1ccc(c(c1)C)NCCc2ccccc2 7a_100000736561_100000765856 [0,2,0,0,0,0|2,0,0]=4 17063 B18R2.4060 Cc1ccc(c(c1)C)OCCc2ccccc2 34a_100000211776_100000765856 [0,2,0,0,0,0|2,0,0]=4 17064 B18R2.4060 Cc1ccc(c(c1)C)OCCc2ccccc2 7a_100000211776_100000765856 [0,2,0,0,0,0|2,0,0]=4 17065 B18R2.4060 Cc1ccc(c(c1)C)SCCc2ccccc2 62a_100000765856_100011217332 [0,2,0,0,0,0|2,0,0]=4 17066 B18R2.4060 Cc1ccc(c(c1)C)SCCc2ccccc2 62a_100011217332_100011218657 [0,2,0,0,0,0|2,0,0]=4 17067 B18R2.4060 Cc1ccc(c(c1)Cl)C=CCc2ccccc2 271570a_200016263579_100011263221 [0,2,0,0,0,0|1,0,1]=4 17068 B18R2.4060 Cc1ccc(c(c1)Cl)CNCc2ccccc2 207a_100011997539_100015611070 [0,2,0,0,0,0|1,0,0]=3 17069 B18R2.4060 Cc1ccc(c(c1)Cl)CNCc2ccccc2 207a_100015324214_100011935181 [0,2,0,0,0,0|1,0,0]=3 17070 B18R2.4060 Cc1ccc(c(c1)Cl)CNCc2ccccc2 2230a_100015324214_100012349684 [0,2,0,0,0,0|1,0,0]=3 17071 B18R2.4060 Cc1ccc(c(c1)Cl)CNCc2ccccc2 270004a_100011997539_100015611070 [0,2,0,0,0,0|1,0,0]=3 17072 B18R2.4060 Cc1ccc(c(c1)Cl)CNCc2ccccc2 270004a_100015324214_100011935181 [0,2,0,0,0,0|1,0,0]=3 17073 B18R2.4060 Cc1ccc(c(c1)Cl)CNCc2ccccc2 34a_100011997539_100015291786 [0,2,0,0,0,0|1,0,0]=3 17074 B18R2.4060 Cc1ccc(c(c1)Cl)CNCc2ccccc2 34a_100015324214_100012349684 [0,2,0,0,0,0|1,0,0]=3 17075 B18R2.4060 Cc1ccc(c(c1)Cl)CNCc2ccccn2 207a_100011997539_100000209966 [0,2,0,0,0,0|2,0,0]=4 17076 B18R2.4060 Cc1ccc(c(c1)Cl)CNCc2ccccn2 270004a_100000210449_100011935181 [0,2,0,0,0,0|2,0,0]=4 17077 B18R2.4060 Cc1ccc(c(c1)Cl)CNCc2ccccn2 270004a_100011997539_100000209966 [0,2,0,0,0,0|2,0,0]=4 17078 B18R2.4060 Cc1ccc(c(c1)Cl)CNCc2ccccn2 34a_100011997539_100000721315 [0,2,0,0,0,0|2,0,0]=4 17079 B18R2.4060 Cc1ccc(c(c1)Cl)CNCc2cccnc2 207a_100000210453_100011935181 [0,2,0,0,0,0|2,0,0]=4 17080 B18R2.4060 Cc1ccc(c(c1)Cl)CNCc2cccnc2 207a_100011997539_100000209961 [0,2,0,0,0,0|2,0,0]=4 17081 B18R2.4060 Cc1ccc(c(c1)Cl)CNCc2cccnc2 270004a_100000210453_100011935181 [0,2,0,0,0,0|2,0,0]=4 17082 B18R2.4060 Cc1ccc(c(c1)Cl)CNCc2cccnc2 270004a_100011997539_100000209961 [0,2,0,0,0,0|2,0,0]=4 17083 B18R2.4060 Cc1ccc(c(c1)Cl)CNCc2cccnc2 34a_100011997539_100000733263 [0,2,0,0,0,0|2,0,0]=4 17084 B18R2.4060 Cc1ccc(c(c1)Cl)CNCc2ccncc2 207a_100011997539_100000186114 [0,2,0,0,0,0|2,0,0]=4 17085 B18R2.4060 Cc1ccc(c(c1)Cl)COCc2ccccc2 34a_100000210790_100012349684 [0,2,0,0,0,0|0,0,0]=2 17086 B18R2.4060 Cc1ccc(c(c1)Cl)COCc2ccccc2 34a_100000720314_100015291786 [0,2,0,0,0,0|0,0,0]=2 17087 B18R2.4060 Cc1ccc(c(c1)Cl)COCc2ccccc2 7a_100000210790_100012349684 [0,2,0,0,0,0|0,0,0]=2 17088 B18R2.4060 Cc1ccc(c(c1)Cl)COCc2ccccc2 7a_100000720314_100000211182 [0,2,0,0,0,0|0,0,0]=2 17089 B18R2.4060 Cc1ccc(c(c1)Cl)COCc2ccccn2 34a_100000720314_100000721315 [0,2,0,0,0,0|1,0,0]=3 17090 B18R2.4060 Cc1ccc(c(c1)Cl)COCc2ccccn2 7a_100000720314_100000721315 [0,2,0,0,0,0|1,0,0]=3 17091 B18R2.4060 Cc1ccc(c(c1)Cl)COCc2cccnc2 34a_100000720314_100000733263 [0,2,0,0,0,0|1,0,0]=3 17092 B18R2.4060 Cc1ccc(c(c1)Cl)COCc2cccnc2 7a_100000720314_100000741622 [0,2,0,0,0,0|1,0,0]=3 17093 B18R2.4060 Cc1ccc(c(c1)Cl)COCc2cccnn2 34a_100000720314_100016990269 [0,2,0,0,0,0|2,0,0]=4 17094 B18R2.4060 Cc1ccc(c(c1)Cl)COCc2cccnn2 7a_100000720314_100016990269 [0,2,0,0,0,0|2,0,0]=4 17095 B18R2.4060 Cc1ccc(c(c1)Cl)COCc2ccncc2 7a_100000720314_100015193705 [0,2,0,0,0,0|1,0,0]=3 17096 B18R2.4060 Cc1ccc(c(c1)Cl)COCc2cnccn2 34a_100000720314_100016995436 [0,2,0,0,0,0|2,0,0]=4 17097 B18R2.4060 Cc1ccc(c(c1)Cl)COCc2cnccn2 7a_100000720314_100016995436 [0,2,0,0,0,0|2,0,0]=4 17098 B18R2.4060 Cc1ccc(c(c1)Cl)COCc2cncnc2 34a_100000720314_100015196519 [0,2,0,0,0,0|2,0,0]=4 17099 B18R2.4060 Cc1ccc(c(c1)Cl)COCc2cncnc2 7a_100000720314_100015196519 [0,2,0,0,0,0|2,0,0]=4 17100 B18R2.4060 Cc1ccc(c(c1)Cl)COCc2ncccn2 34a_100000720314_100000703007 [0,2,0,0,0,0|2,0,0]=4 17101 B18R2.4060 Cc1ccc(c(c1)Cl)COCc2ncccn2 7a_100000720314_100000703007 [0,2,0,0,0,0|2,0,0]=4 17102 B18R2.4060 Cc1ccc(c(c1)Cl)CSCc2ccccc2 62a_100000211182_100012349684 [0,2,0,0,0,0|0,1,0]=3 17103 B18R2.4060 Cc1ccc(c(c1)Cl)CSCc2ccccc2 62a_100012349684_100015291786 [0,2,0,0,0,0|0,1,0]=3 17104 B18R2.4060 Cc1ccc(c(c1)Cl)CSCc2ccccn2 62a_100000721315_100012349684 [0,2,0,0,0,0|1,1,0]=4 17105 B18R2.4060 Cc1ccc(c(c1)Cl)CSCc2ccccn2 62a_100012349684_100000721315 [0,2,0,0,0,0|1,1,0]=4 17106 B18R2.4060 Cc1ccc(c(c1)Cl)CSCc2cccnc2 62a_100000741622_100012349684 [0,2,0,0,0,0|1,1,0]=4 17107 B18R2.4060 Cc1ccc(c(c1)Cl)CSCc2cccnc2 62a_100012349684_100000741622 [0,2,0,0,0,0|1,1,0]=4 17108 B18R2.4060 Cc1ccc(c(c1)Cl)CSCc2ccncc2 62a_100012349684_100015193705 [0,2,0,0,0,0|1,1,0]=4 17109 B18R2.4060 Cc1ccc(c(c1)Cl)CSCc2ccncc2 62a_100015193705_100012349684 [0,2,0,0,0,0|1,1,0]=4 17110 B18R2.4060 Cc1ccc(c(c1)Cl)NCCc2ccccc2 34a_100000210522_100000765856 [0,2,0,0,0,0|2,0,0]=4 17111 B18R2.4060 Cc1ccc(c(c1)Cl)OCCc2ccccc2 34a_100000749699_100000765856 [0,2,0,0,0,0|2,0,0]=4 17112 B18R2.4060 Cc1ccc(c(c1)Cl)OCCc2ccccc2 7a_100000749699_100000765856 [0,2,0,0,0,0|2,0,0]=4 17113 B18R2.4060 Cc1ccc(c(c1)Cl)SCCc2ccccc2 62a_100000765856_100011263221 [0,2,0,0,0,0|2,0,0]=4 17114 B18R2.4060 Cc1ccc(c(c1)Cl)SCCc2ccccc2 62a_100011263221_100011218657 [0,2,0,0,0,0|2,0,0]=4 17115 B18R2.4060 Cc1ccc(c(c1)F)C=CCc2ccccc2 271570a_200016263579_100011216119 [0,2,0,0,0,0|1,0,1]=4 17116 B18R2.4060 Cc1ccc(c(c1)F)CNCc2ccccc2 207a_100015324214_100011217368 [0,2,0,0,0,0|1,0,0]=3 17117 B18R2.4060 Cc1ccc(c(c1)F)CNCc2ccccc2 207a_100102887089_100015611070 [0,2,0,0,0,0|1,0,0]=3 17118 B18R2.4060 Cc1ccc(c(c1)F)CNCc2ccccc2 2230a_100015324214_100011217900 [0,2,0,0,0,0|1,0,0]=3 17119 B18R2.4060 Cc1ccc(c(c1)F)CNCc2ccccc2 270004a_100015324214_100011217368 [0,2,0,0,0,0|1,0,0]=3 17120 B18R2.4060 Cc1ccc(c(c1)F)CNCc2ccccc2 270004a_100102887089_100015611070 [0,2,0,0,0,0|1,0,0]=3 17121 B18R2.4060 Cc1ccc(c(c1)F)CNCc2ccccc2 34a_100015324214_100012002367 [0,2,0,0,0,0|1,0,0]=3 17122 B18R2.4060 Cc1ccc(c(c1)F)CNCc2ccccc2 34a_100102887089_100015291786 [0,2,0,0,0,0|1,0,0]=3 17123 B18R2.4060 Cc1ccc(c(c1)F)CNCc2ccccn2 207a_100102887089_100000209966 [0,2,0,0,0,0|2,0,0]=4 17124 B18R2.4060 Cc1ccc(c(c1)F)CNCc2ccccn2 270004a_100000210449_100011217368 [0,2,0,0,0,0|2,0,0]=4 17125 B18R2.4060 Cc1ccc(c(c1)F)CNCc2ccccn2 270004a_100102887089_100000209966 [0,2,0,0,0,0|2,0,0]=4 17126 B18R2.4060 Cc1ccc(c(c1)F)CNCc2ccccn2 34a_100102887089_100000721315 [0,2,0,0,0,0|2,0,0]=4 17127 B18R2.4060 Cc1ccc(c(c1)F)CNCc2cccnc2 207a_100000210453_100011217368 [0,2,0,0,0,0|2,0,0]=4 17128 B18R2.4060 Cc1ccc(c(c1)F)CNCc2cccnc2 207a_100102887089_100000209961 [0,2,0,0,0,0|2,0,0]=4 17129 B18R2.4060 Cc1ccc(c(c1)F)CNCc2cccnc2 270004a_100000210453_100011217368 [0,2,0,0,0,0|2,0,0]=4 17130 B18R2.4060 Cc1ccc(c(c1)F)CNCc2cccnc2 270004a_100102887089_100000209961 [0,2,0,0,0,0|2,0,0]=4 17131 B18R2.4060 Cc1ccc(c(c1)F)CNCc2cccnc2 34a_100102887089_100000733263 [0,2,0,0,0,0|2,0,0]=4 17132 B18R2.4060 Cc1ccc(c(c1)F)CNCc2ccncc2 207a_100102887089_100000186114 [0,2,0,0,0,0|2,0,0]=4 17133 B18R2.4060 Cc1ccc(c(c1)F)COCc2ccccc2 34a_100000210790_100012002367 [0,2,0,0,0,0|0,0,0]=2 17134 B18R2.4060 Cc1ccc(c(c1)F)COCc2ccccc2 34a_100011216587_100015291786 [0,2,0,0,0,0|0,0,0]=2 17135 B18R2.4060 Cc1ccc(c(c1)F)COCc2ccccc2 7a_100000210790_100012002367 [0,2,0,0,0,0|0,0,0]=2 17136 B18R2.4060 Cc1ccc(c(c1)F)COCc2ccccc2 7a_100011216587_100000211182 [0,2,0,0,0,0|0,0,0]=2 17137 B18R2.4060 Cc1ccc(c(c1)F)COCc2ccccn2 34a_100011216587_100000721315 [0,2,0,0,0,0|1,0,0]=3 17138 B18R2.4060 Cc1ccc(c(c1)F)COCc2ccccn2 7a_100011216587_100000721315 [0,2,0,0,0,0|1,0,0]=3 17139 B18R2.4060 Cc1ccc(c(c1)F)COCc2cccnc2 34a_100011216587_100000733263 [0,2,0,0,0,0|1,0,0]=3 17140 B18R2.4060 Cc1ccc(c(c1)F)COCc2cccnc2 7a_100011216587_100000741622 [0,2,0,0,0,0|1,0,0]=3 17141 B18R2.4060 Cc1ccc(c(c1)F)COCc2cccnn2 34a_100011216587_100016990269 [0,2,0,0,0,0|2,0,0]=4 17142 B18R2.4060 Cc1ccc(c(c1)F)COCc2cccnn2 7a_100011216587_100016990269 [0,2,0,0,0,0|2,0,0]=4 17143 B18R2.4060 Cc1ccc(c(c1)F)COCc2ccncc2 7a_100011216587_100015193705 [0,2,0,0,0,0|1,0,0]=3 17144 B18R2.4060 Cc1ccc(c(c1)F)COCc2cnccn2 34a_100011216587_100016995436 [0,2,0,0,0,0|2,0,0]=4 17145 B18R2.4060 Cc1ccc(c(c1)F)COCc2cnccn2 7a_100011216587_100016995436 [0,2,0,0,0,0|2,0,0]=4 17146 B18R2.4060 Cc1ccc(c(c1)F)COCc2cncnc2 34a_100011216587_100015196519 [0,2,0,0,0,0|2,0,0]=4 17147 B18R2.4060 Cc1ccc(c(c1)F)COCc2cncnc2 7a_100011216587_100015196519 [0,2,0,0,0,0|2,0,0]=4 17148 B18R2.4060 Cc1ccc(c(c1)F)COCc2ncccn2 34a_100011216587_100000703007 [0,2,0,0,0,0|2,0,0]=4 17149 B18R2.4060 Cc1ccc(c(c1)F)COCc2ncccn2 7a_100011216587_100000703007 [0,2,0,0,0,0|2,0,0]=4 17150 B18R2.4060 Cc1ccc(c(c1)F)CSCc2ccccc2 62a_100000211182_100011217900 [0,2,0,0,0,0|0,1,0]=3 17151 B18R2.4060 Cc1ccc(c(c1)F)CSCc2ccccc2 62a_100011217900_100015291786 [0,2,0,0,0,0|0,1,0]=3 17152 B18R2.4060 Cc1ccc(c(c1)F)CSCc2ccccn2 62a_100000721315_100011217900 [0,2,0,0,0,0|1,1,0]=4 17153 B18R2.4060 Cc1ccc(c(c1)F)CSCc2ccccn2 62a_100011217900_100000721315 [0,2,0,0,0,0|1,1,0]=4 17154 B18R2.4060 Cc1ccc(c(c1)F)CSCc2cccnc2 62a_100000741622_100011217900 [0,2,0,0,0,0|1,1,0]=4 17155 B18R2.4060 Cc1ccc(c(c1)F)CSCc2cccnc2 62a_100011217900_100000741622 [0,2,0,0,0,0|1,1,0]=4 17156 B18R2.4060 Cc1ccc(c(c1)F)CSCc2ccncc2 62a_100011217900_100015193705 [0,2,0,0,0,0|1,1,0]=4 17157 B18R2.4060 Cc1ccc(c(c1)F)CSCc2ccncc2 62a_100015193705_100011217900 [0,2,0,0,0,0|1,1,0]=4 17158 B18R2.4060 Cc1ccc(c(c1)F)NCCc2ccccc2 34a_100000211023_100000765856 [0,2,0,0,0,0|2,0,0]=4 17159 B18R2.4060 Cc1ccc(c(c1)F)OCCc2ccccc2 34a_100011216688_100000765856 [0,2,0,0,0,0|2,0,0]=4 17160 B18R2.4060 Cc1ccc(c(c1)F)OCCc2ccccc2 7a_100011216688_100000765856 [0,2,0,0,0,0|2,0,0]=4 17161 B18R2.4060 Cc1ccc(c(c1)F)SCCc2ccccc2 62a_100000765856_100011216119 [0,2,0,0,0,0|2,0,0]=4 17162 B18R2.4060 Cc1ccc(c(c1)F)SCCc2ccccc2 62a_100011216119_100011218657 [0,2,0,0,0,0|2,0,0]=4 17163 B18R2.4060 Cc1ccc(c(c1)I)CNCc2ccccc2 207a_100015324214_100010150104 [0,2,0,0,0,0|1,0,0]=3 17164 B18R2.4060 Cc1ccc(c(c1)I)CNCc2ccccc2 270004a_100015324214_100010150104 [0,2,0,0,0,0|1,0,0]=3 17165 B18R2.4060 Cc1ccc(c(c1)I)CNCc2ccccn2 270004a_100000210449_100010150104 [0,2,0,0,0,0|2,0,0]=4 17166 B18R2.4060 Cc1ccc(c(c1)I)CNCc2cccnc2 207a_100000210453_100010150104 [0,2,0,0,0,0|2,0,0]=4 17167 B18R2.4060 Cc1ccc(c(c1)I)CNCc2cccnc2 270004a_100000210453_100010150104 [0,2,0,0,0,0|2,0,0]=4 17168 B18R2.4060 Cc1ccc(c(c1)I)NCCc2ccccc2 34a_100011356834_100000765856 [0,2,0,0,0,0|2,0,0]=4 17169 B18R2.4060 Cc1ccc(c(c1)I)OCCc2ccccc2 34a_100000765521_100000765856 [0,2,0,0,0,0|2,0,0]=4 17170 B18R2.4060 Cc1ccc(c(c1)I)OCCc2ccccc2 7a_100000765521_100000765856 [0,2,0,0,0,0|2,0,0]=4 17171 B18R2.4060 Cc1ccc(c(c1)N)C=CCc2ccccc2 271570a_200016263579_100011216686 [0,2,0,0,0,0|1,0,1]=4 17172 B18R2.4060 Cc1ccc(c(c1)N)COCc2ccccc2 34a_100000087799_100015291786 [0,2,0,0,0,0|0,0,0]=2 17173 B18R2.4060 Cc1ccc(c(c1)N)COCc2ccccc2 7a_100000087799_100000211182 [0,2,0,0,0,0|0,0,0]=2 17174 B18R2.4060 Cc1ccc(c(c1)N)COCc2ccccn2 34a_100000087799_100000721315 [0,2,0,0,0,0|1,0,0]=3 17175 B18R2.4060 Cc1ccc(c(c1)N)COCc2ccccn2 7a_100000087799_100000721315 [0,2,0,0,0,0|1,0,0]=3 17176 B18R2.4060 Cc1ccc(c(c1)N)COCc2cccnc2 34a_100000087799_100000733263 [0,2,0,0,0,0|1,0,0]=3 17177 B18R2.4060 Cc1ccc(c(c1)N)COCc2cccnc2 7a_100000087799_100000741622 [0,2,0,0,0,0|1,0,0]=3 17178 B18R2.4060 Cc1ccc(c(c1)N)COCc2cccnn2 34a_100000087799_100016990269 [0,2,0,0,0,0|2,0,0]=4 17179 B18R2.4060 Cc1ccc(c(c1)N)COCc2cccnn2 7a_100000087799_100016990269 [0,2,0,0,0,0|2,0,0]=4 17180 B18R2.4060 Cc1ccc(c(c1)N)COCc2ccncc2 7a_100000087799_100015193705 [0,2,0,0,0,0|1,0,0]=3 17181 B18R2.4060 Cc1ccc(c(c1)N)COCc2cnccn2 34a_100000087799_100016995436 [0,2,0,0,0,0|2,0,0]=4 17182 B18R2.4060 Cc1ccc(c(c1)N)COCc2cnccn2 7a_100000087799_100016995436 [0,2,0,0,0,0|2,0,0]=4 17183 B18R2.4060 Cc1ccc(c(c1)N)COCc2cncnc2 34a_100000087799_100015196519 [0,2,0,0,0,0|2,0,0]=4 17184 B18R2.4060 Cc1ccc(c(c1)N)COCc2cncnc2 7a_100000087799_100015196519 [0,2,0,0,0,0|2,0,0]=4 17185 B18R2.4060 Cc1ccc(c(c1)N)COCc2ncccn2 34a_100000087799_100000703007 [0,2,0,0,0,0|2,0,0]=4 17186 B18R2.4060 Cc1ccc(c(c1)N)COCc2ncccn2 7a_100000087799_100000703007 [0,2,0,0,0,0|2,0,0]=4 17187 B18R2.4060 Cc1ccc(c(c1)N)OCCc2ccccc2 34a_100011215204_100000765856 [0,2,0,0,0,0|2,0,0]=4 17188 B18R2.4060 Cc1ccc(c(c1)N)OCCc2ccccc2 7a_100011215204_100000765856 [0,2,0,0,0,0|2,0,0]=4 17189 B18R2.4060 Cc1ccc(c(c1)N)SCCc2ccccc2 62a_100000765856_100011216686 [0,2,0,0,0,0|2,0,0]=4 17190 B18R2.4060 Cc1ccc(c(c1)N)SCCc2ccccc2 62a_100011216686_100011218657 [0,2,0,0,0,0|2,0,0]=4 17191 B18R2.4060 Cc1ccc(c(c1)O)C=CCc2ccccc2 271570a_200016263579_100012002257 [0,2,0,0,0,0|1,0,1]=4 17192 B18R2.4060 Cc1ccc(c(c1)O)NCCc2ccccc2 34a_100000211527_100000765856 [0,2,0,0,0,0|2,0,0]=4 17193 B18R2.4060 Cc1ccc(c(c1)O)SCCc2ccccc2 62a_100000765856_100012002257 [0,2,0,0,0,0|2,0,0]=4 17194 B18R2.4060 Cc1ccc(c(c1)O)SCCc2ccccc2 62a_100012002257_100011218657 [0,2,0,0,0,0|2,0,0]=4 17195 B18R2.4060 Cc1ccc(c(n1)Br)CNCc2ccccc2 2230a_100015324214_200010064658 [0,2,0,0,0,0|2,0,0]=4 17196 B18R2.4060 Cc1ccc(c(n1)Br)CNCc2ccccc2 34a_100015324214_200010064658 [0,2,0,0,0,0|2,0,0]=4 17197 B18R2.4060 Cc1ccc(c(n1)Br)COCc2ccccc2 34a_100000210790_200010064658 [0,2,0,0,0,0|1,0,0]=3 17198 B18R2.4060 Cc1ccc(c(n1)Br)COCc2ccccc2 7a_100000210790_200010064658 [0,2,0,0,0,0|1,0,0]=3 17199 B18R2.4060 Cc1ccc(c(n1)Br)CSCc2ccccc2 62a_100000211182_200010064658 [0,2,0,0,0,0|1,1,0]=4 17200 B18R2.4060 Cc1ccc(c(n1)Br)CSCc2ccccc2 62a_200010064658_100015291786 [0,2,0,0,0,0|1,1,0]=4 17201 B18R2.4060 Cc1ccc(c(n1)C)CNCc2ccccc2 207a_100015324214_100011794427 [0,2,0,0,0,0|2,0,0]=4 17202 B18R2.4060 Cc1ccc(c(n1)C)CNCc2ccccc2 270004a_100015324214_100011794427 [0,2,0,0,0,0|2,0,0]=4 17203 B18R2.4060 Cc1ccc(c(n1)C)COCc2ccccc2 34a_100011756430_100015291786 [0,2,0,0,0,0|1,0,0]=3 17204 B18R2.4060 Cc1ccc(c(n1)C)COCc2ccccc2 7a_100011756430_100000211182 [0,2,0,0,0,0|1,0,0]=3 17205 B18R2.4060 Cc1ccc(c(n1)C)COCc2ccccn2 34a_100011756430_100000721315 [0,2,0,0,0,0|2,0,0]=4 17206 B18R2.4060 Cc1ccc(c(n1)C)COCc2ccccn2 7a_100011756430_100000721315 [0,2,0,0,0,0|2,0,0]=4 17207 B18R2.4060 Cc1ccc(c(n1)C)COCc2cccnc2 34a_100011756430_100000733263 [0,2,0,0,0,0|2,0,0]=4 17208 B18R2.4060 Cc1ccc(c(n1)C)COCc2cccnc2 7a_100011756430_100000741622 [0,2,0,0,0,0|2,0,0]=4 17209 B18R2.4060 Cc1ccc(c(n1)C)COCc2ccncc2 7a_100011756430_100015193705 [0,2,0,0,0,0|2,0,0]=4 17210 B18R2.4060 Cc1ccc(c(n1)Cl)COCc2ccccc2 34a_102495338573_100015291786 [0,2,0,0,0,0|1,0,0]=3 17211 B18R2.4060 Cc1ccc(c(n1)Cl)COCc2ccccc2 7a_102495338573_100000211182 [0,2,0,0,0,0|1,0,0]=3 17212 B18R2.4060 Cc1ccc(c(n1)Cl)COCc2ccccn2 34a_102495338573_100000721315 [0,2,0,0,0,0|2,0,0]=4 17213 B18R2.4060 Cc1ccc(c(n1)Cl)COCc2ccccn2 7a_102495338573_100000721315 [0,2,0,0,0,0|2,0,0]=4 17214 B18R2.4060 Cc1ccc(c(n1)Cl)COCc2cccnc2 34a_102495338573_100000733263 [0,2,0,0,0,0|2,0,0]=4 17215 B18R2.4060 Cc1ccc(c(n1)Cl)COCc2cccnc2 7a_102495338573_100000741622 [0,2,0,0,0,0|2,0,0]=4 17216 B18R2.4060 Cc1ccc(c(n1)Cl)COCc2ccncc2 7a_102495338573_100015193705 [0,2,0,0,0,0|2,0,0]=4 17217 B18R2.4060 Cc1cnc(c(c1)C)CNCc2ccccc2 2230a_100015324214_100016990036 [0,2,0,0,0,0|2,0,0]=4 17218 B18R2.4060 Cc1cnc(c(c1)C)CNCc2ccccc2 34a_100015324214_100016990036 [0,2,0,0,0,0|2,0,0]=4 17219 B18R2.4060 Cc1cnc(c(c1)C)COCc2ccccc2 34a_100000210790_100016990036 [0,2,0,0,0,0|1,0,0]=3 17220 B18R2.4060 Cc1cnc(c(c1)C)COCc2ccccc2 34a_100012000483_100015291786 [0,2,0,0,0,0|1,0,0]=3 17221 B18R2.4060 Cc1cnc(c(c1)C)COCc2ccccc2 7a_100000210790_100016990036 [0,2,0,0,0,0|1,0,0]=3 17222 B18R2.4060 Cc1cnc(c(c1)C)COCc2ccccc2 7a_100012000483_100000211182 [0,2,0,0,0,0|1,0,0]=3 17223 B18R2.4060 Cc1cnc(c(c1)C)COCc2ccccn2 34a_100012000483_100000721315 [0,2,0,0,0,0|2,0,0]=4 17224 B18R2.4060 Cc1cnc(c(c1)C)COCc2ccccn2 7a_100012000483_100000721315 [0,2,0,0,0,0|2,0,0]=4 17225 B18R2.4060 Cc1cnc(c(c1)C)COCc2cccnc2 34a_100012000483_100000733263 [0,2,0,0,0,0|2,0,0]=4 17226 B18R2.4060 Cc1cnc(c(c1)C)COCc2cccnc2 7a_100012000483_100000741622 [0,2,0,0,0,0|2,0,0]=4 17227 B18R2.4060 Cc1cnc(c(c1)C)COCc2ccncc2 7a_100012000483_100015193705 [0,2,0,0,0,0|2,0,0]=4 17228 B18R2.4060 Cc1cnc(c(c1)C)CSCc2ccccc2 62a_100000211182_100016990036 [0,2,0,0,0,0|1,1,0]=4 17229 B18R2.4060 Cc1cnc(c(c1)C)CSCc2ccccc2 62a_100016990036_100015291786 [0,2,0,0,0,0|1,1,0]=4 17230 B18R2.4060 Cc1cnc(c(c1)F)CNCc2ccccc2 207a_100015324214_100009845184 [0,2,0,0,0,0|2,0,0]=4 17231 B18R2.4060 Cc1cnc(c(c1)F)CNCc2ccccc2 270004a_100015324214_100009845184 [0,2,0,0,0,0|2,0,0]=4 17232 B18R2.4060 Cc1nc(ccc1COCc2ccccc2)F 34a_100000081978_100015291786 [0,2,0,0,0,0|1,0,0]=3 17233 B18R2.4060 Cc1nc(ccc1COCc2ccccc2)F 7a_100000081978_100000211182 [0,2,0,0,0,0|1,0,0]=3 17234 B18R2.4060 Cc1nc(ccc1COCc2ccccn2)F 34a_100000081978_100000721315 [0,2,0,0,0,0|2,0,0]=4 17235 B18R2.4060 Cc1nc(ccc1COCc2ccccn2)F 7a_100000081978_100000721315 [0,2,0,0,0,0|2,0,0]=4 17236 B18R2.4060 Cc1nc(ccc1COCc2cccnc2)F 34a_100000081978_100000733263 [0,2,0,0,0,0|2,0,0]=4 17237 B18R2.4060 Cc1nc(ccc1COCc2cccnc2)F 7a_100000081978_100000741622 [0,2,0,0,0,0|2,0,0]=4 17238 B18R2.4060 Cc1nc(ccc1COCc2ccncc2)F 7a_100000081978_100015193705 [0,2,0,0,0,0|2,0,0]=4 17239 B18R2.4060 Cc1ncc(c(n1)C)COCc2ccccc2 34a_100000699490_100015291786 [0,2,0,0,0,0|2,0,0]=4 17240 B18R2.4060 Cc1ncc(c(n1)C)COCc2ccccc2 7a_100000699490_100000211182 [0,2,0,0,0,0|2,0,0]=4 17241 B18R2.4060 Cc1ncc(c(n1)N)COCc2ccccc2 7a_100000701481_100000211182 [0,2,0,0,0,0|2,0,0]=4 17242 B18R2.4060 Clc1cc(c(cn1)CNCc2ccccc2)Br 270004a_100015324214_100009892795 [0,2,0,0,0,0|2,0,0]=4 17243 B18R2.4060 Clc1cc(c(cn1)CNCc2ccccc2)Cl 2230a_100015324214_100011997056 [0,2,0,0,0,0|2,0,0]=4 17244 B18R2.4060 Clc1cc(c(cn1)CNCc2ccccc2)Cl 34a_100015324214_100011997056 [0,2,0,0,0,0|2,0,0]=4 17245 B18R2.4060 Clc1cc(c(cn1)COCc2ccccc2)Cl 34a_100000210790_100011997056 [0,2,0,0,0,0|1,0,0]=3 17246 B18R2.4060 Clc1cc(c(cn1)COCc2ccccc2)Cl 34a_100000702863_100015291786 [0,2,0,0,0,0|1,0,0]=3 17247 B18R2.4060 Clc1cc(c(cn1)COCc2ccccc2)Cl 7a_100000210790_100011997056 [0,2,0,0,0,0|1,0,0]=3 17248 B18R2.4060 Clc1cc(c(cn1)COCc2ccccc2)Cl 7a_100000702863_100000211182 [0,2,0,0,0,0|1,0,0]=3 17249 B18R2.4060 Clc1cc(c(cn1)COCc2ccccn2)Cl 34a_100000702863_100000721315 [0,2,0,0,0,0|2,0,0]=4 17250 B18R2.4060 Clc1cc(c(cn1)COCc2ccccn2)Cl 7a_100000702863_100000721315 [0,2,0,0,0,0|2,0,0]=4 17251 B18R2.4060 Clc1cc(c(cn1)COCc2cccnc2)Cl 34a_100000702863_100000733263 [0,2,0,0,0,0|2,0,0]=4 17252 B18R2.4060 Clc1cc(c(cn1)COCc2cccnc2)Cl 7a_100000702863_100000741622 [0,2,0,0,0,0|2,0,0]=4 17253 B18R2.4060 Clc1cc(c(cn1)COCc2ccncc2)Cl 7a_100000702863_100015193705 [0,2,0,0,0,0|2,0,0]=4 17254 B18R2.4060 Clc1cc(c(cn1)CSCc2ccccc2)Cl 62a_100000211182_100011997056 [0,2,0,0,0,0|1,1,0]=4 17255 B18R2.4060 Clc1cc(c(cn1)CSCc2ccccc2)Cl 62a_100011997056_100015291786 [0,2,0,0,0,0|1,1,0]=4 17256 B18R2.4060 Clc1cc(ccc1C=CCc2ccccc2)Br 271570a_200016263579_100011216062 [0,2,0,0,0,0|1,0,1]=4 17257 B18R2.4060 Clc1cc(ccc1CNCc2ccccc2)Br 207a_100015324214_100000764164 [0,2,0,0,0,0|1,0,0]=3 17258 B18R2.4060 Clc1cc(ccc1CNCc2ccccc2)Br 207a_100020628970_100015611070 [0,2,0,0,0,0|1,0,0]=3 17259 B18R2.4060 Clc1cc(ccc1CNCc2ccccc2)Br 2230a_100015324214_100011740631 [0,2,0,0,0,0|1,0,0]=3 17260 B18R2.4060 Clc1cc(ccc1CNCc2ccccc2)Br 270004a_100015324214_100000764164 [0,2,0,0,0,0|1,0,0]=3 17261 B18R2.4060 Clc1cc(ccc1CNCc2ccccc2)Br 270004a_100020628970_100015611070 [0,2,0,0,0,0|1,0,0]=3 17262 B18R2.4060 Clc1cc(ccc1CNCc2ccccc2)Br 34a_100015324214_100011740631 [0,2,0,0,0,0|1,0,0]=3 17263 B18R2.4060 Clc1cc(ccc1CNCc2ccccc2)Br 34a_100020628970_100015291786 [0,2,0,0,0,0|1,0,0]=3 17264 B18R2.4060 Clc1cc(ccc1CNCc2ccccc2)I 207a_100015324214_100000727542 [0,2,0,0,0,0|1,0,0]=3 17265 B18R2.4060 Clc1cc(ccc1CNCc2ccccn2)Br 207a_100020628970_100000209966 [0,2,0,0,0,0|2,0,0]=4 17266 B18R2.4060 Clc1cc(ccc1CNCc2ccccn2)Br 270004a_100000210449_100000764164 [0,2,0,0,0,0|2,0,0]=4 17267 B18R2.4060 Clc1cc(ccc1CNCc2ccccn2)Br 270004a_100020628970_100000209966 [0,2,0,0,0,0|2,0,0]=4 17268 B18R2.4060 Clc1cc(ccc1CNCc2ccccn2)Br 34a_100020628970_100000721315 [0,2,0,0,0,0|2,0,0]=4 17269 B18R2.4060 Clc1cc(ccc1CNCc2cccnc2)Br 207a_100000210453_100000764164 [0,2,0,0,0,0|2,0,0]=4 17270 B18R2.4060 Clc1cc(ccc1CNCc2cccnc2)Br 207a_100020628970_100000209961 [0,2,0,0,0,0|2,0,0]=4 17271 B18R2.4060 Clc1cc(ccc1CNCc2cccnc2)Br 270004a_100000210453_100000764164 [0,2,0,0,0,0|2,0,0]=4 17272 B18R2.4060 Clc1cc(ccc1CNCc2cccnc2)Br 270004a_100020628970_100000209961 [0,2,0,0,0,0|2,0,0]=4 17273 B18R2.4060 Clc1cc(ccc1CNCc2cccnc2)Br 34a_100020628970_100000733263 [0,2,0,0,0,0|2,0,0]=4 17274 B18R2.4060 Clc1cc(ccc1CNCc2cccnc2)I 207a_100000210453_100000727542 [0,2,0,0,0,0|2,0,0]=4 17275 B18R2.4060 Clc1cc(ccc1CNCc2ccncc2)Br 207a_100020628970_100000186114 [0,2,0,0,0,0|2,0,0]=4 17276 B18R2.4060 Clc1cc(ccc1COCc2ccccc2)Br 34a_100000210790_100011740631 [0,2,0,0,0,0|0,0,0]=2 17277 B18R2.4060 Clc1cc(ccc1COCc2ccccc2)Br 34a_100000756401_100015291786 [0,2,0,0,0,0|0,0,0]=2 17278 B18R2.4060 Clc1cc(ccc1COCc2ccccc2)Br 7a_100000210790_100011740631 [0,2,0,0,0,0|0,0,0]=2 17279 B18R2.4060 Clc1cc(ccc1COCc2ccccc2)Br 7a_100000756401_100000211182 [0,2,0,0,0,0|0,0,0]=2 17280 B18R2.4060 Clc1cc(ccc1COCc2ccccn2)Br 34a_100000756401_100000721315 [0,2,0,0,0,0|1,0,0]=3 17281 B18R2.4060 Clc1cc(ccc1COCc2ccccn2)Br 7a_100000756401_100000721315 [0,2,0,0,0,0|1,0,0]=3 17282 B18R2.4060 Clc1cc(ccc1COCc2cccnc2)Br 34a_100000756401_100000733263 [0,2,0,0,0,0|1,0,0]=3 17283 B18R2.4060 Clc1cc(ccc1COCc2cccnc2)Br 7a_100000756401_100000741622 [0,2,0,0,0,0|1,0,0]=3 17284 B18R2.4060 Clc1cc(ccc1COCc2cccnn2)Br 34a_100000756401_100016990269 [0,2,0,0,0,0|2,0,0]=4 17285 B18R2.4060 Clc1cc(ccc1COCc2cccnn2)Br 7a_100000756401_100016990269 [0,2,0,0,0,0|2,0,0]=4 17286 B18R2.4060 Clc1cc(ccc1COCc2ccncc2)Br 7a_100000756401_100015193705 [0,2,0,0,0,0|1,0,0]=3 17287 B18R2.4060 Clc1cc(ccc1COCc2cnccn2)Br 34a_100000756401_100016995436 [0,2,0,0,0,0|2,0,0]=4 17288 B18R2.4060 Clc1cc(ccc1COCc2cnccn2)Br 7a_100000756401_100016995436 [0,2,0,0,0,0|2,0,0]=4 17289 B18R2.4060 Clc1cc(ccc1COCc2cncnc2)Br 34a_100000756401_100015196519 [0,2,0,0,0,0|2,0,0]=4 17290 B18R2.4060 Clc1cc(ccc1COCc2cncnc2)Br 7a_100000756401_100015196519 [0,2,0,0,0,0|2,0,0]=4 17291 B18R2.4060 Clc1cc(ccc1COCc2ncccn2)Br 34a_100000756401_100000703007 [0,2,0,0,0,0|2,0,0]=4 17292 B18R2.4060 Clc1cc(ccc1COCc2ncccn2)Br 7a_100000756401_100000703007 [0,2,0,0,0,0|2,0,0]=4 17293 B18R2.4060 Clc1cc(ccc1CSCc2ccccc2)Br 62a_100000211182_100011740631 [0,2,0,0,0,0|0,1,0]=3 17294 B18R2.4060 Clc1cc(ccc1CSCc2ccccc2)Br 62a_100011740631_100015291786 [0,2,0,0,0,0|0,1,0]=3 17295 B18R2.4060 Clc1cc(ccc1CSCc2ccccn2)Br 62a_100000721315_100011740631 [0,2,0,0,0,0|1,1,0]=4 17296 B18R2.4060 Clc1cc(ccc1CSCc2ccccn2)Br 62a_100011740631_100000721315 [0,2,0,0,0,0|1,1,0]=4 17297 B18R2.4060 Clc1cc(ccc1CSCc2cccnc2)Br 62a_100000741622_100011740631 [0,2,0,0,0,0|1,1,0]=4 17298 B18R2.4060 Clc1cc(ccc1CSCc2cccnc2)Br 62a_100011740631_100000741622 [0,2,0,0,0,0|1,1,0]=4 17299 B18R2.4060 Clc1cc(ccc1CSCc2ccncc2)Br 62a_100011740631_100015193705 [0,2,0,0,0,0|1,1,0]=4 17300 B18R2.4060 Clc1cc(ccc1CSCc2ccncc2)Br 62a_100015193705_100011740631 [0,2,0,0,0,0|1,1,0]=4 17301 B18R2.4060 Clc1cc(ccc1NCCc2ccccc2)Br 34a_100000211467_100000765856 [0,2,0,0,0,0|2,0,0]=4 17302 B18R2.4060 Clc1cc(ccc1NCCc2ccccc2)I 34a_100011218065_100000765856 [0,2,0,0,0,0|2,0,0]=4 17303 B18R2.4060 Clc1cc(ccc1OCCc2ccccc2)Br 34a_100000186472_100000765856 [0,2,0,0,0,0|2,0,0]=4 17304 B18R2.4060 Clc1cc(ccc1OCCc2ccccc2)Br 7a_100000186472_100000765856 [0,2,0,0,0,0|2,0,0]=4 17305 B18R2.4060 Clc1cc(ccc1OCCc2ccccc2)I 34a_100012360047_100000765856 [0,2,0,0,0,0|2,0,0]=4 17306 B18R2.4060 Clc1cc(ccc1OCCc2ccccc2)I 7a_100012360047_100000765856 [0,2,0,0,0,0|2,0,0]=4 17307 B18R2.4060 Clc1cc(ccc1SCCc2ccccc2)Br 62a_100000765856_100011216062 [0,2,0,0,0,0|2,0,0]=4 17308 B18R2.4060 Clc1cc(ccc1SCCc2ccccc2)Br 62a_100011216062_100011218657 [0,2,0,0,0,0|2,0,0]=4 17309 B18R2.4060 Clc1cc(cnc1CNCc2ccccc2)Br 207a_100015324214_100009814801 [0,2,0,0,0,0|2,0,0]=4 17310 B18R2.4060 Clc1cc(cnc1CNCc2ccccc2)Br 270004a_100015324214_100009814801 [0,2,0,0,0,0|2,0,0]=4 17311 B18R2.4060 Clc1cc(cnc1CNCc2ccccc2)Br 34a_100025703182_100015291786 [0,2,0,0,0,0|2,0,0]=4 17312 B18R2.4060 Clc1cc(cnc1COCc2ccccc2)Br 34a_100010065239_100015291786 [0,2,0,0,0,0|1,0,0]=3 17313 B18R2.4060 Clc1cc(cnc1COCc2ccccc2)Br 7a_100010065239_100000211182 [0,2,0,0,0,0|1,0,0]=3 17314 B18R2.4060 Clc1cc(cnc1COCc2ccccn2)Br 34a_100010065239_100000721315 [0,2,0,0,0,0|2,0,0]=4 17315 B18R2.4060 Clc1cc(cnc1COCc2ccccn2)Br 7a_100010065239_100000721315 [0,2,0,0,0,0|2,0,0]=4 17316 B18R2.4060 Clc1cc(cnc1COCc2cccnc2)Br 34a_100010065239_100000733263 [0,2,0,0,0,0|2,0,0]=4 17317 B18R2.4060 Clc1cc(cnc1COCc2cccnc2)Br 7a_100010065239_100000741622 [0,2,0,0,0,0|2,0,0]=4 17318 B18R2.4060 Clc1cc(cnc1COCc2ccncc2)Br 7a_100010065239_100015193705 [0,2,0,0,0,0|2,0,0]=4 17319 B18R2.4060 Clc1ccc(c(c1)Br)C=CCc2ccccc2 271570a_200016263579_100011219703 [0,2,0,0,0,0|1,0,1]=4 17320 B18R2.4060 Clc1ccc(c(c1)Br)CCNc2ccccc2 34a_100000106764_200012945151 [0,2,0,0,0,0|2,0,0]=4 17321 B18R2.4060 Clc1ccc(c(c1)Br)CCOc2ccccc2 34a_100000210340_200012945151 [0,2,0,0,0,0|2,0,0]=4 17322 B18R2.4060 Clc1ccc(c(c1)Br)CCOc2ccccc2 7a_100000210340_200012945151 [0,2,0,0,0,0|2,0,0]=4 17323 B18R2.4060 Clc1ccc(c(c1)Br)CCSc2ccccc2 62a_100000719477_200012945151 [0,2,0,0,0,0|2,0,0]=4 17324 B18R2.4060 Clc1ccc(c(c1)Br)CCSc2ccccc2 62a_200012945151_100000041952 [0,2,0,0,0,0|2,0,0]=4 17325 B18R2.4060 Clc1ccc(c(c1)Br)CNCc2ccccc2 207a_100015324214_100000687667 [0,2,0,0,0,0|1,0,0]=3 17326 B18R2.4060 Clc1ccc(c(c1)Br)CNCc2ccccc2 207a_100102692131_100015611070 [0,2,0,0,0,0|1,0,0]=3 17327 B18R2.4060 Clc1ccc(c(c1)Br)CNCc2ccccc2 2230a_100015324214_100000755608 [0,2,0,0,0,0|1,0,0]=3 17328 B18R2.4060 Clc1ccc(c(c1)Br)CNCc2ccccc2 270004a_100015324214_100000687667 [0,2,0,0,0,0|1,0,0]=3 17329 B18R2.4060 Clc1ccc(c(c1)Br)CNCc2ccccc2 270004a_100102692131_100015611070 [0,2,0,0,0,0|1,0,0]=3 17330 B18R2.4060 Clc1ccc(c(c1)Br)CNCc2ccccc2 34a_100015324214_100000755608 [0,2,0,0,0,0|1,0,0]=3 17331 B18R2.4060 Clc1ccc(c(c1)Br)CNCc2ccccc2 34a_100102692131_100015291786 [0,2,0,0,0,0|1,0,0]=3 17332 B18R2.4060 Clc1ccc(c(c1)Br)CNCc2ccccn2 207a_100102692131_100000209966 [0,2,0,0,0,0|2,0,0]=4 17333 B18R2.4060 Clc1ccc(c(c1)Br)CNCc2ccccn2 270004a_100000210449_100000687667 [0,2,0,0,0,0|2,0,0]=4 17334 B18R2.4060 Clc1ccc(c(c1)Br)CNCc2ccccn2 270004a_100102692131_100000209966 [0,2,0,0,0,0|2,0,0]=4 17335 B18R2.4060 Clc1ccc(c(c1)Br)CNCc2ccccn2 34a_100102692131_100000721315 [0,2,0,0,0,0|2,0,0]=4 17336 B18R2.4060 Clc1ccc(c(c1)Br)CNCc2cccnc2 207a_100000210453_100000687667 [0,2,0,0,0,0|2,0,0]=4 17337 B18R2.4060 Clc1ccc(c(c1)Br)CNCc2cccnc2 207a_100102692131_100000209961 [0,2,0,0,0,0|2,0,0]=4 17338 B18R2.4060 Clc1ccc(c(c1)Br)CNCc2cccnc2 270004a_100000210453_100000687667 [0,2,0,0,0,0|2,0,0]=4 17339 B18R2.4060 Clc1ccc(c(c1)Br)CNCc2cccnc2 270004a_100102692131_100000209961 [0,2,0,0,0,0|2,0,0]=4 17340 B18R2.4060 Clc1ccc(c(c1)Br)CNCc2cccnc2 34a_100102692131_100000733263 [0,2,0,0,0,0|2,0,0]=4 17341 B18R2.4060 Clc1ccc(c(c1)Br)CNCc2ccncc2 207a_100102692131_100000186114 [0,2,0,0,0,0|2,0,0]=4 17342 B18R2.4060 Clc1ccc(c(c1)Br)COCc2ccccc2 34a_100000210790_100000755608 [0,2,0,0,0,0|0,0,0]=2 17343 B18R2.4060 Clc1ccc(c(c1)Br)COCc2ccccc2 34a_100000707881_100015291786 [0,2,0,0,0,0|0,0,0]=2 17344 B18R2.4060 Clc1ccc(c(c1)Br)COCc2ccccc2 7a_100000210790_100000755608 [0,2,0,0,0,0|0,0,0]=2 17345 B18R2.4060 Clc1ccc(c(c1)Br)COCc2ccccc2 7a_100000707881_100000211182 [0,2,0,0,0,0|0,0,0]=2 17346 B18R2.4060 Clc1ccc(c(c1)Br)COCc2ccccn2 34a_100000707881_100000721315 [0,2,0,0,0,0|1,0,0]=3 17347 B18R2.4060 Clc1ccc(c(c1)Br)COCc2ccccn2 7a_100000707881_100000721315 [0,2,0,0,0,0|1,0,0]=3 17348 B18R2.4060 Clc1ccc(c(c1)Br)COCc2cccnc2 34a_100000707881_100000733263 [0,2,0,0,0,0|1,0,0]=3 17349 B18R2.4060 Clc1ccc(c(c1)Br)COCc2cccnc2 7a_100000707881_100000741622 [0,2,0,0,0,0|1,0,0]=3 17350 B18R2.4060 Clc1ccc(c(c1)Br)COCc2cccnn2 34a_100000707881_100016990269 [0,2,0,0,0,0|2,0,0]=4 17351 B18R2.4060 Clc1ccc(c(c1)Br)COCc2cccnn2 7a_100000707881_100016990269 [0,2,0,0,0,0|2,0,0]=4 17352 B18R2.4060 Clc1ccc(c(c1)Br)COCc2ccncc2 7a_100000707881_100015193705 [0,2,0,0,0,0|1,0,0]=3 17353 B18R2.4060 Clc1ccc(c(c1)Br)COCc2cnccn2 34a_100000707881_100016995436 [0,2,0,0,0,0|2,0,0]=4 17354 B18R2.4060 Clc1ccc(c(c1)Br)COCc2cnccn2 7a_100000707881_100016995436 [0,2,0,0,0,0|2,0,0]=4 17355 B18R2.4060 Clc1ccc(c(c1)Br)COCc2cncnc2 34a_100000707881_100015196519 [0,2,0,0,0,0|2,0,0]=4 17356 B18R2.4060 Clc1ccc(c(c1)Br)COCc2cncnc2 7a_100000707881_100015196519 [0,2,0,0,0,0|2,0,0]=4 17357 B18R2.4060 Clc1ccc(c(c1)Br)COCc2ncccn2 34a_100000707881_100000703007 [0,2,0,0,0,0|2,0,0]=4 17358 B18R2.4060 Clc1ccc(c(c1)Br)COCc2ncccn2 7a_100000707881_100000703007 [0,2,0,0,0,0|2,0,0]=4 17359 B18R2.4060 Clc1ccc(c(c1)Br)CSCc2ccccc2 62a_100000211182_100000755608 [0,2,0,0,0,0|0,1,0]=3 17360 B18R2.4060 Clc1ccc(c(c1)Br)CSCc2ccccc2 62a_100000755608_100015291786 [0,2,0,0,0,0|0,1,0]=3 17361 B18R2.4060 Clc1ccc(c(c1)Br)CSCc2ccccn2 62a_100000721315_100000755608 [0,2,0,0,0,0|1,1,0]=4 17362 B18R2.4060 Clc1ccc(c(c1)Br)CSCc2ccccn2 62a_100000755608_100000721315 [0,2,0,0,0,0|1,1,0]=4 17363 B18R2.4060 Clc1ccc(c(c1)Br)CSCc2cccnc2 62a_100000741622_100000755608 [0,2,0,0,0,0|1,1,0]=4 17364 B18R2.4060 Clc1ccc(c(c1)Br)CSCc2cccnc2 62a_100000755608_100000741622 [0,2,0,0,0,0|1,1,0]=4 17365 B18R2.4060 Clc1ccc(c(c1)Br)CSCc2ccncc2 62a_100000755608_100015193705 [0,2,0,0,0,0|1,1,0]=4 17366 B18R2.4060 Clc1ccc(c(c1)Br)CSCc2ccncc2 62a_100015193705_100000755608 [0,2,0,0,0,0|1,1,0]=4 17367 B18R2.4060 Clc1ccc(c(c1)Br)NCCc2ccccc2 34a_100000752454_100000765856 [0,2,0,0,0,0|2,0,0]=4 17368 B18R2.4060 Clc1ccc(c(c1)Br)OCCc2ccccc2 34a_100000211998_100000765856 [0,2,0,0,0,0|2,0,0]=4 17369 B18R2.4060 Clc1ccc(c(c1)Br)OCCc2ccccc2 7a_100000211998_100000765856 [0,2,0,0,0,0|2,0,0]=4 17370 B18R2.4060 Clc1ccc(c(c1)Br)SCCc2ccccc2 62a_100000765856_100011219703 [0,2,0,0,0,0|2,0,0]=4 17371 B18R2.4060 Clc1ccc(c(c1)Br)SCCc2ccccc2 62a_100011219703_100011218657 [0,2,0,0,0,0|2,0,0]=4 17372 B18R2.4060 Clc1ccc(c(c1)Cl)C=CCc2ccccc2 271570a_200016263579_100000699841 [0,2,0,0,0,0|1,0,1]=4 17373 B18R2.4060 Clc1ccc(c(c1)Cl)CCNc2ccccc2 34a_100000106764_200012161198 [0,2,0,0,0,0|2,0,0]=4 17374 B18R2.4060 Clc1ccc(c(c1)Cl)CCOc2ccccc2 34a_100000210340_200012161198 [0,2,0,0,0,0|2,0,0]=4 17375 B18R2.4060 Clc1ccc(c(c1)Cl)CCOc2ccccc2 7a_100000210340_200012161198 [0,2,0,0,0,0|2,0,0]=4 17376 B18R2.4060 Clc1ccc(c(c1)Cl)CCSc2ccccc2 62a_100000719477_200012161198 [0,2,0,0,0,0|2,0,0]=4 17377 B18R2.4060 Clc1ccc(c(c1)Cl)CCSc2ccccc2 62a_200012161198_100000041952 [0,2,0,0,0,0|2,0,0]=4 17378 B18R2.4060 Clc1ccc(c(c1)Cl)CNCc2ccccc2 207a_100000174880_100015611070 [0,2,0,0,0,0|1,0,0]=3 17379 B18R2.4060 Clc1ccc(c(c1)Cl)CNCc2ccccc2 207a_100015324214_100000188887 [0,2,0,0,0,0|1,0,0]=3 17380 B18R2.4060 Clc1ccc(c(c1)Cl)CNCc2ccccc2 2230a_100015324214_100000188473 [0,2,0,0,0,0|1,0,0]=3 17381 B18R2.4060 Clc1ccc(c(c1)Cl)CNCc2ccccc2 270004a_100000174880_100015611070 [0,2,0,0,0,0|1,0,0]=3 17382 B18R2.4060 Clc1ccc(c(c1)Cl)CNCc2ccccc2 270004a_100015324214_100000188887 [0,2,0,0,0,0|1,0,0]=3 17383 B18R2.4060 Clc1ccc(c(c1)Cl)CNCc2ccccc2 34a_100000174880_100015291786 [0,2,0,0,0,0|1,0,0]=3 17384 B18R2.4060 Clc1ccc(c(c1)Cl)CNCc2ccccc2 34a_100015324214_100000188473 [0,2,0,0,0,0|1,0,0]=3 17385 B18R2.4060 Clc1ccc(c(c1)Cl)CNCc2ccccn2 207a_100000174880_100000209966 [0,2,0,0,0,0|2,0,0]=4 17386 B18R2.4060 Clc1ccc(c(c1)Cl)CNCc2ccccn2 270004a_100000174880_100000209966 [0,2,0,0,0,0|2,0,0]=4 17387 B18R2.4060 Clc1ccc(c(c1)Cl)CNCc2ccccn2 270004a_100000210449_100000188887 [0,2,0,0,0,0|2,0,0]=4 17388 B18R2.4060 Clc1ccc(c(c1)Cl)CNCc2ccccn2 34a_100000174880_100000721315 [0,2,0,0,0,0|2,0,0]=4 17389 B18R2.4060 Clc1ccc(c(c1)Cl)CNCc2cccnc2 207a_100000174880_100000209961 [0,2,0,0,0,0|2,0,0]=4 17390 B18R2.4060 Clc1ccc(c(c1)Cl)CNCc2cccnc2 207a_100000210453_100000188887 [0,2,0,0,0,0|2,0,0]=4 17391 B18R2.4060 Clc1ccc(c(c1)Cl)CNCc2cccnc2 270004a_100000174880_100000209961 [0,2,0,0,0,0|2,0,0]=4 17392 B18R2.4060 Clc1ccc(c(c1)Cl)CNCc2cccnc2 270004a_100000210453_100000188887 [0,2,0,0,0,0|2,0,0]=4 17393 B18R2.4060 Clc1ccc(c(c1)Cl)CNCc2cccnc2 34a_100000174880_100000733263 [0,2,0,0,0,0|2,0,0]=4 17394 B18R2.4060 Clc1ccc(c(c1)Cl)CNCc2ccncc2 207a_100000174880_100000186114 [0,2,0,0,0,0|2,0,0]=4 17395 B18R2.4060 Clc1ccc(c(c1)Cl)COCc2ccccc2 34a_100000210790_100000188473 [0,2,0,0,0,0|0,0,0]=2 17396 B18R2.4060 Clc1ccc(c(c1)Cl)COCc2ccccc2 34a_100000215721_100015291786 [0,2,0,0,0,0|0,0,0]=2 17397 B18R2.4060 Clc1ccc(c(c1)Cl)COCc2ccccc2 7a_100000210790_100000188473 [0,2,0,0,0,0|0,0,0]=2 17398 B18R2.4060 Clc1ccc(c(c1)Cl)COCc2ccccc2 7a_100000215721_100000211182 [0,2,0,0,0,0|0,0,0]=2 17399 B18R2.4060 Clc1ccc(c(c1)Cl)COCc2ccccn2 34a_100000215721_100000721315 [0,2,0,0,0,0|1,0,0]=3 17400 B18R2.4060 Clc1ccc(c(c1)Cl)COCc2ccccn2 7a_100000215721_100000721315 [0,2,0,0,0,0|1,0,0]=3 17401 B18R2.4060 Clc1ccc(c(c1)Cl)COCc2cccnc2 34a_100000215721_100000733263 [0,2,0,0,0,0|1,0,0]=3 17402 B18R2.4060 Clc1ccc(c(c1)Cl)COCc2cccnc2 7a_100000215721_100000741622 [0,2,0,0,0,0|1,0,0]=3 17403 B18R2.4060 Clc1ccc(c(c1)Cl)COCc2cccnn2 34a_100000215721_100016990269 [0,2,0,0,0,0|2,0,0]=4 17404 B18R2.4060 Clc1ccc(c(c1)Cl)COCc2cccnn2 7a_100000215721_100016990269 [0,2,0,0,0,0|2,0,0]=4 17405 B18R2.4060 Clc1ccc(c(c1)Cl)COCc2ccncc2 7a_100000215721_100015193705 [0,2,0,0,0,0|1,0,0]=3 17406 B18R2.4060 Clc1ccc(c(c1)Cl)COCc2cnccn2 34a_100000215721_100016995436 [0,2,0,0,0,0|2,0,0]=4 17407 B18R2.4060 Clc1ccc(c(c1)Cl)COCc2cnccn2 7a_100000215721_100016995436 [0,2,0,0,0,0|2,0,0]=4 17408 B18R2.4060 Clc1ccc(c(c1)Cl)COCc2cncnc2 34a_100000215721_100015196519 [0,2,0,0,0,0|2,0,0]=4 17409 B18R2.4060 Clc1ccc(c(c1)Cl)COCc2cncnc2 7a_100000215721_100015196519 [0,2,0,0,0,0|2,0,0]=4 17410 B18R2.4060 Clc1ccc(c(c1)Cl)COCc2ncccn2 34a_100000215721_100000703007 [0,2,0,0,0,0|2,0,0]=4 17411 B18R2.4060 Clc1ccc(c(c1)Cl)COCc2ncccn2 7a_100000215721_100000703007 [0,2,0,0,0,0|2,0,0]=4 17412 B18R2.4060 Clc1ccc(c(c1)Cl)CSCc2ccccc2 62a_100000188473_100015291786 [0,2,0,0,0,0|0,1,0]=3 17413 B18R2.4060 Clc1ccc(c(c1)Cl)CSCc2ccccc2 62a_100000211182_100000188473 [0,2,0,0,0,0|0,1,0]=3 17414 B18R2.4060 Clc1ccc(c(c1)Cl)CSCc2ccccn2 62a_100000188473_100000721315 [0,2,0,0,0,0|1,1,0]=4 17415 B18R2.4060 Clc1ccc(c(c1)Cl)CSCc2ccccn2 62a_100000721315_100000188473 [0,2,0,0,0,0|1,1,0]=4 17416 B18R2.4060 Clc1ccc(c(c1)Cl)CSCc2cccnc2 62a_100000188473_100000741622 [0,2,0,0,0,0|1,1,0]=4 17417 B18R2.4060 Clc1ccc(c(c1)Cl)CSCc2cccnc2 62a_100000741622_100000188473 [0,2,0,0,0,0|1,1,0]=4 17418 B18R2.4060 Clc1ccc(c(c1)Cl)CSCc2ccncc2 62a_100000188473_100015193705 [0,2,0,0,0,0|1,1,0]=4 17419 B18R2.4060 Clc1ccc(c(c1)Cl)CSCc2ccncc2 62a_100015193705_100000188473 [0,2,0,0,0,0|1,1,0]=4 17420 B18R2.4060 Clc1ccc(c(c1)Cl)NCCc2ccccc2 34a_100000185861_100000765856 [0,2,0,0,0,0|2,0,0]=4 17421 B18R2.4060 Clc1ccc(c(c1)Cl)OCCc2ccccc2 34a_100015191787_100000765856 [0,2,0,0,0,0|2,0,0]=4 17422 B18R2.4060 Clc1ccc(c(c1)Cl)OCCc2ccccc2 7a_100015191787_100000765856 [0,2,0,0,0,0|2,0,0]=4 17423 B18R2.4060 Clc1ccc(c(c1)Cl)SCCc2ccccc2 62a_100000699841_100011218657 [0,2,0,0,0,0|2,0,0]=4 17424 B18R2.4060 Clc1ccc(c(c1)Cl)SCCc2ccccc2 62a_100000765856_100000699841 [0,2,0,0,0,0|2,0,0]=4 17425 B18R2.4060 Clc1ccc(c(c1)I)CNCc2ccccc2 2230a_100015324214_100010254388 [0,2,0,0,0,0|1,0,0]=3 17426 B18R2.4060 Clc1ccc(c(c1)I)CNCc2ccccc2 34a_100015324214_100010254388 [0,2,0,0,0,0|1,0,0]=3 17427 B18R2.4060 Clc1ccc(c(c1)I)COCc2ccccc2 34a_100000210790_100010254388 [0,2,0,0,0,0|0,0,0]=2 17428 B18R2.4060 Clc1ccc(c(c1)I)COCc2ccccc2 34a_100000722340_100015291786 [0,2,0,0,0,0|0,0,0]=2 17429 B18R2.4060 Clc1ccc(c(c1)I)COCc2ccccc2 7a_100000210790_100010254388 [0,2,0,0,0,0|0,0,0]=2 17430 B18R2.4060 Clc1ccc(c(c1)I)COCc2ccccc2 7a_100000722340_100000211182 [0,2,0,0,0,0|0,0,0]=2 17431 B18R2.4060 Clc1ccc(c(c1)I)COCc2ccccn2 34a_100000722340_100000721315 [0,2,0,0,0,0|1,0,0]=3 17432 B18R2.4060 Clc1ccc(c(c1)I)COCc2ccccn2 7a_100000722340_100000721315 [0,2,0,0,0,0|1,0,0]=3 17433 B18R2.4060 Clc1ccc(c(c1)I)COCc2cccnc2 34a_100000722340_100000733263 [0,2,0,0,0,0|1,0,0]=3 17434 B18R2.4060 Clc1ccc(c(c1)I)COCc2cccnc2 7a_100000722340_100000741622 [0,2,0,0,0,0|1,0,0]=3 17435 B18R2.4060 Clc1ccc(c(c1)I)COCc2cccnn2 34a_100000722340_100016990269 [0,2,0,0,0,0|2,0,0]=4 17436 B18R2.4060 Clc1ccc(c(c1)I)COCc2cccnn2 7a_100000722340_100016990269 [0,2,0,0,0,0|2,0,0]=4 17437 B18R2.4060 Clc1ccc(c(c1)I)COCc2ccncc2 7a_100000722340_100015193705 [0,2,0,0,0,0|1,0,0]=3 17438 B18R2.4060 Clc1ccc(c(c1)I)COCc2cnccn2 34a_100000722340_100016995436 [0,2,0,0,0,0|2,0,0]=4 17439 B18R2.4060 Clc1ccc(c(c1)I)COCc2cnccn2 7a_100000722340_100016995436 [0,2,0,0,0,0|2,0,0]=4 17440 B18R2.4060 Clc1ccc(c(c1)I)COCc2cncnc2 34a_100000722340_100015196519 [0,2,0,0,0,0|2,0,0]=4 17441 B18R2.4060 Clc1ccc(c(c1)I)COCc2cncnc2 7a_100000722340_100015196519 [0,2,0,0,0,0|2,0,0]=4 17442 B18R2.4060 Clc1ccc(c(c1)I)COCc2ncccn2 34a_100000722340_100000703007 [0,2,0,0,0,0|2,0,0]=4 17443 B18R2.4060 Clc1ccc(c(c1)I)COCc2ncccn2 7a_100000722340_100000703007 [0,2,0,0,0,0|2,0,0]=4 17444 B18R2.4060 Clc1ccc(c(c1)I)CSCc2ccccc2 62a_100000211182_100010254388 [0,2,0,0,0,0|0,1,0]=3 17445 B18R2.4060 Clc1ccc(c(c1)I)CSCc2ccccc2 62a_100010254388_100015291786 [0,2,0,0,0,0|0,1,0]=3 17446 B18R2.4060 Clc1ccc(c(c1)I)CSCc2ccccn2 62a_100000721315_100010254388 [0,2,0,0,0,0|1,1,0]=4 17447 B18R2.4060 Clc1ccc(c(c1)I)CSCc2ccccn2 62a_100010254388_100000721315 [0,2,0,0,0,0|1,1,0]=4 17448 B18R2.4060 Clc1ccc(c(c1)I)CSCc2cccnc2 62a_100000741622_100010254388 [0,2,0,0,0,0|1,1,0]=4 17449 B18R2.4060 Clc1ccc(c(c1)I)CSCc2cccnc2 62a_100010254388_100000741622 [0,2,0,0,0,0|1,1,0]=4 17450 B18R2.4060 Clc1ccc(c(c1)I)CSCc2ccncc2 62a_100010254388_100015193705 [0,2,0,0,0,0|1,1,0]=4 17451 B18R2.4060 Clc1ccc(c(c1)I)CSCc2ccncc2 62a_100015193705_100010254388 [0,2,0,0,0,0|1,1,0]=4 17452 B18R2.4060 Clc1ccc(c(c1)I)NCCc2ccccc2 34a_100000761889_100000765856 [0,2,0,0,0,0|2,0,0]=4 17453 B18R2.4060 Clc1ccc(c(c1)I)OCCc2ccccc2 34a_100011356953_100000765856 [0,2,0,0,0,0|2,0,0]=4 17454 B18R2.4060 Clc1ccc(c(c1)I)OCCc2ccccc2 7a_100011356953_100000765856 [0,2,0,0,0,0|2,0,0]=4 17455 B18R2.4060 Clc1ccc(c(n1)Cl)CNCc2ccccc2 2230a_100015324214_100000722033 [0,2,0,0,0,0|2,0,0]=4 17456 B18R2.4060 Clc1ccc(c(n1)Cl)CNCc2ccccc2 34a_100015324214_100000722033 [0,2,0,0,0,0|2,0,0]=4 17457 B18R2.4060 Clc1ccc(c(n1)Cl)COCc2ccccc2 34a_100000210790_100000722033 [0,2,0,0,0,0|1,0,0]=3 17458 B18R2.4060 Clc1ccc(c(n1)Cl)COCc2ccccc2 34a_100000720492_100015291786 [0,2,0,0,0,0|1,0,0]=3 17459 B18R2.4060 Clc1ccc(c(n1)Cl)COCc2ccccc2 7a_100000210790_100000722033 [0,2,0,0,0,0|1,0,0]=3 17460 B18R2.4060 Clc1ccc(c(n1)Cl)COCc2ccccc2 7a_100000720492_100000211182 [0,2,0,0,0,0|1,0,0]=3 17461 B18R2.4060 Clc1ccc(c(n1)Cl)COCc2ccccn2 34a_100000720492_100000721315 [0,2,0,0,0,0|2,0,0]=4 17462 B18R2.4060 Clc1ccc(c(n1)Cl)COCc2ccccn2 7a_100000720492_100000721315 [0,2,0,0,0,0|2,0,0]=4 17463 B18R2.4060 Clc1ccc(c(n1)Cl)COCc2cccnc2 34a_100000720492_100000733263 [0,2,0,0,0,0|2,0,0]=4 17464 B18R2.4060 Clc1ccc(c(n1)Cl)COCc2cccnc2 7a_100000720492_100000741622 [0,2,0,0,0,0|2,0,0]=4 17465 B18R2.4060 Clc1ccc(c(n1)Cl)COCc2ccncc2 7a_100000720492_100015193705 [0,2,0,0,0,0|2,0,0]=4 17466 B18R2.4060 Clc1ccc(c(n1)Cl)CSCc2ccccc2 62a_100000211182_100000722033 [0,2,0,0,0,0|1,1,0]=4 17467 B18R2.4060 Clc1ccc(c(n1)Cl)CSCc2ccccc2 62a_100000722033_100015291786 [0,2,0,0,0,0|1,1,0]=4 17468 B18R2.4060 Clc1cnc(c(c1)Br)CNCc2ccccc2 207a_100015324214_100010064872 [0,2,0,0,0,0|2,0,0]=4 17469 B18R2.4060 Clc1cnc(c(c1)Br)CNCc2ccccc2 270004a_100010113384_100015611070 [0,2,0,0,0,0|2,0,0]=4 17470 B18R2.4060 Clc1cnc(c(c1)Br)CNCc2ccccc2 270004a_100015324214_100010064872 [0,2,0,0,0,0|2,0,0]=4 17471 B18R2.4060 Clc1cnc(c(c1)Br)COCc2ccccc2 34a_100010065237_100015291786 [0,2,0,0,0,0|1,0,0]=3 17472 B18R2.4060 Clc1cnc(c(c1)Br)COCc2ccccc2 7a_100010065237_100000211182 [0,2,0,0,0,0|1,0,0]=3 17473 B18R2.4060 Clc1cnc(c(c1)Br)COCc2ccccn2 34a_100010065237_100000721315 [0,2,0,0,0,0|2,0,0]=4 17474 B18R2.4060 Clc1cnc(c(c1)Br)COCc2ccccn2 7a_100010065237_100000721315 [0,2,0,0,0,0|2,0,0]=4 17475 B18R2.4060 Clc1cnc(c(c1)Br)COCc2cccnc2 34a_100010065237_100000733263 [0,2,0,0,0,0|2,0,0]=4 17476 B18R2.4060 Clc1cnc(c(c1)Br)COCc2cccnc2 7a_100010065237_100000741622 [0,2,0,0,0,0|2,0,0]=4 17477 B18R2.4060 Clc1cnc(c(c1)Br)COCc2ccncc2 7a_100010065237_100015193705 [0,2,0,0,0,0|2,0,0]=4 17478 B18R2.4060 Clc1cnc(c(c1)Cl)CNCc2ccccc2 207a_100015324214_100011361609 [0,2,0,0,0,0|2,0,0]=4 17479 B18R2.4060 Clc1cnc(c(c1)Cl)CNCc2ccccc2 270004a_100015324214_100011361609 [0,2,0,0,0,0|2,0,0]=4 17480 B18R2.4060 Clc1cnc(c(c1)Cl)CNCc2ccccc2 270004a_200020636379_100015611070 [0,2,0,0,0,0|2,0,0]=4 17481 B18R2.4060 Clc1cnc(c(c1)Cl)COCc2ccccc2 34a_100103146734_100015291786 [0,2,0,0,0,0|1,0,0]=3 17482 B18R2.4060 Clc1cnc(c(c1)Cl)COCc2ccccc2 7a_100103146734_100000211182 [0,2,0,0,0,0|1,0,0]=3 17483 B18R2.4060 Clc1cnc(c(c1)Cl)COCc2ccccn2 34a_100103146734_100000721315 [0,2,0,0,0,0|2,0,0]=4 17484 B18R2.4060 Clc1cnc(c(c1)Cl)COCc2ccccn2 7a_100103146734_100000721315 [0,2,0,0,0,0|2,0,0]=4 17485 B18R2.4060 Clc1cnc(c(c1)Cl)COCc2cccnc2 34a_100103146734_100000733263 [0,2,0,0,0,0|2,0,0]=4 17486 B18R2.4060 Clc1cnc(c(c1)Cl)COCc2cccnc2 7a_100103146734_100000741622 [0,2,0,0,0,0|2,0,0]=4 17487 B18R2.4060 Clc1cnc(c(c1)Cl)COCc2ccncc2 7a_100103146734_100015193705 [0,2,0,0,0,0|2,0,0]=4 17488 B18R2.4060 Clc1ncc(c(n1)Cl)COCc2ccccc2 34a_100000210790_100000071240 [0,2,0,0,0,0|2,0,0]=4 17489 B18R2.4060 Clc1ncc(c(n1)Cl)COCc2ccccc2 34a_200009828795_100015291786 [0,2,0,0,0,0|2,0,0]=4 17490 B18R2.4060 Clc1ncc(c(n1)Cl)COCc2ccccc2 7a_100000210790_100010163647 [0,2,0,0,0,0|2,0,0]=4 17491 B18R2.4060 Clc1ncc(c(n1)Cl)COCc2ccccc2 7a_200009828795_100000211182 [0,2,0,0,0,0|2,0,0]=4 17492 B18R2.4060 Fc1cc(ccc1C=CCc2ccccc2)Br 271570a_200016263579_100009814013 [0,2,0,0,0,0|1,0,1]=4 17493 B18R2.4060 Fc1cc(ccc1C=CCc2ccccc2)Cl 271570a_200016263579_100011216042 [0,2,0,0,0,0|1,0,1]=4 17494 B18R2.4060 Fc1cc(ccc1CNCc2ccccc2)Br 207a_100000754580_100015611070 [0,2,0,0,0,0|1,0,0]=3 17495 B18R2.4060 Fc1cc(ccc1CNCc2ccccc2)Br 207a_100015324214_100000211676 [0,2,0,0,0,0|1,0,0]=3 17496 B18R2.4060 Fc1cc(ccc1CNCc2ccccc2)Br 2230a_100015324214_100000211606 [0,2,0,0,0,0|1,0,0]=3 17497 B18R2.4060 Fc1cc(ccc1CNCc2ccccc2)Br 270004a_100000754580_100015611070 [0,2,0,0,0,0|1,0,0]=3 17498 B18R2.4060 Fc1cc(ccc1CNCc2ccccc2)Br 270004a_100015324214_100000211676 [0,2,0,0,0,0|1,0,0]=3 17499 B18R2.4060 Fc1cc(ccc1CNCc2ccccc2)Br 34a_100000754580_100015291786 [0,2,0,0,0,0|1,0,0]=3 17500 B18R2.4060 Fc1cc(ccc1CNCc2ccccc2)Br 34a_100015324214_100000211606 [0,2,0,0,0,0|1,0,0]=3 17501 B18R2.4060 Fc1cc(ccc1CNCc2ccccc2)Cl 207a_100000708496_100015611070 [0,2,0,0,0,0|1,0,0]=3 17502 B18R2.4060 Fc1cc(ccc1CNCc2ccccc2)Cl 207a_100015324214_100000697372 [0,2,0,0,0,0|1,0,0]=3 17503 B18R2.4060 Fc1cc(ccc1CNCc2ccccc2)Cl 2230a_100015324214_100000709361 [0,2,0,0,0,0|1,0,0]=3 17504 B18R2.4060 Fc1cc(ccc1CNCc2ccccc2)Cl 270004a_100000708496_100015611070 [0,2,0,0,0,0|1,0,0]=3 17505 B18R2.4060 Fc1cc(ccc1CNCc2ccccc2)Cl 270004a_100015324214_100000697372 [0,2,0,0,0,0|1,0,0]=3 17506 B18R2.4060 Fc1cc(ccc1CNCc2ccccc2)Cl 34a_100000708496_100015291786 [0,2,0,0,0,0|1,0,0]=3 17507 B18R2.4060 Fc1cc(ccc1CNCc2ccccc2)Cl 34a_100015324214_100000709361 [0,2,0,0,0,0|1,0,0]=3 17508 B18R2.4060 Fc1cc(ccc1CNCc2ccccc2)I 207a_100015324214_100000050965 [0,2,0,0,0,0|1,0,0]=3 17509 B18R2.4060 Fc1cc(ccc1CNCc2ccccc2)I 2230a_100015324214_100010244991 [0,2,0,0,0,0|1,0,0]=3 17510 B18R2.4060 Fc1cc(ccc1CNCc2ccccc2)I 34a_100015324214_100010244991 [0,2,0,0,0,0|1,0,0]=3 17511 B18R2.4060 Fc1cc(ccc1CNCc2ccccn2)Br 207a_100000754580_100000209966 [0,2,0,0,0,0|2,0,0]=4 17512 B18R2.4060 Fc1cc(ccc1CNCc2ccccn2)Br 270004a_100000210449_100000211676 [0,2,0,0,0,0|2,0,0]=4 17513 B18R2.4060 Fc1cc(ccc1CNCc2ccccn2)Br 270004a_100000754580_100000209966 [0,2,0,0,0,0|2,0,0]=4 17514 B18R2.4060 Fc1cc(ccc1CNCc2ccccn2)Br 34a_100000754580_100000721315 [0,2,0,0,0,0|2,0,0]=4 17515 B18R2.4060 Fc1cc(ccc1CNCc2ccccn2)Cl 207a_100000708496_100000209966 [0,2,0,0,0,0|2,0,0]=4 17516 B18R2.4060 Fc1cc(ccc1CNCc2ccccn2)Cl 270004a_100000210449_100000697372 [0,2,0,0,0,0|2,0,0]=4 17517 B18R2.4060 Fc1cc(ccc1CNCc2ccccn2)Cl 270004a_100000708496_100000209966 [0,2,0,0,0,0|2,0,0]=4 17518 B18R2.4060 Fc1cc(ccc1CNCc2ccccn2)Cl 34a_100000708496_100000721315 [0,2,0,0,0,0|2,0,0]=4 17519 B18R2.4060 Fc1cc(ccc1CNCc2cccnc2)Br 207a_100000210453_100000211676 [0,2,0,0,0,0|2,0,0]=4 17520 B18R2.4060 Fc1cc(ccc1CNCc2cccnc2)Br 207a_100000754580_100000209961 [0,2,0,0,0,0|2,0,0]=4 17521 B18R2.4060 Fc1cc(ccc1CNCc2cccnc2)Br 270004a_100000210453_100000211676 [0,2,0,0,0,0|2,0,0]=4 17522 B18R2.4060 Fc1cc(ccc1CNCc2cccnc2)Br 270004a_100000754580_100000209961 [0,2,0,0,0,0|2,0,0]=4 17523 B18R2.4060 Fc1cc(ccc1CNCc2cccnc2)Br 34a_100000754580_100000733263 [0,2,0,0,0,0|2,0,0]=4 17524 B18R2.4060 Fc1cc(ccc1CNCc2cccnc2)Cl 207a_100000210453_100000697372 [0,2,0,0,0,0|2,0,0]=4 17525 B18R2.4060 Fc1cc(ccc1CNCc2cccnc2)Cl 207a_100000708496_100000209961 [0,2,0,0,0,0|2,0,0]=4 17526 B18R2.4060 Fc1cc(ccc1CNCc2cccnc2)Cl 270004a_100000210453_100000697372 [0,2,0,0,0,0|2,0,0]=4 17527 B18R2.4060 Fc1cc(ccc1CNCc2cccnc2)Cl 270004a_100000708496_100000209961 [0,2,0,0,0,0|2,0,0]=4 17528 B18R2.4060 Fc1cc(ccc1CNCc2cccnc2)Cl 34a_100000708496_100000733263 [0,2,0,0,0,0|2,0,0]=4 17529 B18R2.4060 Fc1cc(ccc1CNCc2cccnc2)I 207a_100000210453_100000050965 [0,2,0,0,0,0|2,0,0]=4 17530 B18R2.4060 Fc1cc(ccc1CNCc2ccncc2)Br 207a_100000754580_100000186114 [0,2,0,0,0,0|2,0,0]=4 17531 B18R2.4060 Fc1cc(ccc1CNCc2ccncc2)Cl 207a_100000708496_100000186114 [0,2,0,0,0,0|2,0,0]=4 17532 B18R2.4060 Fc1cc(ccc1COCc2ccccc2)Br 34a_100000210790_100000211606 [0,2,0,0,0,0|0,0,0]=2 17533 B18R2.4060 Fc1cc(ccc1COCc2ccccc2)Br 34a_100011191541_100015291786 [0,2,0,0,0,0|0,0,0]=2 17534 B18R2.4060 Fc1cc(ccc1COCc2ccccc2)Br 7a_100000210790_100000211606 [0,2,0,0,0,0|0,0,0]=2 17535 B18R2.4060 Fc1cc(ccc1COCc2ccccc2)Br 7a_100011191541_100000211182 [0,2,0,0,0,0|0,0,0]=2 17536 B18R2.4060 Fc1cc(ccc1COCc2ccccc2)Cl 34a_100000210790_100000709361 [0,2,0,0,0,0|0,0,0]=2 17537 B18R2.4060 Fc1cc(ccc1COCc2ccccc2)Cl 34a_100011217562_100015291786 [0,2,0,0,0,0|0,0,0]=2 17538 B18R2.4060 Fc1cc(ccc1COCc2ccccc2)Cl 7a_100000210790_100000709361 [0,2,0,0,0,0|0,0,0]=2 17539 B18R2.4060 Fc1cc(ccc1COCc2ccccc2)Cl 7a_100011217562_100000211182 [0,2,0,0,0,0|0,0,0]=2 17540 B18R2.4060 Fc1cc(ccc1COCc2ccccc2)I 34a_100000210790_100010244991 [0,2,0,0,0,0|0,0,0]=2 17541 B18R2.4060 Fc1cc(ccc1COCc2ccccc2)I 34a_200010202041_100015291786 [0,2,0,0,0,0|0,0,0]=2 17542 B18R2.4060 Fc1cc(ccc1COCc2ccccc2)I 7a_100000210790_100010244991 [0,2,0,0,0,0|0,0,0]=2 17543 B18R2.4060 Fc1cc(ccc1COCc2ccccc2)I 7a_200010202041_100000211182 [0,2,0,0,0,0|0,0,0]=2 17544 B18R2.4060 Fc1cc(ccc1COCc2ccccn2)Br 34a_100011191541_100000721315 [0,2,0,0,0,0|1,0,0]=3 17545 B18R2.4060 Fc1cc(ccc1COCc2ccccn2)Br 7a_100011191541_100000721315 [0,2,0,0,0,0|1,0,0]=3 17546 B18R2.4060 Fc1cc(ccc1COCc2ccccn2)Cl 34a_100011217562_100000721315 [0,2,0,0,0,0|1,0,0]=3 17547 B18R2.4060 Fc1cc(ccc1COCc2ccccn2)Cl 7a_100011217562_100000721315 [0,2,0,0,0,0|1,0,0]=3 17548 B18R2.4060 Fc1cc(ccc1COCc2ccccn2)I 34a_200010202041_100000721315 [0,2,0,0,0,0|1,0,0]=3 17549 B18R2.4060 Fc1cc(ccc1COCc2ccccn2)I 7a_200010202041_100000721315 [0,2,0,0,0,0|1,0,0]=3 17550 B18R2.4060 Fc1cc(ccc1COCc2cccnc2)Br 34a_100011191541_100000733263 [0,2,0,0,0,0|1,0,0]=3 17551 B18R2.4060 Fc1cc(ccc1COCc2cccnc2)Br 7a_100011191541_100000741622 [0,2,0,0,0,0|1,0,0]=3 17552 B18R2.4060 Fc1cc(ccc1COCc2cccnc2)Cl 34a_100011217562_100000733263 [0,2,0,0,0,0|1,0,0]=3 17553 B18R2.4060 Fc1cc(ccc1COCc2cccnc2)Cl 7a_100011217562_100000741622 [0,2,0,0,0,0|1,0,0]=3 17554 B18R2.4060 Fc1cc(ccc1COCc2cccnc2)I 34a_200010202041_100000733263 [0,2,0,0,0,0|1,0,0]=3 17555 B18R2.4060 Fc1cc(ccc1COCc2cccnc2)I 7a_200010202041_100000741622 [0,2,0,0,0,0|1,0,0]=3 17556 B18R2.4060 Fc1cc(ccc1COCc2cccnn2)Br 34a_100011191541_100016990269 [0,2,0,0,0,0|2,0,0]=4 17557 B18R2.4060 Fc1cc(ccc1COCc2cccnn2)Br 7a_100011191541_100016990269 [0,2,0,0,0,0|2,0,0]=4 17558 B18R2.4060 Fc1cc(ccc1COCc2cccnn2)Cl 34a_100011217562_100016990269 [0,2,0,0,0,0|2,0,0]=4 17559 B18R2.4060 Fc1cc(ccc1COCc2cccnn2)Cl 7a_100011217562_100016990269 [0,2,0,0,0,0|2,0,0]=4 17560 B18R2.4060 Fc1cc(ccc1COCc2cccnn2)I 34a_200010202041_100016990269 [0,2,0,0,0,0|2,0,0]=4 17561 B18R2.4060 Fc1cc(ccc1COCc2cccnn2)I 7a_200010202041_100016990269 [0,2,0,0,0,0|2,0,0]=4 17562 B18R2.4060 Fc1cc(ccc1COCc2ccncc2)Br 7a_100011191541_100015193705 [0,2,0,0,0,0|1,0,0]=3 17563 B18R2.4060 Fc1cc(ccc1COCc2ccncc2)Cl 7a_100011217562_100015193705 [0,2,0,0,0,0|1,0,0]=3 17564 B18R2.4060 Fc1cc(ccc1COCc2ccncc2)I 7a_200010202041_100015193705 [0,2,0,0,0,0|1,0,0]=3 17565 B18R2.4060 Fc1cc(ccc1COCc2cnccn2)Br 34a_100011191541_100016995436 [0,2,0,0,0,0|2,0,0]=4 17566 B18R2.4060 Fc1cc(ccc1COCc2cnccn2)Br 7a_100011191541_100016995436 [0,2,0,0,0,0|2,0,0]=4 17567 B18R2.4060 Fc1cc(ccc1COCc2cnccn2)Cl 34a_100011217562_100016995436 [0,2,0,0,0,0|2,0,0]=4 17568 B18R2.4060 Fc1cc(ccc1COCc2cnccn2)Cl 7a_100011217562_100016995436 [0,2,0,0,0,0|2,0,0]=4 17569 B18R2.4060 Fc1cc(ccc1COCc2cnccn2)I 34a_200010202041_100016995436 [0,2,0,0,0,0|2,0,0]=4 17570 B18R2.4060 Fc1cc(ccc1COCc2cnccn2)I 7a_200010202041_100016995436 [0,2,0,0,0,0|2,0,0]=4 17571 B18R2.4060 Fc1cc(ccc1COCc2cncnc2)Br 34a_100011191541_100015196519 [0,2,0,0,0,0|2,0,0]=4 17572 B18R2.4060 Fc1cc(ccc1COCc2cncnc2)Br 7a_100011191541_100015196519 [0,2,0,0,0,0|2,0,0]=4 17573 B18R2.4060 Fc1cc(ccc1COCc2cncnc2)Cl 34a_100011217562_100015196519 [0,2,0,0,0,0|2,0,0]=4 17574 B18R2.4060 Fc1cc(ccc1COCc2cncnc2)Cl 7a_100011217562_100015196519 [0,2,0,0,0,0|2,0,0]=4 17575 B18R2.4060 Fc1cc(ccc1COCc2cncnc2)I 34a_200010202041_100015196519 [0,2,0,0,0,0|2,0,0]=4 17576 B18R2.4060 Fc1cc(ccc1COCc2cncnc2)I 7a_200010202041_100015196519 [0,2,0,0,0,0|2,0,0]=4 17577 B18R2.4060 Fc1cc(ccc1COCc2ncccn2)Br 34a_100011191541_100000703007 [0,2,0,0,0,0|2,0,0]=4 17578 B18R2.4060 Fc1cc(ccc1COCc2ncccn2)Br 7a_100011191541_100000703007 [0,2,0,0,0,0|2,0,0]=4 17579 B18R2.4060 Fc1cc(ccc1COCc2ncccn2)Cl 34a_100011217562_100000703007 [0,2,0,0,0,0|2,0,0]=4 17580 B18R2.4060 Fc1cc(ccc1COCc2ncccn2)Cl 7a_100011217562_100000703007 [0,2,0,0,0,0|2,0,0]=4 17581 B18R2.4060 Fc1cc(ccc1COCc2ncccn2)I 34a_200010202041_100000703007 [0,2,0,0,0,0|2,0,0]=4 17582 B18R2.4060 Fc1cc(ccc1COCc2ncccn2)I 7a_200010202041_100000703007 [0,2,0,0,0,0|2,0,0]=4 17583 B18R2.4060 Fc1cc(ccc1CSCc2ccccc2)Br 62a_100000211182_100000211606 [0,2,0,0,0,0|0,1,0]=3 17584 B18R2.4060 Fc1cc(ccc1CSCc2ccccc2)Br 62a_100000211606_100015291786 [0,2,0,0,0,0|0,1,0]=3 17585 B18R2.4060 Fc1cc(ccc1CSCc2ccccc2)Cl 62a_100000211182_100000709361 [0,2,0,0,0,0|0,1,0]=3 17586 B18R2.4060 Fc1cc(ccc1CSCc2ccccc2)Cl 62a_100000709361_100015291786 [0,2,0,0,0,0|0,1,0]=3 17587 B18R2.4060 Fc1cc(ccc1CSCc2ccccc2)I 62a_100000211182_100010244991 [0,2,0,0,0,0|0,1,0]=3 17588 B18R2.4060 Fc1cc(ccc1CSCc2ccccc2)I 62a_100010244991_100015291786 [0,2,0,0,0,0|0,1,0]=3 17589 B18R2.4060 Fc1cc(ccc1CSCc2ccccn2)Br 62a_100000211606_100000721315 [0,2,0,0,0,0|1,1,0]=4 17590 B18R2.4060 Fc1cc(ccc1CSCc2ccccn2)Br 62a_100000721315_100000211606 [0,2,0,0,0,0|1,1,0]=4 17591 B18R2.4060 Fc1cc(ccc1CSCc2ccccn2)Cl 62a_100000709361_100000721315 [0,2,0,0,0,0|1,1,0]=4 17592 B18R2.4060 Fc1cc(ccc1CSCc2ccccn2)Cl 62a_100000721315_100000709361 [0,2,0,0,0,0|1,1,0]=4 17593 B18R2.4060 Fc1cc(ccc1CSCc2ccccn2)I 62a_100000721315_100010244991 [0,2,0,0,0,0|1,1,0]=4 17594 B18R2.4060 Fc1cc(ccc1CSCc2ccccn2)I 62a_100010244991_100000721315 [0,2,0,0,0,0|1,1,0]=4 17595 B18R2.4060 Fc1cc(ccc1CSCc2cccnc2)Br 62a_100000211606_100000741622 [0,2,0,0,0,0|1,1,0]=4 17596 B18R2.4060 Fc1cc(ccc1CSCc2cccnc2)Br 62a_100000741622_100000211606 [0,2,0,0,0,0|1,1,0]=4 17597 B18R2.4060 Fc1cc(ccc1CSCc2cccnc2)Cl 62a_100000709361_100000741622 [0,2,0,0,0,0|1,1,0]=4 17598 B18R2.4060 Fc1cc(ccc1CSCc2cccnc2)Cl 62a_100000741622_100000709361 [0,2,0,0,0,0|1,1,0]=4 17599 B18R2.4060 Fc1cc(ccc1CSCc2cccnc2)I 62a_100000741622_100010244991 [0,2,0,0,0,0|1,1,0]=4 17600 B18R2.4060 Fc1cc(ccc1CSCc2cccnc2)I 62a_100010244991_100000741622 [0,2,0,0,0,0|1,1,0]=4 17601 B18R2.4060 Fc1cc(ccc1CSCc2ccncc2)Br 62a_100000211606_100015193705 [0,2,0,0,0,0|1,1,0]=4 17602 B18R2.4060 Fc1cc(ccc1CSCc2ccncc2)Br 62a_100015193705_100000211606 [0,2,0,0,0,0|1,1,0]=4 17603 B18R2.4060 Fc1cc(ccc1CSCc2ccncc2)Cl 62a_100000709361_100015193705 [0,2,0,0,0,0|1,1,0]=4 17604 B18R2.4060 Fc1cc(ccc1CSCc2ccncc2)Cl 62a_100015193705_100000709361 [0,2,0,0,0,0|1,1,0]=4 17605 B18R2.4060 Fc1cc(ccc1CSCc2ccncc2)I 62a_100010244991_100015193705 [0,2,0,0,0,0|1,1,0]=4 17606 B18R2.4060 Fc1cc(ccc1CSCc2ccncc2)I 62a_100015193705_100010244991 [0,2,0,0,0,0|1,1,0]=4 17607 B18R2.4060 Fc1cc(ccc1NCCc2ccccc2)Br 34a_100000210722_100000765856 [0,2,0,0,0,0|2,0,0]=4 17608 B18R2.4060 Fc1cc(ccc1NCCc2ccccc2)Cl 34a_100000211020_100000765856 [0,2,0,0,0,0|2,0,0]=4 17609 B18R2.4060 Fc1cc(ccc1NCCc2ccccc2)I 34a_100011215594_100000765856 [0,2,0,0,0,0|2,0,0]=4 17610 B18R2.4060 Fc1cc(ccc1OCCc2ccccc2)Br 34a_100000185481_100000765856 [0,2,0,0,0,0|2,0,0]=4 17611 B18R2.4060 Fc1cc(ccc1OCCc2ccccc2)Br 7a_100000185481_100000765856 [0,2,0,0,0,0|2,0,0]=4 17612 B18R2.4060 Fc1cc(ccc1OCCc2ccccc2)Cl 34a_100000230166_100000765856 [0,2,0,0,0,0|2,0,0]=4 17613 B18R2.4060 Fc1cc(ccc1OCCc2ccccc2)Cl 7a_100000230166_100000765856 [0,2,0,0,0,0|2,0,0]=4 17614 B18R2.4060 Fc1cc(ccc1OCCc2ccccc2)I 34a_100011356965_100000765856 [0,2,0,0,0,0|2,0,0]=4 17615 B18R2.4060 Fc1cc(ccc1OCCc2ccccc2)I 7a_100011356965_100000765856 [0,2,0,0,0,0|2,0,0]=4 17616 B18R2.4060 Fc1cc(ccc1SCCc2ccccc2)Br 62a_100000765856_100009814013 [0,2,0,0,0,0|2,0,0]=4 17617 B18R2.4060 Fc1cc(ccc1SCCc2ccccc2)Br 62a_100009814013_100011218657 [0,2,0,0,0,0|2,0,0]=4 17618 B18R2.4060 Fc1cc(ccc1SCCc2ccccc2)Cl 62a_100000765856_100011216042 [0,2,0,0,0,0|2,0,0]=4 17619 B18R2.4060 Fc1cc(ccc1SCCc2ccccc2)Cl 62a_100011216042_100011218657 [0,2,0,0,0,0|2,0,0]=4 17620 B18R2.4060 Fc1cc(cnc1CNCc2ccccc2)Br 207a_100015324214_100010180630 [0,2,0,0,0,0|2,0,0]=4 17621 B18R2.4060 Fc1cc(cnc1CNCc2ccccc2)Br 270004a_100015188786_100015611070 [0,2,0,0,0,0|2,0,0]=4 17622 B18R2.4060 Fc1cc(cnc1CNCc2ccccc2)Br 270004a_100015324214_100010180630 [0,2,0,0,0,0|2,0,0]=4 17623 B18R2.4060 Fc1cc(cnc1CNCc2ccccc2)Br 34a_100015188786_100015291786 [0,2,0,0,0,0|2,0,0]=4 17624 B18R2.4060 Fc1cc(cnc1CNCc2ccccc2)Cl 207a_100015324214_100009858488 [0,2,0,0,0,0|2,0,0]=4 17625 B18R2.4060 Fc1cc(cnc1CNCc2ccccc2)Cl 2230a_100015324214_200009879301 [0,2,0,0,0,0|2,0,0]=4 17626 B18R2.4060 Fc1cc(cnc1CNCc2ccccc2)Cl 270004a_100015324214_100009858488 [0,2,0,0,0,0|2,0,0]=4 17627 B18R2.4060 Fc1cc(cnc1CNCc2ccccc2)Cl 34a_100015324214_200009879301 [0,2,0,0,0,0|2,0,0]=4 17628 B18R2.4060 Fc1cc(cnc1COCc2ccccc2)Br 34a_100010065252_100015291786 [0,2,0,0,0,0|1,0,0]=3 17629 B18R2.4060 Fc1cc(cnc1COCc2ccccc2)Br 7a_100010065252_100000211182 [0,2,0,0,0,0|1,0,0]=3 17630 B18R2.4060 Fc1cc(cnc1COCc2ccccc2)Cl 34a_100000210790_200009879301 [0,2,0,0,0,0|1,0,0]=3 17631 B18R2.4060 Fc1cc(cnc1COCc2ccccc2)Cl 34a_100009885607_100015291786 [0,2,0,0,0,0|1,0,0]=3 17632 B18R2.4060 Fc1cc(cnc1COCc2ccccc2)Cl 7a_100000210790_200009879301 [0,2,0,0,0,0|1,0,0]=3 17633 B18R2.4060 Fc1cc(cnc1COCc2ccccc2)Cl 7a_100009885607_100000211182 [0,2,0,0,0,0|1,0,0]=3 17634 B18R2.4060 Fc1cc(cnc1COCc2ccccn2)Br 34a_100010065252_100000721315 [0,2,0,0,0,0|2,0,0]=4 17635 B18R2.4060 Fc1cc(cnc1COCc2ccccn2)Br 7a_100010065252_100000721315 [0,2,0,0,0,0|2,0,0]=4 17636 B18R2.4060 Fc1cc(cnc1COCc2ccccn2)Cl 34a_100009885607_100000721315 [0,2,0,0,0,0|2,0,0]=4 17637 B18R2.4060 Fc1cc(cnc1COCc2ccccn2)Cl 7a_100009885607_100000721315 [0,2,0,0,0,0|2,0,0]=4 17638 B18R2.4060 Fc1cc(cnc1COCc2cccnc2)Br 34a_100010065252_100000733263 [0,2,0,0,0,0|2,0,0]=4 17639 B18R2.4060 Fc1cc(cnc1COCc2cccnc2)Br 7a_100010065252_100000741622 [0,2,0,0,0,0|2,0,0]=4 17640 B18R2.4060 Fc1cc(cnc1COCc2cccnc2)Cl 34a_100009885607_100000733263 [0,2,0,0,0,0|2,0,0]=4 17641 B18R2.4060 Fc1cc(cnc1COCc2cccnc2)Cl 7a_100009885607_100000741622 [0,2,0,0,0,0|2,0,0]=4 17642 B18R2.4060 Fc1cc(cnc1COCc2ccncc2)Br 7a_100010065252_100015193705 [0,2,0,0,0,0|2,0,0]=4 17643 B18R2.4060 Fc1cc(cnc1COCc2ccncc2)Cl 7a_100009885607_100015193705 [0,2,0,0,0,0|2,0,0]=4 17644 B18R2.4060 Fc1cc(cnc1CSCc2ccccc2)Cl 62a_100000211182_200009879301 [0,2,0,0,0,0|1,1,0]=4 17645 B18R2.4060 Fc1cc(cnc1CSCc2ccccc2)Cl 62a_200009879301_100015291786 [0,2,0,0,0,0|1,1,0]=4 17646 B18R2.4060 Fc1ccc(c(c1)Br)C=CCc2ccccc2 271570a_200016263579_100011217111 [0,2,0,0,0,0|1,0,1]=4 17647 B18R2.4060 Fc1ccc(c(c1)Br)CNCc2ccccc2 207a_100000708791_100015611070 [0,2,0,0,0,0|1,0,0]=3 17648 B18R2.4060 Fc1ccc(c(c1)Br)CNCc2ccccc2 207a_100015324214_100000685661 [0,2,0,0,0,0|1,0,0]=3 17649 B18R2.4060 Fc1ccc(c(c1)Br)CNCc2ccccc2 2230a_100015324214_100000243222 [0,2,0,0,0,0|1,0,0]=3 17650 B18R2.4060 Fc1ccc(c(c1)Br)CNCc2ccccc2 270004a_100000708791_100015611070 [0,2,0,0,0,0|1,0,0]=3 17651 B18R2.4060 Fc1ccc(c(c1)Br)CNCc2ccccc2 270004a_100015324214_100000685661 [0,2,0,0,0,0|1,0,0]=3 17652 B18R2.4060 Fc1ccc(c(c1)Br)CNCc2ccccc2 34a_100000708791_100015291786 [0,2,0,0,0,0|1,0,0]=3 17653 B18R2.4060 Fc1ccc(c(c1)Br)CNCc2ccccc2 34a_100015324214_100000243222 [0,2,0,0,0,0|1,0,0]=3 17654 B18R2.4060 Fc1ccc(c(c1)Br)CNCc2ccccn2 207a_100000708791_100000209966 [0,2,0,0,0,0|2,0,0]=4 17655 B18R2.4060 Fc1ccc(c(c1)Br)CNCc2ccccn2 270004a_100000210449_100000685661 [0,2,0,0,0,0|2,0,0]=4 17656 B18R2.4060 Fc1ccc(c(c1)Br)CNCc2ccccn2 270004a_100000708791_100000209966 [0,2,0,0,0,0|2,0,0]=4 17657 B18R2.4060 Fc1ccc(c(c1)Br)CNCc2ccccn2 34a_100000708791_100000721315 [0,2,0,0,0,0|2,0,0]=4 17658 B18R2.4060 Fc1ccc(c(c1)Br)CNCc2cccnc2 207a_100000210453_100000685661 [0,2,0,0,0,0|2,0,0]=4 17659 B18R2.4060 Fc1ccc(c(c1)Br)CNCc2cccnc2 207a_100000708791_100000209961 [0,2,0,0,0,0|2,0,0]=4 17660 B18R2.4060 Fc1ccc(c(c1)Br)CNCc2cccnc2 270004a_100000210453_100000685661 [0,2,0,0,0,0|2,0,0]=4 17661 B18R2.4060 Fc1ccc(c(c1)Br)CNCc2cccnc2 270004a_100000708791_100000209961 [0,2,0,0,0,0|2,0,0]=4 17662 B18R2.4060 Fc1ccc(c(c1)Br)CNCc2cccnc2 34a_100000708791_100000733263 [0,2,0,0,0,0|2,0,0]=4 17663 B18R2.4060 Fc1ccc(c(c1)Br)CNCc2ccncc2 207a_100000708791_100000186114 [0,2,0,0,0,0|2,0,0]=4 17664 B18R2.4060 Fc1ccc(c(c1)Br)COCc2ccccc2 34a_100000210790_100000243222 [0,2,0,0,0,0|0,0,0]=2 17665 B18R2.4060 Fc1ccc(c(c1)Br)COCc2ccccc2 34a_100000744086_100015291786 [0,2,0,0,0,0|0,0,0]=2 17666 B18R2.4060 Fc1ccc(c(c1)Br)COCc2ccccc2 7a_100000210790_100000243222 [0,2,0,0,0,0|0,0,0]=2 17667 B18R2.4060 Fc1ccc(c(c1)Br)COCc2ccccc2 7a_100000744086_100000211182 [0,2,0,0,0,0|0,0,0]=2 17668 B18R2.4060 Fc1ccc(c(c1)Br)COCc2ccccn2 34a_100000744086_100000721315 [0,2,0,0,0,0|1,0,0]=3 17669 B18R2.4060 Fc1ccc(c(c1)Br)COCc2ccccn2 7a_100000744086_100000721315 [0,2,0,0,0,0|1,0,0]=3 17670 B18R2.4060 Fc1ccc(c(c1)Br)COCc2cccnc2 34a_100000744086_100000733263 [0,2,0,0,0,0|1,0,0]=3 17671 B18R2.4060 Fc1ccc(c(c1)Br)COCc2cccnc2 7a_100000744086_100000741622 [0,2,0,0,0,0|1,0,0]=3 17672 B18R2.4060 Fc1ccc(c(c1)Br)COCc2cccnn2 34a_100000744086_100016990269 [0,2,0,0,0,0|2,0,0]=4 17673 B18R2.4060 Fc1ccc(c(c1)Br)COCc2cccnn2 7a_100000744086_100016990269 [0,2,0,0,0,0|2,0,0]=4 17674 B18R2.4060 Fc1ccc(c(c1)Br)COCc2ccncc2 7a_100000744086_100015193705 [0,2,0,0,0,0|1,0,0]=3 17675 B18R2.4060 Fc1ccc(c(c1)Br)COCc2cnccn2 34a_100000744086_100016995436 [0,2,0,0,0,0|2,0,0]=4 17676 B18R2.4060 Fc1ccc(c(c1)Br)COCc2cnccn2 7a_100000744086_100016995436 [0,2,0,0,0,0|2,0,0]=4 17677 B18R2.4060 Fc1ccc(c(c1)Br)COCc2cncnc2 34a_100000744086_100015196519 [0,2,0,0,0,0|2,0,0]=4 17678 B18R2.4060 Fc1ccc(c(c1)Br)COCc2cncnc2 7a_100000744086_100015196519 [0,2,0,0,0,0|2,0,0]=4 17679 B18R2.4060 Fc1ccc(c(c1)Br)COCc2ncccn2 34a_100000744086_100000703007 [0,2,0,0,0,0|2,0,0]=4 17680 B18R2.4060 Fc1ccc(c(c1)Br)COCc2ncccn2 7a_100000744086_100000703007 [0,2,0,0,0,0|2,0,0]=4 17681 B18R2.4060 Fc1ccc(c(c1)Br)CSCc2ccccc2 62a_100000211182_100000243222 [0,2,0,0,0,0|0,1,0]=3 17682 B18R2.4060 Fc1ccc(c(c1)Br)CSCc2ccccc2 62a_100000243222_100015291786 [0,2,0,0,0,0|0,1,0]=3 17683 B18R2.4060 Fc1ccc(c(c1)Br)CSCc2ccccn2 62a_100000243222_100000721315 [0,2,0,0,0,0|1,1,0]=4 17684 B18R2.4060 Fc1ccc(c(c1)Br)CSCc2ccccn2 62a_100000721315_100000243222 [0,2,0,0,0,0|1,1,0]=4 17685 B18R2.4060 Fc1ccc(c(c1)Br)CSCc2cccnc2 62a_100000243222_100000741622 [0,2,0,0,0,0|1,1,0]=4 17686 B18R2.4060 Fc1ccc(c(c1)Br)CSCc2cccnc2 62a_100000741622_100000243222 [0,2,0,0,0,0|1,1,0]=4 17687 B18R2.4060 Fc1ccc(c(c1)Br)CSCc2ccncc2 62a_100000243222_100015193705 [0,2,0,0,0,0|1,1,0]=4 17688 B18R2.4060 Fc1ccc(c(c1)Br)CSCc2ccncc2 62a_100015193705_100000243222 [0,2,0,0,0,0|1,1,0]=4 17689 B18R2.4060 Fc1ccc(c(c1)Br)NCCc2ccccc2 34a_100000738039_100000765856 [0,2,0,0,0,0|2,0,0]=4 17690 B18R2.4060 Fc1ccc(c(c1)Br)OCCc2ccccc2 34a_100000211999_100000765856 [0,2,0,0,0,0|2,0,0]=4 17691 B18R2.4060 Fc1ccc(c(c1)Br)OCCc2ccccc2 7a_100000211999_100000765856 [0,2,0,0,0,0|2,0,0]=4 17692 B18R2.4060 Fc1ccc(c(c1)Br)SCCc2ccccc2 62a_100000765856_100011217111 [0,2,0,0,0,0|2,0,0]=4 17693 B18R2.4060 Fc1ccc(c(c1)Br)SCCc2ccccc2 62a_100011217111_100011218657 [0,2,0,0,0,0|2,0,0]=4 17694 B18R2.4060 Fc1ccc(c(c1)Cl)C=CCc2ccccc2 271570a_200016263579_100000733362 [0,2,0,0,0,0|1,0,1]=4 17695 B18R2.4060 Fc1ccc(c(c1)Cl)CNCc2ccccc2 207a_100000174946_100015611070 [0,2,0,0,0,0|1,0,0]=3 17696 B18R2.4060 Fc1ccc(c(c1)Cl)CNCc2ccccc2 207a_100015324214_100000752949 [0,2,0,0,0,0|1,0,0]=3 17697 B18R2.4060 Fc1ccc(c(c1)Cl)CNCc2ccccc2 2230a_100015324214_100011216360 [0,2,0,0,0,0|1,0,0]=3 17698 B18R2.4060 Fc1ccc(c(c1)Cl)CNCc2ccccc2 270004a_100000174946_100015611070 [0,2,0,0,0,0|1,0,0]=3 17699 B18R2.4060 Fc1ccc(c(c1)Cl)CNCc2ccccc2 270004a_100015324214_100000752949 [0,2,0,0,0,0|1,0,0]=3 17700 B18R2.4060 Fc1ccc(c(c1)Cl)CNCc2ccccc2 34a_100000174946_100015291786 [0,2,0,0,0,0|1,0,0]=3 17701 B18R2.4060 Fc1ccc(c(c1)Cl)CNCc2ccccc2 34a_100015324214_100011216360 [0,2,0,0,0,0|1,0,0]=3 17702 B18R2.4060 Fc1ccc(c(c1)Cl)CNCc2ccccn2 207a_100000174946_100000209966 [0,2,0,0,0,0|2,0,0]=4 17703 B18R2.4060 Fc1ccc(c(c1)Cl)CNCc2ccccn2 270004a_100000174946_100000209966 [0,2,0,0,0,0|2,0,0]=4 17704 B18R2.4060 Fc1ccc(c(c1)Cl)CNCc2ccccn2 270004a_100000210449_100000752949 [0,2,0,0,0,0|2,0,0]=4 17705 B18R2.4060 Fc1ccc(c(c1)Cl)CNCc2ccccn2 34a_100000174946_100000721315 [0,2,0,0,0,0|2,0,0]=4 17706 B18R2.4060 Fc1ccc(c(c1)Cl)CNCc2cccnc2 207a_100000174946_100000209961 [0,2,0,0,0,0|2,0,0]=4 17707 B18R2.4060 Fc1ccc(c(c1)Cl)CNCc2cccnc2 207a_100000210453_100000752949 [0,2,0,0,0,0|2,0,0]=4 17708 B18R2.4060 Fc1ccc(c(c1)Cl)CNCc2cccnc2 270004a_100000174946_100000209961 [0,2,0,0,0,0|2,0,0]=4 17709 B18R2.4060 Fc1ccc(c(c1)Cl)CNCc2cccnc2 270004a_100000210453_100000752949 [0,2,0,0,0,0|2,0,0]=4 17710 B18R2.4060 Fc1ccc(c(c1)Cl)CNCc2cccnc2 34a_100000174946_100000733263 [0,2,0,0,0,0|2,0,0]=4 17711 B18R2.4060 Fc1ccc(c(c1)Cl)CNCc2ccncc2 207a_100000174946_100000186114 [0,2,0,0,0,0|2,0,0]=4 17712 B18R2.4060 Fc1ccc(c(c1)Cl)COCc2ccccc2 34a_100000210790_100011216360 [0,2,0,0,0,0|0,0,0]=2 17713 B18R2.4060 Fc1ccc(c(c1)Cl)COCc2ccccc2 34a_100011219954_100015291786 [0,2,0,0,0,0|0,0,0]=2 17714 B18R2.4060 Fc1ccc(c(c1)Cl)COCc2ccccc2 7a_100000210790_100011216360 [0,2,0,0,0,0|0,0,0]=2 17715 B18R2.4060 Fc1ccc(c(c1)Cl)COCc2ccccc2 7a_100011219954_100000211182 [0,2,0,0,0,0|0,0,0]=2 17716 B18R2.4060 Fc1ccc(c(c1)Cl)COCc2ccccn2 34a_100011219954_100000721315 [0,2,0,0,0,0|1,0,0]=3 17717 B18R2.4060 Fc1ccc(c(c1)Cl)COCc2ccccn2 7a_100011219954_100000721315 [0,2,0,0,0,0|1,0,0]=3 17718 B18R2.4060 Fc1ccc(c(c1)Cl)COCc2cccnc2 34a_100011219954_100000733263 [0,2,0,0,0,0|1,0,0]=3 17719 B18R2.4060 Fc1ccc(c(c1)Cl)COCc2cccnc2 7a_100011219954_100000741622 [0,2,0,0,0,0|1,0,0]=3 17720 B18R2.4060 Fc1ccc(c(c1)Cl)COCc2cccnn2 34a_100011219954_100016990269 [0,2,0,0,0,0|2,0,0]=4 17721 B18R2.4060 Fc1ccc(c(c1)Cl)COCc2cccnn2 7a_100011219954_100016990269 [0,2,0,0,0,0|2,0,0]=4 17722 B18R2.4060 Fc1ccc(c(c1)Cl)COCc2ccncc2 7a_100011219954_100015193705 [0,2,0,0,0,0|1,0,0]=3 17723 B18R2.4060 Fc1ccc(c(c1)Cl)COCc2cnccn2 34a_100011219954_100016995436 [0,2,0,0,0,0|2,0,0]=4 17724 B18R2.4060 Fc1ccc(c(c1)Cl)COCc2cnccn2 7a_100011219954_100016995436 [0,2,0,0,0,0|2,0,0]=4 17725 B18R2.4060 Fc1ccc(c(c1)Cl)COCc2cncnc2 34a_100011219954_100015196519 [0,2,0,0,0,0|2,0,0]=4 17726 B18R2.4060 Fc1ccc(c(c1)Cl)COCc2cncnc2 7a_100011219954_100015196519 [0,2,0,0,0,0|2,0,0]=4 17727 B18R2.4060 Fc1ccc(c(c1)Cl)COCc2ncccn2 34a_100011219954_100000703007 [0,2,0,0,0,0|2,0,0]=4 17728 B18R2.4060 Fc1ccc(c(c1)Cl)COCc2ncccn2 7a_100011219954_100000703007 [0,2,0,0,0,0|2,0,0]=4 17729 B18R2.4060 Fc1ccc(c(c1)Cl)CSCc2ccccc2 62a_100000187853_100015291786 [0,2,0,0,0,0|0,1,0]=3 17730 B18R2.4060 Fc1ccc(c(c1)Cl)CSCc2ccccc2 62a_100000211182_100000187853 [0,2,0,0,0,0|0,1,0]=3 17731 B18R2.4060 Fc1ccc(c(c1)Cl)CSCc2ccccn2 62a_100000187853_100000721315 [0,2,0,0,0,0|1,1,0]=4 17732 B18R2.4060 Fc1ccc(c(c1)Cl)CSCc2ccccn2 62a_100000721315_100000187853 [0,2,0,0,0,0|1,1,0]=4 17733 B18R2.4060 Fc1ccc(c(c1)Cl)CSCc2cccnc2 62a_100000187853_100000741622 [0,2,0,0,0,0|1,1,0]=4 17734 B18R2.4060 Fc1ccc(c(c1)Cl)CSCc2cccnc2 62a_100000741622_100000187853 [0,2,0,0,0,0|1,1,0]=4 17735 B18R2.4060 Fc1ccc(c(c1)Cl)CSCc2ccncc2 62a_100000187853_100015193705 [0,2,0,0,0,0|1,1,0]=4 17736 B18R2.4060 Fc1ccc(c(c1)Cl)CSCc2ccncc2 62a_100015193705_100000187853 [0,2,0,0,0,0|1,1,0]=4 17737 B18R2.4060 Fc1ccc(c(c1)Cl)NCCc2ccccc2 34a_100000212003_100000765856 [0,2,0,0,0,0|2,0,0]=4 17738 B18R2.4060 Fc1ccc(c(c1)Cl)OCCc2ccccc2 34a_100000212004_100000765856 [0,2,0,0,0,0|2,0,0]=4 17739 B18R2.4060 Fc1ccc(c(c1)Cl)OCCc2ccccc2 7a_100000212004_100000765856 [0,2,0,0,0,0|2,0,0]=4 17740 B18R2.4060 Fc1ccc(c(c1)Cl)SCCc2ccccc2 62a_100000733362_100011218657 [0,2,0,0,0,0|2,0,0]=4 17741 B18R2.4060 Fc1ccc(c(c1)Cl)SCCc2ccccc2 62a_100000765856_100000733362 [0,2,0,0,0,0|2,0,0]=4 17742 B18R2.4060 Fc1ccc(c(c1)F)C=CCc2ccccc2 271570a_200016263579_100000750030 [0,2,0,0,0,0|1,0,1]=4 17743 B18R2.4060 Fc1ccc(c(c1)F)CNCc2ccccc2 207a_100000737868_100015611070 [0,2,0,0,0,0|1,0,0]=3 17744 B18R2.4060 Fc1ccc(c(c1)F)CNCc2ccccc2 207a_100015324214_100000211964 [0,2,0,0,0,0|1,0,0]=3 17745 B18R2.4060 Fc1ccc(c(c1)F)CNCc2ccccc2 2230a_100015324214_100000748237 [0,2,0,0,0,0|1,0,0]=3 17746 B18R2.4060 Fc1ccc(c(c1)F)CNCc2ccccc2 270004a_100000737868_100015611070 [0,2,0,0,0,0|1,0,0]=3 17747 B18R2.4060 Fc1ccc(c(c1)F)CNCc2ccccc2 270004a_100015324214_100000211964 [0,2,0,0,0,0|1,0,0]=3 17748 B18R2.4060 Fc1ccc(c(c1)F)CNCc2ccccc2 34a_100000737868_100015291786 [0,2,0,0,0,0|1,0,0]=3 17749 B18R2.4060 Fc1ccc(c(c1)F)CNCc2ccccc2 34a_100015324214_100000748237 [0,2,0,0,0,0|1,0,0]=3 17750 B18R2.4060 Fc1ccc(c(c1)F)CNCc2ccccn2 207a_100000737868_100000209966 [0,2,0,0,0,0|2,0,0]=4 17751 B18R2.4060 Fc1ccc(c(c1)F)CNCc2ccccn2 270004a_100000210449_100000211964 [0,2,0,0,0,0|2,0,0]=4 17752 B18R2.4060 Fc1ccc(c(c1)F)CNCc2ccccn2 270004a_100000737868_100000209966 [0,2,0,0,0,0|2,0,0]=4 17753 B18R2.4060 Fc1ccc(c(c1)F)CNCc2ccccn2 34a_100000737868_100000721315 [0,2,0,0,0,0|2,0,0]=4 17754 B18R2.4060 Fc1ccc(c(c1)F)CNCc2cccnc2 207a_100000210453_100000211964 [0,2,0,0,0,0|2,0,0]=4 17755 B18R2.4060 Fc1ccc(c(c1)F)CNCc2cccnc2 207a_100000737868_100000209961 [0,2,0,0,0,0|2,0,0]=4 17756 B18R2.4060 Fc1ccc(c(c1)F)CNCc2cccnc2 270004a_100000210453_100000211964 [0,2,0,0,0,0|2,0,0]=4 17757 B18R2.4060 Fc1ccc(c(c1)F)CNCc2cccnc2 270004a_100000737868_100000209961 [0,2,0,0,0,0|2,0,0]=4 17758 B18R2.4060 Fc1ccc(c(c1)F)CNCc2cccnc2 34a_100000737868_100000733263 [0,2,0,0,0,0|2,0,0]=4 17759 B18R2.4060 Fc1ccc(c(c1)F)CNCc2ccncc2 207a_100000737868_100000186114 [0,2,0,0,0,0|2,0,0]=4 17760 B18R2.4060 Fc1ccc(c(c1)F)COCc2ccccc2 34a_100000210790_100000748237 [0,2,0,0,0,0|0,0,0]=2 17761 B18R2.4060 Fc1ccc(c(c1)F)COCc2ccccc2 34a_100011215441_100015291786 [0,2,0,0,0,0|0,0,0]=2 17762 B18R2.4060 Fc1ccc(c(c1)F)COCc2ccccc2 7a_100000210790_100000748237 [0,2,0,0,0,0|0,0,0]=2 17763 B18R2.4060 Fc1ccc(c(c1)F)COCc2ccccc2 7a_100011215441_100000211182 [0,2,0,0,0,0|0,0,0]=2 17764 B18R2.4060 Fc1ccc(c(c1)F)COCc2ccccn2 34a_100011215441_100000721315 [0,2,0,0,0,0|1,0,0]=3 17765 B18R2.4060 Fc1ccc(c(c1)F)COCc2ccccn2 7a_100011215441_100000721315 [0,2,0,0,0,0|1,0,0]=3 17766 B18R2.4060 Fc1ccc(c(c1)F)COCc2cccnc2 34a_100011215441_100000733263 [0,2,0,0,0,0|1,0,0]=3 17767 B18R2.4060 Fc1ccc(c(c1)F)COCc2cccnc2 7a_100011215441_100000741622 [0,2,0,0,0,0|1,0,0]=3 17768 B18R2.4060 Fc1ccc(c(c1)F)COCc2cccnn2 34a_100011215441_100016990269 [0,2,0,0,0,0|2,0,0]=4 17769 B18R2.4060 Fc1ccc(c(c1)F)COCc2cccnn2 7a_100011215441_100016990269 [0,2,0,0,0,0|2,0,0]=4 17770 B18R2.4060 Fc1ccc(c(c1)F)COCc2ccncc2 7a_100011215441_100015193705 [0,2,0,0,0,0|1,0,0]=3 17771 B18R2.4060 Fc1ccc(c(c1)F)COCc2cnccn2 34a_100011215441_100016995436 [0,2,0,0,0,0|2,0,0]=4 17772 B18R2.4060 Fc1ccc(c(c1)F)COCc2cnccn2 7a_100011215441_100016995436 [0,2,0,0,0,0|2,0,0]=4 17773 B18R2.4060 Fc1ccc(c(c1)F)COCc2cncnc2 34a_100011215441_100015196519 [0,2,0,0,0,0|2,0,0]=4 17774 B18R2.4060 Fc1ccc(c(c1)F)COCc2cncnc2 7a_100011215441_100015196519 [0,2,0,0,0,0|2,0,0]=4 17775 B18R2.4060 Fc1ccc(c(c1)F)COCc2ncccn2 34a_100011215441_100000703007 [0,2,0,0,0,0|2,0,0]=4 17776 B18R2.4060 Fc1ccc(c(c1)F)COCc2ncccn2 7a_100011215441_100000703007 [0,2,0,0,0,0|2,0,0]=4 17777 B18R2.4060 Fc1ccc(c(c1)F)CSCc2ccccc2 62a_100000211182_100000748237 [0,2,0,0,0,0|0,1,0]=3 17778 B18R2.4060 Fc1ccc(c(c1)F)CSCc2ccccc2 62a_100000748237_100015291786 [0,2,0,0,0,0|0,1,0]=3 17779 B18R2.4060 Fc1ccc(c(c1)F)CSCc2ccccn2 62a_100000721315_100000748237 [0,2,0,0,0,0|1,1,0]=4 17780 B18R2.4060 Fc1ccc(c(c1)F)CSCc2ccccn2 62a_100000748237_100000721315 [0,2,0,0,0,0|1,1,0]=4 17781 B18R2.4060 Fc1ccc(c(c1)F)CSCc2cccnc2 62a_100000741622_100000748237 [0,2,0,0,0,0|1,1,0]=4 17782 B18R2.4060 Fc1ccc(c(c1)F)CSCc2cccnc2 62a_100000748237_100000741622 [0,2,0,0,0,0|1,1,0]=4 17783 B18R2.4060 Fc1ccc(c(c1)F)CSCc2ccncc2 62a_100000748237_100015193705 [0,2,0,0,0,0|1,1,0]=4 17784 B18R2.4060 Fc1ccc(c(c1)F)CSCc2ccncc2 62a_100015193705_100000748237 [0,2,0,0,0,0|1,1,0]=4 17785 B18R2.4060 Fc1ccc(c(c1)F)NCCc2ccccc2 34a_100000210720_100000765856 [0,2,0,0,0,0|2,0,0]=4 17786 B18R2.4060 Fc1ccc(c(c1)F)OCCc2ccccc2 34a_100000230127_100000765856 [0,2,0,0,0,0|2,0,0]=4 17787 B18R2.4060 Fc1ccc(c(c1)F)OCCc2ccccc2 7a_100000230127_100000765856 [0,2,0,0,0,0|2,0,0]=4 17788 B18R2.4060 Fc1ccc(c(c1)F)SCCc2ccccc2 62a_100000750030_100011218657 [0,2,0,0,0,0|2,0,0]=4 17789 B18R2.4060 Fc1ccc(c(c1)F)SCCc2ccccc2 62a_100000765856_100000750030 [0,2,0,0,0,0|2,0,0]=4 17790 B18R2.4060 Fc1ccc(c(c1)I)CNCc2ccccc2 207a_100015324214_100010254405 [0,2,0,0,0,0|1,0,0]=3 17791 B18R2.4060 Fc1ccc(c(c1)I)CNCc2ccccc2 2230a_100015324214_100012354799 [0,2,0,0,0,0|1,0,0]=3 17792 B18R2.4060 Fc1ccc(c(c1)I)CNCc2ccccc2 34a_100015324214_100012354799 [0,2,0,0,0,0|1,0,0]=3 17793 B18R2.4060 Fc1ccc(c(c1)I)CNCc2cccnc2 207a_100000210453_100010254405 [0,2,0,0,0,0|2,0,0]=4 17794 B18R2.4060 Fc1ccc(c(c1)I)COCc2ccccc2 34a_100000210790_100012354799 [0,2,0,0,0,0|0,0,0]=2 17795 B18R2.4060 Fc1ccc(c(c1)I)COCc2ccccc2 34a_100011356828_100015291786 [0,2,0,0,0,0|0,0,0]=2 17796 B18R2.4060 Fc1ccc(c(c1)I)COCc2ccccc2 7a_100000210790_100012354799 [0,2,0,0,0,0|0,0,0]=2 17797 B18R2.4060 Fc1ccc(c(c1)I)COCc2ccccc2 7a_100011356828_100000211182 [0,2,0,0,0,0|0,0,0]=2 17798 B18R2.4060 Fc1ccc(c(c1)I)COCc2ccccn2 34a_100011356828_100000721315 [0,2,0,0,0,0|1,0,0]=3 17799 B18R2.4060 Fc1ccc(c(c1)I)COCc2ccccn2 7a_100011356828_100000721315 [0,2,0,0,0,0|1,0,0]=3 17800 B18R2.4060 Fc1ccc(c(c1)I)COCc2cccnc2 34a_100011356828_100000733263 [0,2,0,0,0,0|1,0,0]=3 17801 B18R2.4060 Fc1ccc(c(c1)I)COCc2cccnc2 7a_100011356828_100000741622 [0,2,0,0,0,0|1,0,0]=3 17802 B18R2.4060 Fc1ccc(c(c1)I)COCc2cccnn2 34a_100011356828_100016990269 [0,2,0,0,0,0|2,0,0]=4 17803 B18R2.4060 Fc1ccc(c(c1)I)COCc2cccnn2 7a_100011356828_100016990269 [0,2,0,0,0,0|2,0,0]=4 17804 B18R2.4060 Fc1ccc(c(c1)I)COCc2ccncc2 7a_100011356828_100015193705 [0,2,0,0,0,0|1,0,0]=3 17805 B18R2.4060 Fc1ccc(c(c1)I)COCc2cnccn2 34a_100011356828_100016995436 [0,2,0,0,0,0|2,0,0]=4 17806 B18R2.4060 Fc1ccc(c(c1)I)COCc2cnccn2 7a_100011356828_100016995436 [0,2,0,0,0,0|2,0,0]=4 17807 B18R2.4060 Fc1ccc(c(c1)I)COCc2cncnc2 34a_100011356828_100015196519 [0,2,0,0,0,0|2,0,0]=4 17808 B18R2.4060 Fc1ccc(c(c1)I)COCc2cncnc2 7a_100011356828_100015196519 [0,2,0,0,0,0|2,0,0]=4 17809 B18R2.4060 Fc1ccc(c(c1)I)COCc2ncccn2 34a_100011356828_100000703007 [0,2,0,0,0,0|2,0,0]=4 17810 B18R2.4060 Fc1ccc(c(c1)I)COCc2ncccn2 7a_100011356828_100000703007 [0,2,0,0,0,0|2,0,0]=4 17811 B18R2.4060 Fc1ccc(c(c1)I)CSCc2ccccc2 62a_100000211182_100012354799 [0,2,0,0,0,0|0,1,0]=3 17812 B18R2.4060 Fc1ccc(c(c1)I)CSCc2ccccc2 62a_100012354799_100015291786 [0,2,0,0,0,0|0,1,0]=3 17813 B18R2.4060 Fc1ccc(c(c1)I)CSCc2ccccn2 62a_100000721315_100012354799 [0,2,0,0,0,0|1,1,0]=4 17814 B18R2.4060 Fc1ccc(c(c1)I)CSCc2ccccn2 62a_100012354799_100000721315 [0,2,0,0,0,0|1,1,0]=4 17815 B18R2.4060 Fc1ccc(c(c1)I)CSCc2cccnc2 62a_100000741622_100012354799 [0,2,0,0,0,0|1,1,0]=4 17816 B18R2.4060 Fc1ccc(c(c1)I)CSCc2cccnc2 62a_100012354799_100000741622 [0,2,0,0,0,0|1,1,0]=4 17817 B18R2.4060 Fc1ccc(c(c1)I)CSCc2ccncc2 62a_100012354799_100015193705 [0,2,0,0,0,0|1,1,0]=4 17818 B18R2.4060 Fc1ccc(c(c1)I)CSCc2ccncc2 62a_100015193705_100012354799 [0,2,0,0,0,0|1,1,0]=4 17819 B18R2.4060 Fc1ccc(c(c1)I)NCCc2ccccc2 34a_100000760547_100000765856 [0,2,0,0,0,0|2,0,0]=4 17820 B18R2.4060 Fc1ccc(c(c1)I)OCCc2ccccc2 34a_100012355409_100000765856 [0,2,0,0,0,0|2,0,0]=4 17821 B18R2.4060 Fc1ccc(c(c1)I)OCCc2ccccc2 7a_100012355409_100000765856 [0,2,0,0,0,0|2,0,0]=4 17822 B18R2.4060 Fc1cnc(c(c1)Cl)CNCc2ccccc2 34a_100020639648_100015291786 [0,2,0,0,0,0|2,0,0]=4 17823 B18R2.4060 Fc1cnc(c(c1)F)CNCc2ccccc2 34a_100015188779_100015291786 [0,2,0,0,0,0|2,0,0]=4 17824 B18R2.4060 Fc1cnc(c(c1)F)COCc2ccccc2 34a_100000104222_100015291786 [0,2,0,0,0,0|1,0,0]=3 17825 B18R2.4060 Fc1cnc(c(c1)F)COCc2ccccc2 7a_100000104222_100000211182 [0,2,0,0,0,0|1,0,0]=3 17826 B18R2.4060 Fc1cnc(c(c1)F)COCc2ccccn2 34a_100000104222_100000721315 [0,2,0,0,0,0|2,0,0]=4 17827 B18R2.4060 Fc1cnc(c(c1)F)COCc2ccccn2 7a_100000104222_100000721315 [0,2,0,0,0,0|2,0,0]=4 17828 B18R2.4060 Fc1cnc(c(c1)F)COCc2cccnc2 34a_100000104222_100000733263 [0,2,0,0,0,0|2,0,0]=4 17829 B18R2.4060 Fc1cnc(c(c1)F)COCc2cccnc2 7a_100000104222_100000741622 [0,2,0,0,0,0|2,0,0]=4 17830 B18R2.4060 Fc1cnc(c(c1)F)COCc2ccncc2 7a_100000104222_100015193705 [0,2,0,0,0,0|2,0,0]=4 17831 B18R2.4060 Fc1nc(ccc1COCc2ccccc2)Br 34a_100010065253_100015291786 [0,2,0,0,0,0|1,0,0]=3 17832 B18R2.4060 Fc1nc(ccc1COCc2ccccc2)Br 7a_100010065253_100000211182 [0,2,0,0,0,0|1,0,0]=3 17833 B18R2.4060 Fc1nc(ccc1COCc2ccccc2)Cl 34a_100009870654_100015291786 [0,2,0,0,0,0|1,0,0]=3 17834 B18R2.4060 Fc1nc(ccc1COCc2ccccc2)Cl 7a_100009870654_100000211182 [0,2,0,0,0,0|1,0,0]=3 17835 B18R2.4060 Fc1nc(ccc1COCc2ccccn2)Br 34a_100010065253_100000721315 [0,2,0,0,0,0|2,0,0]=4 17836 B18R2.4060 Fc1nc(ccc1COCc2ccccn2)Br 7a_100010065253_100000721315 [0,2,0,0,0,0|2,0,0]=4 17837 B18R2.4060 Fc1nc(ccc1COCc2ccccn2)Cl 34a_100009870654_100000721315 [0,2,0,0,0,0|2,0,0]=4 17838 B18R2.4060 Fc1nc(ccc1COCc2ccccn2)Cl 7a_100009870654_100000721315 [0,2,0,0,0,0|2,0,0]=4 17839 B18R2.4060 Fc1nc(ccc1COCc2cccnc2)Br 34a_100010065253_100000733263 [0,2,0,0,0,0|2,0,0]=4 17840 B18R2.4060 Fc1nc(ccc1COCc2cccnc2)Br 7a_100010065253_100000741622 [0,2,0,0,0,0|2,0,0]=4 17841 B18R2.4060 Fc1nc(ccc1COCc2cccnc2)Cl 34a_100009870654_100000733263 [0,2,0,0,0,0|2,0,0]=4 17842 B18R2.4060 Fc1nc(ccc1COCc2cccnc2)Cl 7a_100009870654_100000741622 [0,2,0,0,0,0|2,0,0]=4 17843 B18R2.4060 Fc1nc(ccc1COCc2ccncc2)Br 7a_100010065253_100015193705 [0,2,0,0,0,0|2,0,0]=4 17844 B18R2.4060 Fc1nc(ccc1COCc2ccncc2)Cl 7a_100009870654_100015193705 [0,2,0,0,0,0|2,0,0]=4 17845 B18R2.4060 Ic1ccc(c(c1)I)OCCc2ccccc2 7a_100010001573_100000765856 [0,2,0,0,0,0|2,0,0]=4 17846 B18R2.4060 Nc1cc(ccc1C=CCc2ccccc2)Br 271570a_200016263579_100000743836 [0,2,0,0,0,0|1,0,1]=4 17847 B18R2.4060 Nc1cc(ccc1C=CCc2ccccc2)Cl 271570a_200016263579_100000761886 [0,2,0,0,0,0|1,0,1]=4 17848 B18R2.4060 Nc1cc(ccc1C=CCc2ccccc2)F 271570a_200016263579_100011218093 [0,2,0,0,0,0|1,0,1]=4 17849 B18R2.4060 Nc1cc(ccc1C=CCc2ccccc2)O 271570a_200016263579_100011999798 [0,2,0,0,0,0|1,0,1]=4 17850 B18R2.4060 Nc1cc(ccc1COCc2ccccc2)Br 34a_100000718831_100015291786 [0,2,0,0,0,0|0,0,0]=2 17851 B18R2.4060 Nc1cc(ccc1COCc2ccccc2)Br 7a_100000718831_100000211182 [0,2,0,0,0,0|0,0,0]=2 17852 B18R2.4060 Nc1cc(ccc1COCc2ccccc2)Cl 34a_100000238622_100015291786 [0,2,0,0,0,0|0,0,0]=2 17853 B18R2.4060 Nc1cc(ccc1COCc2ccccc2)Cl 7a_100000238622_100000211182 [0,2,0,0,0,0|0,0,0]=2 17854 B18R2.4060 Nc1cc(ccc1COCc2ccccc2)F 34a_100011996588_100015291786 [0,2,0,0,0,0|0,0,0]=2 17855 B18R2.4060 Nc1cc(ccc1COCc2ccccn2)Br 34a_100000718831_100000721315 [0,2,0,0,0,0|1,0,0]=3 17856 B18R2.4060 Nc1cc(ccc1COCc2ccccn2)Br 7a_100000718831_100000721315 [0,2,0,0,0,0|1,0,0]=3 17857 B18R2.4060 Nc1cc(ccc1COCc2ccccn2)Cl 34a_100000238622_100000721315 [0,2,0,0,0,0|1,0,0]=3 17858 B18R2.4060 Nc1cc(ccc1COCc2ccccn2)Cl 7a_100000238622_100000721315 [0,2,0,0,0,0|1,0,0]=3 17859 B18R2.4060 Nc1cc(ccc1COCc2ccccn2)F 34a_100011996588_100000721315 [0,2,0,0,0,0|1,0,0]=3 17860 B18R2.4060 Nc1cc(ccc1COCc2cccnc2)Br 34a_100000718831_100000733263 [0,2,0,0,0,0|1,0,0]=3 17861 B18R2.4060 Nc1cc(ccc1COCc2cccnc2)Br 7a_100000718831_100000741622 [0,2,0,0,0,0|1,0,0]=3 17862 B18R2.4060 Nc1cc(ccc1COCc2cccnc2)Cl 34a_100000238622_100000733263 [0,2,0,0,0,0|1,0,0]=3 17863 B18R2.4060 Nc1cc(ccc1COCc2cccnc2)Cl 7a_100000238622_100000741622 [0,2,0,0,0,0|1,0,0]=3 17864 B18R2.4060 Nc1cc(ccc1COCc2cccnc2)F 34a_100011996588_100000733263 [0,2,0,0,0,0|1,0,0]=3 17865 B18R2.4060 Nc1cc(ccc1COCc2cccnn2)Br 34a_100000718831_100016990269 [0,2,0,0,0,0|2,0,0]=4 17866 B18R2.4060 Nc1cc(ccc1COCc2cccnn2)Br 7a_100000718831_100016990269 [0,2,0,0,0,0|2,0,0]=4 17867 B18R2.4060 Nc1cc(ccc1COCc2cccnn2)Cl 34a_100000238622_100016990269 [0,2,0,0,0,0|2,0,0]=4 17868 B18R2.4060 Nc1cc(ccc1COCc2cccnn2)Cl 7a_100000238622_100016990269 [0,2,0,0,0,0|2,0,0]=4 17869 B18R2.4060 Nc1cc(ccc1COCc2cccnn2)F 34a_100011996588_100016990269 [0,2,0,0,0,0|2,0,0]=4 17870 B18R2.4060 Nc1cc(ccc1COCc2ccncc2)Br 7a_100000718831_100015193705 [0,2,0,0,0,0|1,0,0]=3 17871 B18R2.4060 Nc1cc(ccc1COCc2ccncc2)Cl 7a_100000238622_100015193705 [0,2,0,0,0,0|1,0,0]=3 17872 B18R2.4060 Nc1cc(ccc1COCc2cnccn2)Br 34a_100000718831_100016995436 [0,2,0,0,0,0|2,0,0]=4 17873 B18R2.4060 Nc1cc(ccc1COCc2cnccn2)Br 7a_100000718831_100016995436 [0,2,0,0,0,0|2,0,0]=4 17874 B18R2.4060 Nc1cc(ccc1COCc2cnccn2)Cl 34a_100000238622_100016995436 [0,2,0,0,0,0|2,0,0]=4 17875 B18R2.4060 Nc1cc(ccc1COCc2cnccn2)Cl 7a_100000238622_100016995436 [0,2,0,0,0,0|2,0,0]=4 17876 B18R2.4060 Nc1cc(ccc1COCc2cnccn2)F 34a_100011996588_100016995436 [0,2,0,0,0,0|2,0,0]=4 17877 B18R2.4060 Nc1cc(ccc1COCc2cncnc2)Br 34a_100000718831_100015196519 [0,2,0,0,0,0|2,0,0]=4 17878 B18R2.4060 Nc1cc(ccc1COCc2cncnc2)Br 7a_100000718831_100015196519 [0,2,0,0,0,0|2,0,0]=4 17879 B18R2.4060 Nc1cc(ccc1COCc2cncnc2)Cl 34a_100000238622_100015196519 [0,2,0,0,0,0|2,0,0]=4 17880 B18R2.4060 Nc1cc(ccc1COCc2cncnc2)Cl 7a_100000238622_100015196519 [0,2,0,0,0,0|2,0,0]=4 17881 B18R2.4060 Nc1cc(ccc1COCc2cncnc2)F 34a_100011996588_100015196519 [0,2,0,0,0,0|2,0,0]=4 17882 B18R2.4060 Nc1cc(ccc1COCc2ncccn2)Br 34a_100000718831_100000703007 [0,2,0,0,0,0|2,0,0]=4 17883 B18R2.4060 Nc1cc(ccc1COCc2ncccn2)Br 7a_100000718831_100000703007 [0,2,0,0,0,0|2,0,0]=4 17884 B18R2.4060 Nc1cc(ccc1COCc2ncccn2)Cl 34a_100000238622_100000703007 [0,2,0,0,0,0|2,0,0]=4 17885 B18R2.4060 Nc1cc(ccc1COCc2ncccn2)Cl 7a_100000238622_100000703007 [0,2,0,0,0,0|2,0,0]=4 17886 B18R2.4060 Nc1cc(ccc1COCc2ncccn2)F 34a_100011996588_100000703007 [0,2,0,0,0,0|2,0,0]=4 17887 B18R2.4060 Nc1cc(ccc1OCCc2ccccc2)Br 34a_100000752626_100000765856 [0,2,0,0,0,0|2,0,0]=4 17888 B18R2.4060 Nc1cc(ccc1OCCc2ccccc2)Br 7a_100000752626_100000765856 [0,2,0,0,0,0|2,0,0]=4 17889 B18R2.4060 Nc1cc(ccc1OCCc2ccccc2)Cl 34a_100000210500_100000765856 [0,2,0,0,0,0|2,0,0]=4 17890 B18R2.4060 Nc1cc(ccc1OCCc2ccccc2)Cl 7a_100000210500_100000765856 [0,2,0,0,0,0|2,0,0]=4 17891 B18R2.4060 Nc1cc(ccc1OCCc2ccccc2)F 34a_100000759472_100000765856 [0,2,0,0,0,0|2,0,0]=4 17892 B18R2.4060 Nc1cc(ccc1OCCc2ccccc2)F 7a_100000759472_100000765856 [0,2,0,0,0,0|2,0,0]=4 17893 B18R2.4060 Nc1cc(ccc1OCCc2ccccc2)I 34a_100000753495_100000765856 [0,2,0,0,0,0|2,0,0]=4 17894 B18R2.4060 Nc1cc(ccc1OCCc2ccccc2)I 7a_100000753495_100000765856 [0,2,0,0,0,0|2,0,0]=4 17895 B18R2.4060 Nc1cc(ccc1SCCc2ccccc2)Br 62a_100000743836_100011218657 [0,2,0,0,0,0|2,0,0]=4 17896 B18R2.4060 Nc1cc(ccc1SCCc2ccccc2)Br 62a_100000765856_100000743836 [0,2,0,0,0,0|2,0,0]=4 17897 B18R2.4060 Nc1cc(ccc1SCCc2ccccc2)Cl 62a_100000761886_100011218657 [0,2,0,0,0,0|2,0,0]=4 17898 B18R2.4060 Nc1cc(ccc1SCCc2ccccc2)Cl 62a_100000765856_100000761886 [0,2,0,0,0,0|2,0,0]=4 17899 B18R2.4060 Nc1cc(ccc1SCCc2ccccc2)F 62a_100000687223_100011218657 [0,2,0,0,0,0|2,0,0]=4 17900 B18R2.4060 Nc1cc(ccc1SCCc2ccccc2)F 62a_100000765856_100000687223 [0,2,0,0,0,0|2,0,0]=4 17901 B18R2.4060 Nc1cc(ccc1SCCc2ccccc2)O 62a_100000765856_100011999798 [0,2,0,0,0,0|2,0,0]=4 17902 B18R2.4060 Nc1cc(ccc1SCCc2ccccc2)O 62a_100011999798_100011218657 [0,2,0,0,0,0|2,0,0]=4 17903 B18R2.4060 Nc1cc(ncc1COCc2ccccc2)Cl 34a_100009830438_100015291786 [0,2,0,0,0,0|1,0,0]=3 17904 B18R2.4060 Nc1cc(ncc1COCc2ccccn2)Cl 34a_100009830438_100000721315 [0,2,0,0,0,0|2,0,0]=4 17905 B18R2.4060 Nc1cc(ncc1COCc2cccnc2)Cl 34a_100009830438_100000733263 [0,2,0,0,0,0|2,0,0]=4 17906 B18R2.4060 Nc1ccc(c(c1)Br)C=CCc2ccccc2 271570a_200016263579_100000750458 [0,2,0,0,0,0|1,0,1]=4 17907 B18R2.4060 Nc1ccc(c(c1)Br)OCCc2ccccc2 34a_100011534360_100000765856 [0,2,0,0,0,0|2,0,0]=4 17908 B18R2.4060 Nc1ccc(c(c1)Br)OCCc2ccccc2 7a_100011534360_100000765856 [0,2,0,0,0,0|2,0,0]=4 17909 B18R2.4060 Nc1ccc(c(c1)Br)SCCc2ccccc2 62a_100000750458_100011218657 [0,2,0,0,0,0|2,0,0]=4 17910 B18R2.4060 Nc1ccc(c(c1)Br)SCCc2ccccc2 62a_100000765856_100000750458 [0,2,0,0,0,0|2,0,0]=4 17911 B18R2.4060 Nc1ccc(c(c1)Cl)C=CCc2ccccc2 271570a_200016263579_100000761885 [0,2,0,0,0,0|1,0,1]=4 17912 B18R2.4060 Nc1ccc(c(c1)Cl)COCc2ccccc2 34a_100000689119_100015291786 [0,2,0,0,0,0|0,0,0]=2 17913 B18R2.4060 Nc1ccc(c(c1)Cl)COCc2ccccn2 34a_100000689119_100000721315 [0,2,0,0,0,0|1,0,0]=3 17914 B18R2.4060 Nc1ccc(c(c1)Cl)COCc2cccnc2 34a_100000689119_100000733263 [0,2,0,0,0,0|1,0,0]=3 17915 B18R2.4060 Nc1ccc(c(c1)Cl)COCc2cccnn2 34a_100000689119_100016990269 [0,2,0,0,0,0|2,0,0]=4 17916 B18R2.4060 Nc1ccc(c(c1)Cl)COCc2cnccn2 34a_100000689119_100016995436 [0,2,0,0,0,0|2,0,0]=4 17917 B18R2.4060 Nc1ccc(c(c1)Cl)COCc2cncnc2 34a_100000689119_100015196519 [0,2,0,0,0,0|2,0,0]=4 17918 B18R2.4060 Nc1ccc(c(c1)Cl)COCc2ncccn2 34a_100000689119_100000703007 [0,2,0,0,0,0|2,0,0]=4 17919 B18R2.4060 Nc1ccc(c(c1)Cl)OCCc2ccccc2 34a_100000744943_100000765856 [0,2,0,0,0,0|2,0,0]=4 17920 B18R2.4060 Nc1ccc(c(c1)Cl)OCCc2ccccc2 7a_100000744943_100000765856 [0,2,0,0,0,0|2,0,0]=4 17921 B18R2.4060 Nc1ccc(c(c1)Cl)SCCc2ccccc2 62a_100000761885_100011218657 [0,2,0,0,0,0|2,0,0]=4 17922 B18R2.4060 Nc1ccc(c(c1)Cl)SCCc2ccccc2 62a_100000765856_100000761885 [0,2,0,0,0,0|2,0,0]=4 17923 B18R2.4060 Nc1ccc(c(c1)F)C=CCc2ccccc2 271570a_200016263579_100011356925 [0,2,0,0,0,0|1,0,1]=4 17924 B18R2.4060 Nc1ccc(c(c1)F)OCCc2ccccc2 34a_100011220035_100000765856 [0,2,0,0,0,0|2,0,0]=4 17925 B18R2.4060 Nc1ccc(c(c1)F)OCCc2ccccc2 7a_100011220035_100000765856 [0,2,0,0,0,0|2,0,0]=4 17926 B18R2.4060 Nc1ccc(c(c1)F)SCCc2ccccc2 62a_100000765856_100011356925 [0,2,0,0,0,0|2,0,0]=4 17927 B18R2.4060 Nc1ccc(c(c1)F)SCCc2ccccc2 62a_100011356925_100011218657 [0,2,0,0,0,0|2,0,0]=4 17928 B18R2.4060 Nc1ccc(c(c1)N)C=CCc2ccccc2 271570a_200016263579_200012175722 [0,2,0,0,0,0|1,0,1]=4 17929 B18R2.4060 Nc1ccc(c(c1)N)OCCc2ccccc2 34a_100000725306_100000765856 [0,2,0,0,0,0|2,0,0]=4 17930 B18R2.4060 Nc1ccc(c(c1)N)SCCc2ccccc2 62a_100000765856_200012175722 [0,2,0,0,0,0|2,0,0]=4 17931 B18R2.4060 Nc1ccc(c(c1)N)SCCc2ccccc2 62a_200012175722_100011218657 [0,2,0,0,0,0|2,0,0]=4 17932 B18R2.4060 Nc1nc(ncc1COCc2ccccc2)Cl 7a_200009965464_100000211182 [0,2,0,0,0,0|2,0,0]=4 17933 B18R2.4060 Nc1ncc(c(n1)N)COCc2ccccc2 7a_100000083744_100000211182 [0,2,0,0,0,0|2,0,0]=4 17934 B18R2.4060 O=c1[nH]cc(c(=O)[nH]1)COCc2ccccc2 7a_100000210790_100000035367 [0,2,0,0,0,0|2,0,0]=4 17935 B18R2.4060 Oc1cc(ccc1C=CCc2ccccc2)Br 271570a_200016263579_100012344904 [0,2,0,0,0,0|1,0,1]=4 17936 B18R2.4060 Oc1cc(ccc1C=CCc2ccccc2)Cl 271570a_200016263579_100000050036 [0,2,0,0,0,0|1,0,1]=4 17937 B18R2.4060 Oc1cc(ccc1C=CCc2ccccc2)F 271570a_200016263579_100000690578 [0,2,0,0,0,0|1,0,1]=4 17938 B18R2.4060 Oc1cc(ccc1NCCc2ccccc2)Br 34a_100000739049_100000765856 [0,2,0,0,0,0|2,0,0]=4 17939 B18R2.4060 Oc1cc(ccc1NCCc2ccccc2)Cl 34a_100000185728_100000765856 [0,2,0,0,0,0|2,0,0]=4 17940 B18R2.4060 Oc1cc(ccc1NCCc2ccccc2)F 34a_100000753323_100000765856 [0,2,0,0,0,0|2,0,0]=4 17941 B18R2.4060 Oc1cc(ccc1SCCc2ccccc2)Br 62a_100000765856_100012344904 [0,2,0,0,0,0|2,0,0]=4 17942 B18R2.4060 Oc1cc(ccc1SCCc2ccccc2)Br 62a_100012344904_100011218657 [0,2,0,0,0,0|2,0,0]=4 17943 B18R2.4060 Oc1cc(ccc1SCCc2ccccc2)Cl 62a_100000050036_100011218657 [0,2,0,0,0,0|2,0,0]=4 17944 B18R2.4060 Oc1cc(ccc1SCCc2ccccc2)Cl 62a_100000765856_100000050036 [0,2,0,0,0,0|2,0,0]=4 17945 B18R2.4060 Oc1cc(ccc1SCCc2ccccc2)F 62a_100000690578_100011218657 [0,2,0,0,0,0|2,0,0]=4 17946 B18R2.4060 Oc1cc(ccc1SCCc2ccccc2)F 62a_100000765856_100000690578 [0,2,0,0,0,0|2,0,0]=4 17947 B18R2.4060 Oc1ccc(c(c1)Br)C=CCc2ccccc2 271570a_200016263579_100000701344 [0,2,0,0,0,0|1,0,1]=4 17948 B18R2.4060 Oc1ccc(c(c1)Br)NCCc2ccccc2 34a_100012001276_100000765856 [0,2,0,0,0,0|2,0,0]=4 17949 B18R2.4060 Oc1ccc(c(c1)Br)SCCc2ccccc2 62a_100000701344_100011218657 [0,2,0,0,0,0|2,0,0]=4 17950 B18R2.4060 Oc1ccc(c(c1)Br)SCCc2ccccc2 62a_100000765856_100000701344 [0,2,0,0,0,0|2,0,0]=4 17951 B18R2.4060 Oc1ccc(c(c1)Cl)C=CCc2ccccc2 271570a_200016263579_100000047559 [0,2,0,0,0,0|1,0,1]=4 17952 B18R2.4060 Oc1ccc(c(c1)Cl)CNCc2ccccc2 34a_200161156549_100015291786 [0,2,0,0,0,0|1,0,0]=3 17953 B18R2.4060 Oc1ccc(c(c1)Cl)CNCc2ccccn2 34a_200161156549_100000721315 [0,2,0,0,0,0|2,0,0]=4 17954 B18R2.4060 Oc1ccc(c(c1)Cl)CNCc2cccnc2 34a_200161156549_100000733263 [0,2,0,0,0,0|2,0,0]=4 17955 B18R2.4060 Oc1ccc(c(c1)Cl)NCCc2ccccc2 34a_100011215599_100000765856 [0,2,0,0,0,0|2,0,0]=4 17956 B18R2.4060 Oc1ccc(c(c1)Cl)SCCc2ccccc2 62a_100000047559_100011218657 [0,2,0,0,0,0|2,0,0]=4 17957 B18R2.4060 Oc1ccc(c(c1)Cl)SCCc2ccccc2 62a_100000765856_100000047559 [0,2,0,0,0,0|2,0,0]=4 17958 B18R2.4060 Oc1ccc(c(c1)F)C=CCc2ccccc2 271570a_200016263579_100000755031 [0,2,0,0,0,0|1,0,1]=4 17959 B18R2.4060 Oc1ccc(c(c1)F)NCCc2ccccc2 34a_100000759473_100000765856 [0,2,0,0,0,0|2,0,0]=4 17960 B18R2.4060 Oc1ccc(c(c1)F)SCCc2ccccc2 62a_100000755031_100011218657 [0,2,0,0,0,0|2,0,0]=4 17961 B18R2.4060 Oc1ccc(c(c1)F)SCCc2ccccc2 62a_100000765856_100000755031 [0,2,0,0,0,0|2,0,0]=4 17962 B18R2.4060 Oc1ccc(c(c1)I)NCCc2ccccc2 34a_100010084370_100000765856 [0,2,0,0,0,0|2,0,0]=4 17963 B18R2.4060 Oc1ccc(c(c1)O)C=CCc2ccccc2 271570a_200016263579_100009813921 [0,2,0,0,0,0|1,0,1]=4 17964 B18R2.4060 Oc1ccc(c(c1)O)NCCc2ccccc2 34a_100000106777_100000765856 [0,2,0,0,0,0|2,0,0]=4 17965 B18R2.4060 Oc1ccc(c(c1)O)SCCc2ccccc2 62a_100000765856_100009813921 [0,2,0,0,0,0|2,0,0]=4 17966 B18R2.8976 Brc1cc(ccc1I)NCCc2ccccc2 34a_100000750458_100000765856 [0,2,0,0,0,0|2,0,0]=4 17967 B18R2.8976 Brc1cc(ccc1I)OCCc2ccccc2 34a_100000701344_100000765856 [0,2,0,0,0,0|2,0,0]=4 17968 B18R2.8976 Brc1cc(ccc1I)OCCc2ccccc2 7a_100000701344_100000765856 [0,2,0,0,0,0|2,0,0]=4 17969 B18R2.8976 Brc1ccc(cc1Br)C=CCc2ccccc2 271570a_200016263579_100012356285 [0,2,0,0,0,0|1,0,1]=4 17970 B18R2.8976 Brc1ccc(cc1Br)CNCc2ccccc2 207a_100012351559_100015611070 [0,2,0,0,0,0|1,0,0]=3 17971 B18R2.8976 Brc1ccc(cc1Br)CNCc2ccccc2 207a_100015324214_100011215943 [0,2,0,0,0,0|1,0,0]=3 17972 B18R2.8976 Brc1ccc(cc1Br)CNCc2ccccc2 2230a_100012351559_100015291786 [0,2,0,0,0,0|1,0,0]=3 17973 B18R2.8976 Brc1ccc(cc1Br)CNCc2ccccc2 2230a_100015324214_100012353900 [0,2,0,0,0,0|1,0,0]=3 17974 B18R2.8976 Brc1ccc(cc1Br)CNCc2ccccc2 270004a_100012351559_100015611070 [0,2,0,0,0,0|1,0,0]=3 17975 B18R2.8976 Brc1ccc(cc1Br)CNCc2ccccc2 270004a_100015324214_100011215943 [0,2,0,0,0,0|1,0,0]=3 17976 B18R2.8976 Brc1ccc(cc1Br)CNCc2ccccc2 34a_100012351559_100015291786 [0,2,0,0,0,0|1,0,0]=3 17977 B18R2.8976 Brc1ccc(cc1Br)CNCc2ccccc2 34a_100015324214_100012353900 [0,2,0,0,0,0|1,0,0]=3 17978 B18R2.8976 Brc1ccc(cc1Br)CNCc2ccccn2 207a_100012351559_100000209966 [0,2,0,0,0,0|2,0,0]=4 17979 B18R2.8976 Brc1ccc(cc1Br)CNCc2ccccn2 2230a_100012351559_100000721315 [0,2,0,0,0,0|2,0,0]=4 17980 B18R2.8976 Brc1ccc(cc1Br)CNCc2ccccn2 270004a_100000210449_100011215943 [0,2,0,0,0,0|2,0,0]=4 17981 B18R2.8976 Brc1ccc(cc1Br)CNCc2ccccn2 270004a_100012351559_100000209966 [0,2,0,0,0,0|2,0,0]=4 17982 B18R2.8976 Brc1ccc(cc1Br)CNCc2ccccn2 34a_100012351559_100000721315 [0,2,0,0,0,0|2,0,0]=4 17983 B18R2.8976 Brc1ccc(cc1Br)CNCc2cccnc2 207a_100000210453_100011215943 [0,2,0,0,0,0|2,0,0]=4 17984 B18R2.8976 Brc1ccc(cc1Br)CNCc2cccnc2 207a_100012351559_100000209961 [0,2,0,0,0,0|2,0,0]=4 17985 B18R2.8976 Brc1ccc(cc1Br)CNCc2cccnc2 2230a_100012351559_100000741622 [0,2,0,0,0,0|2,0,0]=4 17986 B18R2.8976 Brc1ccc(cc1Br)CNCc2cccnc2 270004a_100000210453_100011215943 [0,2,0,0,0,0|2,0,0]=4 17987 B18R2.8976 Brc1ccc(cc1Br)CNCc2cccnc2 270004a_100012351559_100000209961 [0,2,0,0,0,0|2,0,0]=4 17988 B18R2.8976 Brc1ccc(cc1Br)CNCc2cccnc2 34a_100012351559_100000733263 [0,2,0,0,0,0|2,0,0]=4 17989 B18R2.8976 Brc1ccc(cc1Br)CNCc2ccncc2 207a_100012351559_100000186114 [0,2,0,0,0,0|2,0,0]=4 17990 B18R2.8976 Brc1ccc(cc1Br)CNCc2ccncc2 2230a_100012351559_100015193705 [0,2,0,0,0,0|2,0,0]=4 17991 B18R2.8976 Brc1ccc(cc1Br)COCc2ccccc2 34a_100000210790_100012353900 [0,2,0,0,0,0|0,0,0]=2 17992 B18R2.8976 Brc1ccc(cc1Br)COCc2ccccc2 7a_100000210790_100012353900 [0,2,0,0,0,0|0,0,0]=2 17993 B18R2.8976 Brc1ccc(cc1Br)CSCc2ccccc2 62a_100000211182_100012353900 [0,2,0,0,0,0|0,1,0]=3 17994 B18R2.8976 Brc1ccc(cc1Br)CSCc2ccccc2 62a_100012353900_100015291786 [0,2,0,0,0,0|0,1,0]=3 17995 B18R2.8976 Brc1ccc(cc1Br)CSCc2ccccn2 62a_100000721315_100012353900 [0,2,0,0,0,0|1,1,0]=4 17996 B18R2.8976 Brc1ccc(cc1Br)CSCc2ccccn2 62a_100012353900_100000721315 [0,2,0,0,0,0|1,1,0]=4 17997 B18R2.8976 Brc1ccc(cc1Br)CSCc2cccnc2 62a_100000741622_100012353900 [0,2,0,0,0,0|1,1,0]=4 17998 B18R2.8976 Brc1ccc(cc1Br)CSCc2cccnc2 62a_100012353900_100000741622 [0,2,0,0,0,0|1,1,0]=4 17999 B18R2.8976 Brc1ccc(cc1Br)CSCc2ccncc2 62a_100012353900_100015193705 [0,2,0,0,0,0|1,1,0]=4 18000 B18R2.8976 Brc1ccc(cc1Br)CSCc2ccncc2 62a_100015193705_100012353900 [0,2,0,0,0,0|1,1,0]=4 18001 B18R2.8976 Brc1ccc(cc1Br)NCCc2ccccc2 2230a_100011306057_100000765856 [0,2,0,0,0,0|2,0,0]=4 18002 B18R2.8976 Brc1ccc(cc1Br)NCCc2ccccc2 34a_100011306057_100000765856 [0,2,0,0,0,0|2,0,0]=4 18003 B18R2.8976 Brc1ccc(cc1Br)NCCc2ccccc2 7a_100011306057_100000765856 [0,2,0,0,0,0|2,0,0]=4 18004 B18R2.8976 Brc1ccc(cc1Br)SCCc2ccccc2 62a_100000765856_100012356285 [0,2,0,0,0,0|2,0,0]=4 18005 B18R2.8976 Brc1ccc(cc1Br)SCCc2ccccc2 62a_100012356285_100011218657 [0,2,0,0,0,0|2,0,0]=4 18006 B18R2.8976 Brc1ccc(cc1I)CNCc2ccccc2 207a_100015324214_100010146563 [0,2,0,0,0,0|1,0,0]=3 18007 B18R2.8976 Brc1ccc(cc1I)CNCc2ccccc2 2230a_100015324214_100010146616 [0,2,0,0,0,0|1,0,0]=3 18008 B18R2.8976 Brc1ccc(cc1I)CNCc2ccccc2 270004a_100015324214_100010146563 [0,2,0,0,0,0|1,0,0]=3 18009 B18R2.8976 Brc1ccc(cc1I)CNCc2ccccc2 34a_100015324214_100010146616 [0,2,0,0,0,0|1,0,0]=3 18010 B18R2.8976 Brc1ccc(cc1I)CNCc2ccccn2 270004a_100000210449_100010146563 [0,2,0,0,0,0|2,0,0]=4 18011 B18R2.8976 Brc1ccc(cc1I)CNCc2cccnc2 207a_100000210453_100010146563 [0,2,0,0,0,0|2,0,0]=4 18012 B18R2.8976 Brc1ccc(cc1I)CNCc2cccnc2 270004a_100000210453_100010146563 [0,2,0,0,0,0|2,0,0]=4 18013 B18R2.8976 Brc1ccc(cc1I)COCc2ccccc2 34a_100000210790_100010146616 [0,2,0,0,0,0|0,0,0]=2 18014 B18R2.8976 Brc1ccc(cc1I)COCc2ccccc2 7a_100000210790_100010146616 [0,2,0,0,0,0|0,0,0]=2 18015 B18R2.8976 Brc1ccc(cc1I)CSCc2ccccc2 62a_100000211182_100010146616 [0,2,0,0,0,0|0,1,0]=3 18016 B18R2.8976 Brc1ccc(cc1I)CSCc2ccccc2 62a_100010146616_100015291786 [0,2,0,0,0,0|0,1,0]=3 18017 B18R2.8976 Brc1ccc(cc1I)CSCc2ccccn2 62a_100000721315_100010146616 [0,2,0,0,0,0|1,1,0]=4 18018 B18R2.8976 Brc1ccc(cc1I)CSCc2ccccn2 62a_100010146616_100000721315 [0,2,0,0,0,0|1,1,0]=4 18019 B18R2.8976 Brc1ccc(cc1I)CSCc2cccnc2 62a_100000741622_100010146616 [0,2,0,0,0,0|1,1,0]=4 18020 B18R2.8976 Brc1ccc(cc1I)CSCc2cccnc2 62a_100010146616_100000741622 [0,2,0,0,0,0|1,1,0]=4 18021 B18R2.8976 Brc1ccc(cc1I)CSCc2ccncc2 62a_100010146616_100015193705 [0,2,0,0,0,0|1,1,0]=4 18022 B18R2.8976 Brc1ccc(cc1I)CSCc2ccncc2 62a_100015193705_100010146616 [0,2,0,0,0,0|1,1,0]=4 18023 B18R2.8976 Brc1ccc(cc1I)NCCc2ccccc2 34a_100000750459_100000765856 [0,2,0,0,0,0|2,0,0]=4 18024 B18R2.8976 Brc1ccc(cc1I)OCCc2ccccc2 34a_100012339312_100000765856 [0,2,0,0,0,0|2,0,0]=4 18025 B18R2.8976 Brc1ccc(cc1I)OCCc2ccccc2 7a_100012339312_100000765856 [0,2,0,0,0,0|2,0,0]=4 18026 B18R2.8976 Cc1cc(ccc1Br)C=CCc2ccccc2 271570a_200016263579_100009813585 [0,2,0,0,0,0|1,0,1]=4 18027 B18R2.8976 Cc1cc(ccc1Br)CNCc2ccccc2 207a_100015205234_100015611070 [0,2,0,0,0,0|1,0,0]=3 18028 B18R2.8976 Cc1cc(ccc1Br)CNCc2ccccc2 207a_100015324214_100000765772 [0,2,0,0,0,0|1,0,0]=3 18029 B18R2.8976 Cc1cc(ccc1Br)CNCc2ccccc2 2230a_100015205234_100015291786 [0,2,0,0,0,0|1,0,0]=3 18030 B18R2.8976 Cc1cc(ccc1Br)CNCc2ccccc2 2230a_100015324214_100000727479 [0,2,0,0,0,0|1,0,0]=3 18031 B18R2.8976 Cc1cc(ccc1Br)CNCc2ccccc2 270004a_100015205234_100015611070 [0,2,0,0,0,0|1,0,0]=3 18032 B18R2.8976 Cc1cc(ccc1Br)CNCc2ccccc2 270004a_100015324214_100000765772 [0,2,0,0,0,0|1,0,0]=3 18033 B18R2.8976 Cc1cc(ccc1Br)CNCc2ccccc2 34a_100015205234_100015291786 [0,2,0,0,0,0|1,0,0]=3 18034 B18R2.8976 Cc1cc(ccc1Br)CNCc2ccccc2 34a_100015324214_100000727479 [0,2,0,0,0,0|1,0,0]=3 18035 B18R2.8976 Cc1cc(ccc1Br)CNCc2ccccn2 207a_100015205234_100000209966 [0,2,0,0,0,0|2,0,0]=4 18036 B18R2.8976 Cc1cc(ccc1Br)CNCc2ccccn2 2230a_100015205234_100000721315 [0,2,0,0,0,0|2,0,0]=4 18037 B18R2.8976 Cc1cc(ccc1Br)CNCc2ccccn2 270004a_100000210449_100000765772 [0,2,0,0,0,0|2,0,0]=4 18038 B18R2.8976 Cc1cc(ccc1Br)CNCc2ccccn2 270004a_100015205234_100000209966 [0,2,0,0,0,0|2,0,0]=4 18039 B18R2.8976 Cc1cc(ccc1Br)CNCc2ccccn2 34a_100015205234_100000721315 [0,2,0,0,0,0|2,0,0]=4 18040 B18R2.8976 Cc1cc(ccc1Br)CNCc2cccnc2 207a_100000210453_100000765772 [0,2,0,0,0,0|2,0,0]=4 18041 B18R2.8976 Cc1cc(ccc1Br)CNCc2cccnc2 207a_100015205234_100000209961 [0,2,0,0,0,0|2,0,0]=4 18042 B18R2.8976 Cc1cc(ccc1Br)CNCc2cccnc2 2230a_100015205234_100000741622 [0,2,0,0,0,0|2,0,0]=4 18043 B18R2.8976 Cc1cc(ccc1Br)CNCc2cccnc2 270004a_100000210453_100000765772 [0,2,0,0,0,0|2,0,0]=4 18044 B18R2.8976 Cc1cc(ccc1Br)CNCc2cccnc2 270004a_100015205234_100000209961 [0,2,0,0,0,0|2,0,0]=4 18045 B18R2.8976 Cc1cc(ccc1Br)CNCc2cccnc2 34a_100015205234_100000733263 [0,2,0,0,0,0|2,0,0]=4 18046 B18R2.8976 Cc1cc(ccc1Br)CNCc2ccncc2 207a_100015205234_100000186114 [0,2,0,0,0,0|2,0,0]=4 18047 B18R2.8976 Cc1cc(ccc1Br)CNCc2ccncc2 2230a_100015205234_100015193705 [0,2,0,0,0,0|2,0,0]=4 18048 B18R2.8976 Cc1cc(ccc1Br)COCc2ccccc2 34a_100000210790_100000727479 [0,2,0,0,0,0|0,0,0]=2 18049 B18R2.8976 Cc1cc(ccc1Br)COCc2ccccc2 34a_100000718852_100015291786 [0,2,0,0,0,0|0,0,0]=2 18050 B18R2.8976 Cc1cc(ccc1Br)COCc2ccccc2 7a_100000210790_100000727479 [0,2,0,0,0,0|0,0,0]=2 18051 B18R2.8976 Cc1cc(ccc1Br)COCc2ccccc2 7a_100000718852_100000211182 [0,2,0,0,0,0|0,0,0]=2 18052 B18R2.8976 Cc1cc(ccc1Br)COCc2ccccn2 34a_100000718852_100000721315 [0,2,0,0,0,0|1,0,0]=3 18053 B18R2.8976 Cc1cc(ccc1Br)COCc2ccccn2 7a_100000718852_100000721315 [0,2,0,0,0,0|1,0,0]=3 18054 B18R2.8976 Cc1cc(ccc1Br)COCc2cccnc2 34a_100000718852_100000733263 [0,2,0,0,0,0|1,0,0]=3 18055 B18R2.8976 Cc1cc(ccc1Br)COCc2cccnc2 7a_100000718852_100000741622 [0,2,0,0,0,0|1,0,0]=3 18056 B18R2.8976 Cc1cc(ccc1Br)COCc2cccnn2 34a_100000718852_100016990269 [0,2,0,0,0,0|2,0,0]=4 18057 B18R2.8976 Cc1cc(ccc1Br)COCc2cccnn2 7a_100000718852_100016990269 [0,2,0,0,0,0|2,0,0]=4 18058 B18R2.8976 Cc1cc(ccc1Br)COCc2ccncc2 7a_100000718852_100015193705 [0,2,0,0,0,0|1,0,0]=3 18059 B18R2.8976 Cc1cc(ccc1Br)COCc2cnccn2 34a_100000718852_100016995436 [0,2,0,0,0,0|2,0,0]=4 18060 B18R2.8976 Cc1cc(ccc1Br)COCc2cnccn2 7a_100000718852_100016995436 [0,2,0,0,0,0|2,0,0]=4 18061 B18R2.8976 Cc1cc(ccc1Br)COCc2cncnc2 34a_100000718852_100015196519 [0,2,0,0,0,0|2,0,0]=4 18062 B18R2.8976 Cc1cc(ccc1Br)COCc2cncnc2 7a_100000718852_100015196519 [0,2,0,0,0,0|2,0,0]=4 18063 B18R2.8976 Cc1cc(ccc1Br)COCc2ncccn2 34a_100000718852_100000703007 [0,2,0,0,0,0|2,0,0]=4 18064 B18R2.8976 Cc1cc(ccc1Br)COCc2ncccn2 7a_100000718852_100000703007 [0,2,0,0,0,0|2,0,0]=4 18065 B18R2.8976 Cc1cc(ccc1Br)CSCc2ccccc2 62a_100000211182_100000727479 [0,2,0,0,0,0|0,1,0]=3 18066 B18R2.8976 Cc1cc(ccc1Br)CSCc2ccccc2 62a_100000727479_100015291786 [0,2,0,0,0,0|0,1,0]=3 18067 B18R2.8976 Cc1cc(ccc1Br)CSCc2ccccn2 62a_100000721315_100000727479 [0,2,0,0,0,0|1,1,0]=4 18068 B18R2.8976 Cc1cc(ccc1Br)CSCc2ccccn2 62a_100000727479_100000721315 [0,2,0,0,0,0|1,1,0]=4 18069 B18R2.8976 Cc1cc(ccc1Br)CSCc2cccnc2 62a_100000727479_100000741622 [0,2,0,0,0,0|1,1,0]=4 18070 B18R2.8976 Cc1cc(ccc1Br)CSCc2cccnc2 62a_100000741622_100000727479 [0,2,0,0,0,0|1,1,0]=4 18071 B18R2.8976 Cc1cc(ccc1Br)CSCc2ccncc2 62a_100000727479_100015193705 [0,2,0,0,0,0|1,1,0]=4 18072 B18R2.8976 Cc1cc(ccc1Br)CSCc2ccncc2 62a_100015193705_100000727479 [0,2,0,0,0,0|1,1,0]=4 18073 B18R2.8976 Cc1cc(ccc1Br)NCCc2ccccc2 2230a_100000210723_100000765856 [0,2,0,0,0,0|2,0,0]=4 18074 B18R2.8976 Cc1cc(ccc1Br)NCCc2ccccc2 34a_100000210723_100000765856 [0,2,0,0,0,0|2,0,0]=4 18075 B18R2.8976 Cc1cc(ccc1Br)NCCc2ccccc2 7a_100000210723_100000765856 [0,2,0,0,0,0|2,0,0]=4 18076 B18R2.8976 Cc1cc(ccc1Br)OCCc2ccccc2 34a_100000690111_100000765856 [0,2,0,0,0,0|2,0,0]=4 18077 B18R2.8976 Cc1cc(ccc1Br)OCCc2ccccc2 7a_100000690111_100000765856 [0,2,0,0,0,0|2,0,0]=4 18078 B18R2.8976 Cc1cc(ccc1Br)SCCc2ccccc2 62a_100000765856_100009813585 [0,2,0,0,0,0|2,0,0]=4 18079 B18R2.8976 Cc1cc(ccc1Br)SCCc2ccccc2 62a_100009813585_100011218657 [0,2,0,0,0,0|2,0,0]=4 18080 B18R2.8976 Cc1cc(ccc1Cl)C=CCc2ccccc2 271570a_200016263579_100000049509 [0,2,0,0,0,0|1,0,1]=4 18081 B18R2.8976 Cc1cc(ccc1Cl)CNCc2ccccc2 207a_100015324214_100000698814 [0,2,0,0,0,0|1,0,0]=3 18082 B18R2.8976 Cc1cc(ccc1Cl)CNCc2ccccc2 2230a_100015324214_100012184735 [0,2,0,0,0,0|1,0,0]=3 18083 B18R2.8976 Cc1cc(ccc1Cl)CNCc2ccccc2 270004a_100015324214_100000698814 [0,2,0,0,0,0|1,0,0]=3 18084 B18R2.8976 Cc1cc(ccc1Cl)CNCc2ccccc2 34a_100015324214_100012184735 [0,2,0,0,0,0|1,0,0]=3 18085 B18R2.8976 Cc1cc(ccc1Cl)CNCc2ccccn2 270004a_100000210449_100000698814 [0,2,0,0,0,0|2,0,0]=4 18086 B18R2.8976 Cc1cc(ccc1Cl)CNCc2cccnc2 207a_100000210453_100000698814 [0,2,0,0,0,0|2,0,0]=4 18087 B18R2.8976 Cc1cc(ccc1Cl)CNCc2cccnc2 270004a_100000210453_100000698814 [0,2,0,0,0,0|2,0,0]=4 18088 B18R2.8976 Cc1cc(ccc1Cl)COCc2ccccc2 34a_100000210790_100012184735 [0,2,0,0,0,0|0,0,0]=2 18089 B18R2.8976 Cc1cc(ccc1Cl)COCc2ccccc2 7a_100000210790_100012184735 [0,2,0,0,0,0|0,0,0]=2 18090 B18R2.8976 Cc1cc(ccc1Cl)CSCc2ccccc2 62a_100000211182_100012184735 [0,2,0,0,0,0|0,1,0]=3 18091 B18R2.8976 Cc1cc(ccc1Cl)CSCc2ccccc2 62a_100012184735_100015291786 [0,2,0,0,0,0|0,1,0]=3 18092 B18R2.8976 Cc1cc(ccc1Cl)CSCc2ccccn2 62a_100000721315_100012184735 [0,2,0,0,0,0|1,1,0]=4 18093 B18R2.8976 Cc1cc(ccc1Cl)CSCc2ccccn2 62a_100012184735_100000721315 [0,2,0,0,0,0|1,1,0]=4 18094 B18R2.8976 Cc1cc(ccc1Cl)CSCc2cccnc2 62a_100000741622_100012184735 [0,2,0,0,0,0|1,1,0]=4 18095 B18R2.8976 Cc1cc(ccc1Cl)CSCc2cccnc2 62a_100012184735_100000741622 [0,2,0,0,0,0|1,1,0]=4 18096 B18R2.8976 Cc1cc(ccc1Cl)CSCc2ccncc2 62a_100012184735_100015193705 [0,2,0,0,0,0|1,1,0]=4 18097 B18R2.8976 Cc1cc(ccc1Cl)CSCc2ccncc2 62a_100015193705_100012184735 [0,2,0,0,0,0|1,1,0]=4 18098 B18R2.8976 Cc1cc(ccc1Cl)NCCc2ccccc2 2230a_100000187808_100000765856 [0,2,0,0,0,0|2,0,0]=4 18099 B18R2.8976 Cc1cc(ccc1Cl)NCCc2ccccc2 34a_100000187808_100000765856 [0,2,0,0,0,0|2,0,0]=4 18100 B18R2.8976 Cc1cc(ccc1Cl)NCCc2ccccc2 7a_100000187808_100000765856 [0,2,0,0,0,0|2,0,0]=4 18101 B18R2.8976 Cc1cc(ccc1Cl)OCCc2ccccc2 34a_100000211092_100000765856 [0,2,0,0,0,0|2,0,0]=4 18102 B18R2.8976 Cc1cc(ccc1Cl)OCCc2ccccc2 7a_100000211092_100000765856 [0,2,0,0,0,0|2,0,0]=4 18103 B18R2.8976 Cc1cc(ccc1Cl)SCCc2ccccc2 62a_100000049509_100011218657 [0,2,0,0,0,0|2,0,0]=4 18104 B18R2.8976 Cc1cc(ccc1Cl)SCCc2ccccc2 62a_100000765856_100000049509 [0,2,0,0,0,0|2,0,0]=4 18105 B18R2.8976 Cc1cc(ccc1F)C=CCc2ccccc2 271570a_200016263579_100011218330 [0,2,0,0,0,0|1,0,1]=4 18106 B18R2.8976 Cc1cc(ccc1F)CNCc2ccccc2 207a_100000239911_100015611070 [0,2,0,0,0,0|1,0,0]=3 18107 B18R2.8976 Cc1cc(ccc1F)CNCc2ccccc2 207a_100015324214_100000748208 [0,2,0,0,0,0|1,0,0]=3 18108 B18R2.8976 Cc1cc(ccc1F)CNCc2ccccc2 2230a_100000239911_100015291786 [0,2,0,0,0,0|1,0,0]=3 18109 B18R2.8976 Cc1cc(ccc1F)CNCc2ccccc2 2230a_100015324214_100011216667 [0,2,0,0,0,0|1,0,0]=3 18110 B18R2.8976 Cc1cc(ccc1F)CNCc2ccccc2 270004a_100000239911_100015611070 [0,2,0,0,0,0|1,0,0]=3 18111 B18R2.8976 Cc1cc(ccc1F)CNCc2ccccc2 270004a_100015324214_100000748208 [0,2,0,0,0,0|1,0,0]=3 18112 B18R2.8976 Cc1cc(ccc1F)CNCc2ccccc2 34a_100000239911_100015291786 [0,2,0,0,0,0|1,0,0]=3 18113 B18R2.8976 Cc1cc(ccc1F)CNCc2ccccc2 34a_100015324214_100011216667 [0,2,0,0,0,0|1,0,0]=3 18114 B18R2.8976 Cc1cc(ccc1F)CNCc2ccccn2 207a_100000239911_100000209966 [0,2,0,0,0,0|2,0,0]=4 18115 B18R2.8976 Cc1cc(ccc1F)CNCc2ccccn2 2230a_100000239911_100000721315 [0,2,0,0,0,0|2,0,0]=4 18116 B18R2.8976 Cc1cc(ccc1F)CNCc2ccccn2 270004a_100000210449_100000748208 [0,2,0,0,0,0|2,0,0]=4 18117 B18R2.8976 Cc1cc(ccc1F)CNCc2ccccn2 270004a_100000239911_100000209966 [0,2,0,0,0,0|2,0,0]=4 18118 B18R2.8976 Cc1cc(ccc1F)CNCc2ccccn2 34a_100000239911_100000721315 [0,2,0,0,0,0|2,0,0]=4 18119 B18R2.8976 Cc1cc(ccc1F)CNCc2cccnc2 207a_100000210453_100000748208 [0,2,0,0,0,0|2,0,0]=4 18120 B18R2.8976 Cc1cc(ccc1F)CNCc2cccnc2 207a_100000239911_100000209961 [0,2,0,0,0,0|2,0,0]=4 18121 B18R2.8976 Cc1cc(ccc1F)CNCc2cccnc2 2230a_100000239911_100000741622 [0,2,0,0,0,0|2,0,0]=4 18122 B18R2.8976 Cc1cc(ccc1F)CNCc2cccnc2 270004a_100000210453_100000748208 [0,2,0,0,0,0|2,0,0]=4 18123 B18R2.8976 Cc1cc(ccc1F)CNCc2cccnc2 270004a_100000239911_100000209961 [0,2,0,0,0,0|2,0,0]=4 18124 B18R2.8976 Cc1cc(ccc1F)CNCc2cccnc2 34a_100000239911_100000733263 [0,2,0,0,0,0|2,0,0]=4 18125 B18R2.8976 Cc1cc(ccc1F)CNCc2ccncc2 207a_100000239911_100000186114 [0,2,0,0,0,0|2,0,0]=4 18126 B18R2.8976 Cc1cc(ccc1F)CNCc2ccncc2 2230a_100000239911_100015193705 [0,2,0,0,0,0|2,0,0]=4 18127 B18R2.8976 Cc1cc(ccc1F)COCc2ccccc2 34a_100000210790_100011216667 [0,2,0,0,0,0|0,0,0]=2 18128 B18R2.8976 Cc1cc(ccc1F)COCc2ccccc2 34a_100011219793_100015291786 [0,2,0,0,0,0|0,0,0]=2 18129 B18R2.8976 Cc1cc(ccc1F)COCc2ccccc2 7a_100000210790_100011216667 [0,2,0,0,0,0|0,0,0]=2 18130 B18R2.8976 Cc1cc(ccc1F)COCc2ccccc2 7a_100011219793_100000211182 [0,2,0,0,0,0|0,0,0]=2 18131 B18R2.8976 Cc1cc(ccc1F)COCc2ccccn2 34a_100011219793_100000721315 [0,2,0,0,0,0|1,0,0]=3 18132 B18R2.8976 Cc1cc(ccc1F)COCc2ccccn2 7a_100011219793_100000721315 [0,2,0,0,0,0|1,0,0]=3 18133 B18R2.8976 Cc1cc(ccc1F)COCc2cccnc2 34a_100011219793_100000733263 [0,2,0,0,0,0|1,0,0]=3 18134 B18R2.8976 Cc1cc(ccc1F)COCc2cccnc2 7a_100011219793_100000741622 [0,2,0,0,0,0|1,0,0]=3 18135 B18R2.8976 Cc1cc(ccc1F)COCc2cccnn2 34a_100011219793_100016990269 [0,2,0,0,0,0|2,0,0]=4 18136 B18R2.8976 Cc1cc(ccc1F)COCc2cccnn2 7a_100011219793_100016990269 [0,2,0,0,0,0|2,0,0]=4 18137 B18R2.8976 Cc1cc(ccc1F)COCc2ccncc2 7a_100011219793_100015193705 [0,2,0,0,0,0|1,0,0]=3 18138 B18R2.8976 Cc1cc(ccc1F)COCc2cnccn2 34a_100011219793_100016995436 [0,2,0,0,0,0|2,0,0]=4 18139 B18R2.8976 Cc1cc(ccc1F)COCc2cnccn2 7a_100011219793_100016995436 [0,2,0,0,0,0|2,0,0]=4 18140 B18R2.8976 Cc1cc(ccc1F)COCc2cncnc2 34a_100011219793_100015196519 [0,2,0,0,0,0|2,0,0]=4 18141 B18R2.8976 Cc1cc(ccc1F)COCc2cncnc2 7a_100011219793_100015196519 [0,2,0,0,0,0|2,0,0]=4 18142 B18R2.8976 Cc1cc(ccc1F)COCc2ncccn2 34a_100011219793_100000703007 [0,2,0,0,0,0|2,0,0]=4 18143 B18R2.8976 Cc1cc(ccc1F)COCc2ncccn2 7a_100011219793_100000703007 [0,2,0,0,0,0|2,0,0]=4 18144 B18R2.8976 Cc1cc(ccc1F)CSCc2ccccc2 62a_100000211182_100011216667 [0,2,0,0,0,0|0,1,0]=3 18145 B18R2.8976 Cc1cc(ccc1F)CSCc2ccccc2 62a_100011216667_100015291786 [0,2,0,0,0,0|0,1,0]=3 18146 B18R2.8976 Cc1cc(ccc1F)CSCc2ccccn2 62a_100000721315_100011216667 [0,2,0,0,0,0|1,1,0]=4 18147 B18R2.8976 Cc1cc(ccc1F)CSCc2ccccn2 62a_100011216667_100000721315 [0,2,0,0,0,0|1,1,0]=4 18148 B18R2.8976 Cc1cc(ccc1F)CSCc2cccnc2 62a_100000741622_100011216667 [0,2,0,0,0,0|1,1,0]=4 18149 B18R2.8976 Cc1cc(ccc1F)CSCc2cccnc2 62a_100011216667_100000741622 [0,2,0,0,0,0|1,1,0]=4 18150 B18R2.8976 Cc1cc(ccc1F)CSCc2ccncc2 62a_100011216667_100015193705 [0,2,0,0,0,0|1,1,0]=4 18151 B18R2.8976 Cc1cc(ccc1F)CSCc2ccncc2 62a_100015193705_100011216667 [0,2,0,0,0,0|1,1,0]=4 18152 B18R2.8976 Cc1cc(ccc1F)NCCc2ccccc2 2230a_100000750164_100000765856 [0,2,0,0,0,0|2,0,0]=4 18153 B18R2.8976 Cc1cc(ccc1F)NCCc2ccccc2 34a_100000750164_100000765856 [0,2,0,0,0,0|2,0,0]=4 18154 B18R2.8976 Cc1cc(ccc1F)NCCc2ccccc2 7a_100000750164_100000765856 [0,2,0,0,0,0|2,0,0]=4 18155 B18R2.8976 Cc1cc(ccc1F)OCCc2ccccc2 34a_100000751312_100000765856 [0,2,0,0,0,0|2,0,0]=4 18156 B18R2.8976 Cc1cc(ccc1F)OCCc2ccccc2 7a_100000751312_100000765856 [0,2,0,0,0,0|2,0,0]=4 18157 B18R2.8976 Cc1cc(ccc1F)SCCc2ccccc2 62a_100000765856_100011218330 [0,2,0,0,0,0|2,0,0]=4 18158 B18R2.8976 Cc1cc(ccc1F)SCCc2ccccc2 62a_100011218330_100011218657 [0,2,0,0,0,0|2,0,0]=4 18159 B18R2.8976 Cc1cc(ccc1I)NCCc2ccccc2 34a_100000198070_100000765856 [0,2,0,0,0,0|2,0,0]=4 18160 B18R2.8976 Cc1cc(ccc1I)NCCc2ccccc2 7a_100000198070_100000765856 [0,2,0,0,0,0|2,0,0]=4 18161 B18R2.8976 Cc1cc(ccc1I)OCCc2ccccc2 34a_100000729255_100000765856 [0,2,0,0,0,0|2,0,0]=4 18162 B18R2.8976 Cc1cc(ccc1I)OCCc2ccccc2 7a_100000729255_100000765856 [0,2,0,0,0,0|2,0,0]=4 18163 B18R2.8976 Cc1cc(ccc1N)C=CCc2ccccc2 271570a_200016263579_100000211769 [0,2,0,0,0,0|1,0,1]=4 18164 B18R2.8976 Cc1cc(ccc1N)COCc2ccccc2 34a_200011997030_100015291786 [0,2,0,0,0,0|0,0,0]=2 18165 B18R2.8976 Cc1cc(ccc1N)COCc2ccccn2 34a_200011997030_100000721315 [0,2,0,0,0,0|1,0,0]=3 18166 B18R2.8976 Cc1cc(ccc1N)COCc2cccnc2 34a_200011997030_100000733263 [0,2,0,0,0,0|1,0,0]=3 18167 B18R2.8976 Cc1cc(ccc1N)COCc2cccnn2 34a_200011997030_100016990269 [0,2,0,0,0,0|2,0,0]=4 18168 B18R2.8976 Cc1cc(ccc1N)COCc2cnccn2 34a_200011997030_100016995436 [0,2,0,0,0,0|2,0,0]=4 18169 B18R2.8976 Cc1cc(ccc1N)COCc2cncnc2 34a_200011997030_100015196519 [0,2,0,0,0,0|2,0,0]=4 18170 B18R2.8976 Cc1cc(ccc1N)COCc2ncccn2 34a_200011997030_100000703007 [0,2,0,0,0,0|2,0,0]=4 18171 B18R2.8976 Cc1cc(ccc1N)OCCc2ccccc2 34a_100000756630_100000765856 [0,2,0,0,0,0|2,0,0]=4 18172 B18R2.8976 Cc1cc(ccc1N)OCCc2ccccc2 7a_100000756630_100000765856 [0,2,0,0,0,0|2,0,0]=4 18173 B18R2.8976 Cc1cc(ccc1N)SCCc2ccccc2 62a_100000211769_100011218657 [0,2,0,0,0,0|2,0,0]=4 18174 B18R2.8976 Cc1cc(ccc1N)SCCc2ccccc2 62a_100000765856_100000211769 [0,2,0,0,0,0|2,0,0]=4 18175 B18R2.8976 Cc1cc(ccc1O)C=CCc2ccccc2 271570a_200016263579_100000186361 [0,2,0,0,0,0|1,0,1]=4 18176 B18R2.8976 Cc1cc(ccc1O)NCCc2ccccc2 34a_100011218179_100000765856 [0,2,0,0,0,0|2,0,0]=4 18177 B18R2.8976 Cc1cc(ccc1O)NCCc2ccccc2 7a_100011218179_100000765856 [0,2,0,0,0,0|2,0,0]=4 18178 B18R2.8976 Cc1cc(ccc1O)SCCc2ccccc2 62a_100000765856_100000186361 [0,2,0,0,0,0|2,0,0]=4 18179 B18R2.8976 Cc1cc(cnc1Br)CNCc2ccccc2 270004a_100015324214_100009814818 [0,2,0,0,0,0|2,0,0]=4 18180 B18R2.8976 Cc1cc(cnc1Cl)CNCc2ccccc2 207a_100015324214_100000070293 [0,2,0,0,0,0|2,0,0]=4 18181 B18R2.8976 Cc1cc(cnc1Cl)CNCc2ccccc2 270004a_100015324214_100000070293 [0,2,0,0,0,0|2,0,0]=4 18182 B18R2.8976 Cc1cc(cnc1Cl)COCc2ccccc2 34a_200000092119_100015291786 [0,2,0,0,0,0|1,0,0]=3 18183 B18R2.8976 Cc1cc(cnc1Cl)COCc2ccccc2 7a_200000092119_100000211182 [0,2,0,0,0,0|1,0,0]=3 18184 B18R2.8976 Cc1cc(cnc1Cl)COCc2ccccn2 34a_200000092119_100000721315 [0,2,0,0,0,0|2,0,0]=4 18185 B18R2.8976 Cc1cc(cnc1Cl)COCc2ccccn2 7a_200000092119_100000721315 [0,2,0,0,0,0|2,0,0]=4 18186 B18R2.8976 Cc1cc(cnc1Cl)COCc2cccnc2 34a_200000092119_100000733263 [0,2,0,0,0,0|2,0,0]=4 18187 B18R2.8976 Cc1cc(cnc1Cl)COCc2cccnc2 7a_200000092119_100000741622 [0,2,0,0,0,0|2,0,0]=4 18188 B18R2.8976 Cc1cc(cnc1Cl)COCc2ccncc2 7a_200000092119_100015193705 [0,2,0,0,0,0|2,0,0]=4 18189 B18R2.8976 Cc1cc(cnc1F)CNCc2ccccc2 270004a_100015324214_100000050577 [0,2,0,0,0,0|2,0,0]=4 18190 B18R2.8976 Cc1cc(ncc1Br)CNCc2ccccc2 207a_100015324214_100009814806 [0,2,0,0,0,0|2,0,0]=4 18191 B18R2.8976 Cc1cc(ncc1Br)CNCc2ccccc2 270004a_100015324214_100009814806 [0,2,0,0,0,0|2,0,0]=4 18192 B18R2.8976 Cc1cc(ncc1Br)COCc2ccccc2 34a_200010713146_100015291786 [0,2,0,0,0,0|1,0,0]=3 18193 B18R2.8976 Cc1cc(ncc1Br)COCc2ccccn2 34a_200010713146_100000721315 [0,2,0,0,0,0|2,0,0]=4 18194 B18R2.8976 Cc1cc(ncc1Br)COCc2cccnc2 34a_200010713146_100000733263 [0,2,0,0,0,0|2,0,0]=4 18195 B18R2.8976 Cc1ccc(cc1Br)C=CCc2ccccc2 271570a_200016263579_100011847877 [0,2,0,0,0,0|1,0,1]=4 18196 B18R2.8976 Cc1ccc(cc1Br)CNCc2ccccc2 207a_100015324214_100000695567 [0,2,0,0,0,0|1,0,0]=3 18197 B18R2.8976 Cc1ccc(cc1Br)CNCc2ccccc2 2230a_100015324214_100012232412 [0,2,0,0,0,0|1,0,0]=3 18198 B18R2.8976 Cc1ccc(cc1Br)CNCc2ccccc2 270004a_100015324214_100000695567 [0,2,0,0,0,0|1,0,0]=3 18199 B18R2.8976 Cc1ccc(cc1Br)CNCc2ccccc2 34a_100015324214_100012232412 [0,2,0,0,0,0|1,0,0]=3 18200 B18R2.8976 Cc1ccc(cc1Br)CNCc2ccccn2 270004a_100000210449_100000695567 [0,2,0,0,0,0|2,0,0]=4 18201 B18R2.8976 Cc1ccc(cc1Br)CNCc2cccnc2 207a_100000210453_100000695567 [0,2,0,0,0,0|2,0,0]=4 18202 B18R2.8976 Cc1ccc(cc1Br)CNCc2cccnc2 270004a_100000210453_100000695567 [0,2,0,0,0,0|2,0,0]=4 18203 B18R2.8976 Cc1ccc(cc1Br)COCc2ccccc2 34a_100000210790_100012232412 [0,2,0,0,0,0|0,0,0]=2 18204 B18R2.8976 Cc1ccc(cc1Br)COCc2ccccc2 34a_100000708995_100015291786 [0,2,0,0,0,0|0,0,0]=2 18205 B18R2.8976 Cc1ccc(cc1Br)COCc2ccccc2 7a_100000210790_100012232412 [0,2,0,0,0,0|0,0,0]=2 18206 B18R2.8976 Cc1ccc(cc1Br)COCc2ccccc2 7a_100000708995_100000211182 [0,2,0,0,0,0|0,0,0]=2 18207 B18R2.8976 Cc1ccc(cc1Br)COCc2ccccn2 34a_100000708995_100000721315 [0,2,0,0,0,0|1,0,0]=3 18208 B18R2.8976 Cc1ccc(cc1Br)COCc2ccccn2 7a_100000708995_100000721315 [0,2,0,0,0,0|1,0,0]=3 18209 B18R2.8976 Cc1ccc(cc1Br)COCc2cccnc2 34a_100000708995_100000733263 [0,2,0,0,0,0|1,0,0]=3 18210 B18R2.8976 Cc1ccc(cc1Br)COCc2cccnc2 7a_100000708995_100000741622 [0,2,0,0,0,0|1,0,0]=3 18211 B18R2.8976 Cc1ccc(cc1Br)COCc2cccnn2 34a_100000708995_100016990269 [0,2,0,0,0,0|2,0,0]=4 18212 B18R2.8976 Cc1ccc(cc1Br)COCc2cccnn2 7a_100000708995_100016990269 [0,2,0,0,0,0|2,0,0]=4 18213 B18R2.8976 Cc1ccc(cc1Br)COCc2ccncc2 7a_100000708995_100015193705 [0,2,0,0,0,0|1,0,0]=3 18214 B18R2.8976 Cc1ccc(cc1Br)COCc2cnccn2 34a_100000708995_100016995436 [0,2,0,0,0,0|2,0,0]=4 18215 B18R2.8976 Cc1ccc(cc1Br)COCc2cnccn2 7a_100000708995_100016995436 [0,2,0,0,0,0|2,0,0]=4 18216 B18R2.8976 Cc1ccc(cc1Br)COCc2cncnc2 34a_100000708995_100015196519 [0,2,0,0,0,0|2,0,0]=4 18217 B18R2.8976 Cc1ccc(cc1Br)COCc2cncnc2 7a_100000708995_100015196519 [0,2,0,0,0,0|2,0,0]=4 18218 B18R2.8976 Cc1ccc(cc1Br)COCc2ncccn2 34a_100000708995_100000703007 [0,2,0,0,0,0|2,0,0]=4 18219 B18R2.8976 Cc1ccc(cc1Br)COCc2ncccn2 7a_100000708995_100000703007 [0,2,0,0,0,0|2,0,0]=4 18220 B18R2.8976 Cc1ccc(cc1Br)CSCc2ccccc2 62a_100000211182_100012232412 [0,2,0,0,0,0|0,1,0]=3 18221 B18R2.8976 Cc1ccc(cc1Br)CSCc2ccccc2 62a_100012232412_100015291786 [0,2,0,0,0,0|0,1,0]=3 18222 B18R2.8976 Cc1ccc(cc1Br)CSCc2ccccn2 62a_100000721315_100012232412 [0,2,0,0,0,0|1,1,0]=4 18223 B18R2.8976 Cc1ccc(cc1Br)CSCc2ccccn2 62a_100012232412_100000721315 [0,2,0,0,0,0|1,1,0]=4 18224 B18R2.8976 Cc1ccc(cc1Br)CSCc2cccnc2 62a_100000741622_100012232412 [0,2,0,0,0,0|1,1,0]=4 18225 B18R2.8976 Cc1ccc(cc1Br)CSCc2cccnc2 62a_100012232412_100000741622 [0,2,0,0,0,0|1,1,0]=4 18226 B18R2.8976 Cc1ccc(cc1Br)CSCc2ccncc2 62a_100012232412_100015193705 [0,2,0,0,0,0|1,1,0]=4 18227 B18R2.8976 Cc1ccc(cc1Br)CSCc2ccncc2 62a_100015193705_100012232412 [0,2,0,0,0,0|1,1,0]=4 18228 B18R2.8976 Cc1ccc(cc1Br)NCCc2ccccc2 2230a_100000736455_100000765856 [0,2,0,0,0,0|2,0,0]=4 18229 B18R2.8976 Cc1ccc(cc1Br)NCCc2ccccc2 34a_100000736455_100000765856 [0,2,0,0,0,0|2,0,0]=4 18230 B18R2.8976 Cc1ccc(cc1Br)NCCc2ccccc2 7a_100000736455_100000765856 [0,2,0,0,0,0|2,0,0]=4 18231 B18R2.8976 Cc1ccc(cc1Br)OCCc2ccccc2 34a_100011380479_100000765856 [0,2,0,0,0,0|2,0,0]=4 18232 B18R2.8976 Cc1ccc(cc1Br)OCCc2ccccc2 7a_100011380479_100000765856 [0,2,0,0,0,0|2,0,0]=4 18233 B18R2.8976 Cc1ccc(cc1Br)SCCc2ccccc2 62a_100000765856_100011847877 [0,2,0,0,0,0|2,0,0]=4 18234 B18R2.8976 Cc1ccc(cc1Br)SCCc2ccccc2 62a_100011847877_100011218657 [0,2,0,0,0,0|2,0,0]=4 18235 B18R2.8976 Cc1ccc(cc1C)C=CCc2ccccc2 271570a_200016263579_100011215607 [0,2,0,0,0,0|1,0,1]=4 18236 B18R2.8976 Cc1ccc(cc1C)CNCc2ccccc2 207a_100015324214_100000229942 [0,2,0,0,0,0|1,0,0]=3 18237 B18R2.8976 Cc1ccc(cc1C)CNCc2ccccc2 207a_100025706692_100015611070 [0,2,0,0,0,0|1,0,0]=3 18238 B18R2.8976 Cc1ccc(cc1C)CNCc2ccccc2 2230a_100015324214_100000742320 [0,2,0,0,0,0|1,0,0]=3 18239 B18R2.8976 Cc1ccc(cc1C)CNCc2ccccc2 2230a_100025706692_100015291786 [0,2,0,0,0,0|1,0,0]=3 18240 B18R2.8976 Cc1ccc(cc1C)CNCc2ccccc2 270004a_100015324214_100000229942 [0,2,0,0,0,0|1,0,0]=3 18241 B18R2.8976 Cc1ccc(cc1C)CNCc2ccccc2 270004a_100025706692_100015611070 [0,2,0,0,0,0|1,0,0]=3 18242 B18R2.8976 Cc1ccc(cc1C)CNCc2ccccc2 34a_100015324214_100000742320 [0,2,0,0,0,0|1,0,0]=3 18243 B18R2.8976 Cc1ccc(cc1C)CNCc2ccccc2 34a_100025706692_100015291786 [0,2,0,0,0,0|1,0,0]=3 18244 B18R2.8976 Cc1ccc(cc1C)CNCc2ccccn2 207a_100025706692_100000209966 [0,2,0,0,0,0|2,0,0]=4 18245 B18R2.8976 Cc1ccc(cc1C)CNCc2ccccn2 2230a_100025706692_100000721315 [0,2,0,0,0,0|2,0,0]=4 18246 B18R2.8976 Cc1ccc(cc1C)CNCc2ccccn2 270004a_100000210449_100000229942 [0,2,0,0,0,0|2,0,0]=4 18247 B18R2.8976 Cc1ccc(cc1C)CNCc2ccccn2 270004a_100025706692_100000209966 [0,2,0,0,0,0|2,0,0]=4 18248 B18R2.8976 Cc1ccc(cc1C)CNCc2ccccn2 34a_100025706692_100000721315 [0,2,0,0,0,0|2,0,0]=4 18249 B18R2.8976 Cc1ccc(cc1C)CNCc2cccnc2 207a_100000210453_100000229942 [0,2,0,0,0,0|2,0,0]=4 18250 B18R2.8976 Cc1ccc(cc1C)CNCc2cccnc2 207a_100025706692_100000209961 [0,2,0,0,0,0|2,0,0]=4 18251 B18R2.8976 Cc1ccc(cc1C)CNCc2cccnc2 2230a_100025706692_100000741622 [0,2,0,0,0,0|2,0,0]=4 18252 B18R2.8976 Cc1ccc(cc1C)CNCc2cccnc2 270004a_100000210453_100000229942 [0,2,0,0,0,0|2,0,0]=4 18253 B18R2.8976 Cc1ccc(cc1C)CNCc2cccnc2 270004a_100025706692_100000209961 [0,2,0,0,0,0|2,0,0]=4 18254 B18R2.8976 Cc1ccc(cc1C)CNCc2cccnc2 34a_100025706692_100000733263 [0,2,0,0,0,0|2,0,0]=4 18255 B18R2.8976 Cc1ccc(cc1C)CNCc2ccncc2 207a_100025706692_100000186114 [0,2,0,0,0,0|2,0,0]=4 18256 B18R2.8976 Cc1ccc(cc1C)CNCc2ccncc2 2230a_100025706692_100015193705 [0,2,0,0,0,0|2,0,0]=4 18257 B18R2.8976 Cc1ccc(cc1C)COCc2ccccc2 34a_100000210790_100000742320 [0,2,0,0,0,0|0,0,0]=2 18258 B18R2.8976 Cc1ccc(cc1C)COCc2ccccc2 34a_100011215342_100015291786 [0,2,0,0,0,0|0,0,0]=2 18259 B18R2.8976 Cc1ccc(cc1C)COCc2ccccc2 7a_100000210790_100000742320 [0,2,0,0,0,0|0,0,0]=2 18260 B18R2.8976 Cc1ccc(cc1C)COCc2ccccc2 7a_100011215342_100000211182 [0,2,0,0,0,0|0,0,0]=2 18261 B18R2.8976 Cc1ccc(cc1C)COCc2ccccn2 34a_100011215342_100000721315 [0,2,0,0,0,0|1,0,0]=3 18262 B18R2.8976 Cc1ccc(cc1C)COCc2ccccn2 7a_100011215342_100000721315 [0,2,0,0,0,0|1,0,0]=3 18263 B18R2.8976 Cc1ccc(cc1C)COCc2cccnc2 34a_100011215342_100000733263 [0,2,0,0,0,0|1,0,0]=3 18264 B18R2.8976 Cc1ccc(cc1C)COCc2cccnc2 7a_100011215342_100000741622 [0,2,0,0,0,0|1,0,0]=3 18265 B18R2.8976 Cc1ccc(cc1C)COCc2cccnn2 34a_100011215342_100016990269 [0,2,0,0,0,0|2,0,0]=4 18266 B18R2.8976 Cc1ccc(cc1C)COCc2cccnn2 7a_100011215342_100016990269 [0,2,0,0,0,0|2,0,0]=4 18267 B18R2.8976 Cc1ccc(cc1C)COCc2ccncc2 7a_100011215342_100015193705 [0,2,0,0,0,0|1,0,0]=3 18268 B18R2.8976 Cc1ccc(cc1C)COCc2cnccn2 34a_100011215342_100016995436 [0,2,0,0,0,0|2,0,0]=4 18269 B18R2.8976 Cc1ccc(cc1C)COCc2cnccn2 7a_100011215342_100016995436 [0,2,0,0,0,0|2,0,0]=4 18270 B18R2.8976 Cc1ccc(cc1C)COCc2cncnc2 34a_100011215342_100015196519 [0,2,0,0,0,0|2,0,0]=4 18271 B18R2.8976 Cc1ccc(cc1C)COCc2cncnc2 7a_100011215342_100015196519 [0,2,0,0,0,0|2,0,0]=4 18272 B18R2.8976 Cc1ccc(cc1C)COCc2ncccn2 34a_100011215342_100000703007 [0,2,0,0,0,0|2,0,0]=4 18273 B18R2.8976 Cc1ccc(cc1C)COCc2ncccn2 7a_100011215342_100000703007 [0,2,0,0,0,0|2,0,0]=4 18274 B18R2.8976 Cc1ccc(cc1C)CSCc2ccccc2 62a_100000211182_100000742320 [0,2,0,0,0,0|0,1,0]=3 18275 B18R2.8976 Cc1ccc(cc1C)CSCc2ccccc2 62a_100000742320_100015291786 [0,2,0,0,0,0|0,1,0]=3 18276 B18R2.8976 Cc1ccc(cc1C)CSCc2ccccn2 62a_100000721315_100000742320 [0,2,0,0,0,0|1,1,0]=4 18277 B18R2.8976 Cc1ccc(cc1C)CSCc2ccccn2 62a_100000742320_100000721315 [0,2,0,0,0,0|1,1,0]=4 18278 B18R2.8976 Cc1ccc(cc1C)CSCc2cccnc2 62a_100000741622_100000742320 [0,2,0,0,0,0|1,1,0]=4 18279 B18R2.8976 Cc1ccc(cc1C)CSCc2cccnc2 62a_100000742320_100000741622 [0,2,0,0,0,0|1,1,0]=4 18280 B18R2.8976 Cc1ccc(cc1C)CSCc2ccncc2 62a_100000742320_100015193705 [0,2,0,0,0,0|1,1,0]=4 18281 B18R2.8976 Cc1ccc(cc1C)CSCc2ccncc2 62a_100015193705_100000742320 [0,2,0,0,0,0|1,1,0]=4 18282 B18R2.8976 Cc1ccc(cc1C)NCCc2ccccc2 2230a_100000724040_100000765856 [0,2,0,0,0,0|2,0,0]=4 18283 B18R2.8976 Cc1ccc(cc1C)NCCc2ccccc2 34a_100000724040_100000765856 [0,2,0,0,0,0|2,0,0]=4 18284 B18R2.8976 Cc1ccc(cc1C)NCCc2ccccc2 7a_100000724040_100000765856 [0,2,0,0,0,0|2,0,0]=4 18285 B18R2.8976 Cc1ccc(cc1C)OCCc2ccccc2 34a_100000210932_100000765856 [0,2,0,0,0,0|2,0,0]=4 18286 B18R2.8976 Cc1ccc(cc1C)OCCc2ccccc2 7a_100000210932_100000765856 [0,2,0,0,0,0|2,0,0]=4 18287 B18R2.8976 Cc1ccc(cc1C)SCCc2ccccc2 62a_100000765856_100011215607 [0,2,0,0,0,0|2,0,0]=4 18288 B18R2.8976 Cc1ccc(cc1C)SCCc2ccccc2 62a_100011215607_100011218657 [0,2,0,0,0,0|2,0,0]=4 18289 B18R2.8976 Cc1ccc(cc1Cl)C=CCc2ccccc2 271570a_200016263579_100011216363 [0,2,0,0,0,0|1,0,1]=4 18290 B18R2.8976 Cc1ccc(cc1Cl)CNCc2ccccc2 207a_100015324214_100000760539 [0,2,0,0,0,0|1,0,0]=3 18291 B18R2.8976 Cc1ccc(cc1Cl)CNCc2ccccc2 207a_102495364989_100015611070 [0,2,0,0,0,0|1,0,0]=3 18292 B18R2.8976 Cc1ccc(cc1Cl)CNCc2ccccc2 2230a_100015324214_100011823929 [0,2,0,0,0,0|1,0,0]=3 18293 B18R2.8976 Cc1ccc(cc1Cl)CNCc2ccccc2 2230a_102495364989_100015291786 [0,2,0,0,0,0|1,0,0]=3 18294 B18R2.8976 Cc1ccc(cc1Cl)CNCc2ccccc2 270004a_100015324214_100000760539 [0,2,0,0,0,0|1,0,0]=3 18295 B18R2.8976 Cc1ccc(cc1Cl)CNCc2ccccc2 270004a_102495364989_100015611070 [0,2,0,0,0,0|1,0,0]=3 18296 B18R2.8976 Cc1ccc(cc1Cl)CNCc2ccccc2 34a_100015324214_100011823929 [0,2,0,0,0,0|1,0,0]=3 18297 B18R2.8976 Cc1ccc(cc1Cl)CNCc2ccccc2 34a_102495364989_100015291786 [0,2,0,0,0,0|1,0,0]=3 18298 B18R2.8976 Cc1ccc(cc1Cl)CNCc2ccccn2 207a_102495364989_100000209966 [0,2,0,0,0,0|2,0,0]=4 18299 B18R2.8976 Cc1ccc(cc1Cl)CNCc2ccccn2 2230a_102495364989_100000721315 [0,2,0,0,0,0|2,0,0]=4 18300 B18R2.8976 Cc1ccc(cc1Cl)CNCc2ccccn2 270004a_100000210449_100000760539 [0,2,0,0,0,0|2,0,0]=4 18301 B18R2.8976 Cc1ccc(cc1Cl)CNCc2ccccn2 270004a_102495364989_100000209966 [0,2,0,0,0,0|2,0,0]=4 18302 B18R2.8976 Cc1ccc(cc1Cl)CNCc2ccccn2 34a_102495364989_100000721315 [0,2,0,0,0,0|2,0,0]=4 18303 B18R2.8976 Cc1ccc(cc1Cl)CNCc2cccnc2 207a_100000210453_100000760539 [0,2,0,0,0,0|2,0,0]=4 18304 B18R2.8976 Cc1ccc(cc1Cl)CNCc2cccnc2 207a_102495364989_100000209961 [0,2,0,0,0,0|2,0,0]=4 18305 B18R2.8976 Cc1ccc(cc1Cl)CNCc2cccnc2 2230a_102495364989_100000741622 [0,2,0,0,0,0|2,0,0]=4 18306 B18R2.8976 Cc1ccc(cc1Cl)CNCc2cccnc2 270004a_100000210453_100000760539 [0,2,0,0,0,0|2,0,0]=4 18307 B18R2.8976 Cc1ccc(cc1Cl)CNCc2cccnc2 270004a_102495364989_100000209961 [0,2,0,0,0,0|2,0,0]=4 18308 B18R2.8976 Cc1ccc(cc1Cl)CNCc2cccnc2 34a_102495364989_100000733263 [0,2,0,0,0,0|2,0,0]=4 18309 B18R2.8976 Cc1ccc(cc1Cl)CNCc2ccncc2 207a_102495364989_100000186114 [0,2,0,0,0,0|2,0,0]=4 18310 B18R2.8976 Cc1ccc(cc1Cl)CNCc2ccncc2 2230a_102495364989_100015193705 [0,2,0,0,0,0|2,0,0]=4 18311 B18R2.8976 Cc1ccc(cc1Cl)COCc2ccccc2 34a_100000210790_100011823929 [0,2,0,0,0,0|0,0,0]=2 18312 B18R2.8976 Cc1ccc(cc1Cl)COCc2ccccc2 34a_100011290783_100015291786 [0,2,0,0,0,0|0,0,0]=2 18313 B18R2.8976 Cc1ccc(cc1Cl)COCc2ccccc2 7a_100000210790_100011823929 [0,2,0,0,0,0|0,0,0]=2 18314 B18R2.8976 Cc1ccc(cc1Cl)COCc2ccccc2 7a_100011290783_100000211182 [0,2,0,0,0,0|0,0,0]=2 18315 B18R2.8976 Cc1ccc(cc1Cl)COCc2ccccn2 34a_100011290783_100000721315 [0,2,0,0,0,0|1,0,0]=3 18316 B18R2.8976 Cc1ccc(cc1Cl)COCc2ccccn2 7a_100011290783_100000721315 [0,2,0,0,0,0|1,0,0]=3 18317 B18R2.8976 Cc1ccc(cc1Cl)COCc2cccnc2 34a_100011290783_100000733263 [0,2,0,0,0,0|1,0,0]=3 18318 B18R2.8976 Cc1ccc(cc1Cl)COCc2cccnc2 7a_100011290783_100000741622 [0,2,0,0,0,0|1,0,0]=3 18319 B18R2.8976 Cc1ccc(cc1Cl)COCc2cccnn2 34a_100011290783_100016990269 [0,2,0,0,0,0|2,0,0]=4 18320 B18R2.8976 Cc1ccc(cc1Cl)COCc2cccnn2 7a_100011290783_100016990269 [0,2,0,0,0,0|2,0,0]=4 18321 B18R2.8976 Cc1ccc(cc1Cl)COCc2ccncc2 7a_100011290783_100015193705 [0,2,0,0,0,0|1,0,0]=3 18322 B18R2.8976 Cc1ccc(cc1Cl)COCc2cnccn2 34a_100011290783_100016995436 [0,2,0,0,0,0|2,0,0]=4 18323 B18R2.8976 Cc1ccc(cc1Cl)COCc2cnccn2 7a_100011290783_100016995436 [0,2,0,0,0,0|2,0,0]=4 18324 B18R2.8976 Cc1ccc(cc1Cl)COCc2cncnc2 34a_100011290783_100015196519 [0,2,0,0,0,0|2,0,0]=4 18325 B18R2.8976 Cc1ccc(cc1Cl)COCc2cncnc2 7a_100011290783_100015196519 [0,2,0,0,0,0|2,0,0]=4 18326 B18R2.8976 Cc1ccc(cc1Cl)COCc2ncccn2 34a_100011290783_100000703007 [0,2,0,0,0,0|2,0,0]=4 18327 B18R2.8976 Cc1ccc(cc1Cl)COCc2ncccn2 7a_100011290783_100000703007 [0,2,0,0,0,0|2,0,0]=4 18328 B18R2.8976 Cc1ccc(cc1Cl)CSCc2ccccc2 62a_100000211182_100011823929 [0,2,0,0,0,0|0,1,0]=3 18329 B18R2.8976 Cc1ccc(cc1Cl)CSCc2ccccc2 62a_100011823929_100015291786 [0,2,0,0,0,0|0,1,0]=3 18330 B18R2.8976 Cc1ccc(cc1Cl)CSCc2ccccn2 62a_100000721315_100011823929 [0,2,0,0,0,0|1,1,0]=4 18331 B18R2.8976 Cc1ccc(cc1Cl)CSCc2ccccn2 62a_100011823929_100000721315 [0,2,0,0,0,0|1,1,0]=4 18332 B18R2.8976 Cc1ccc(cc1Cl)CSCc2cccnc2 62a_100000741622_100011823929 [0,2,0,0,0,0|1,1,0]=4 18333 B18R2.8976 Cc1ccc(cc1Cl)CSCc2cccnc2 62a_100011823929_100000741622 [0,2,0,0,0,0|1,1,0]=4 18334 B18R2.8976 Cc1ccc(cc1Cl)CSCc2ccncc2 62a_100011823929_100015193705 [0,2,0,0,0,0|1,1,0]=4 18335 B18R2.8976 Cc1ccc(cc1Cl)CSCc2ccncc2 62a_100015193705_100011823929 [0,2,0,0,0,0|1,1,0]=4 18336 B18R2.8976 Cc1ccc(cc1Cl)NCCc2ccccc2 2230a_100000188892_100000765856 [0,2,0,0,0,0|2,0,0]=4 18337 B18R2.8976 Cc1ccc(cc1Cl)NCCc2ccccc2 34a_100000188892_100000765856 [0,2,0,0,0,0|2,0,0]=4 18338 B18R2.8976 Cc1ccc(cc1Cl)NCCc2ccccc2 7a_100000188892_100000765856 [0,2,0,0,0,0|2,0,0]=4 18339 B18R2.8976 Cc1ccc(cc1Cl)OCCc2ccccc2 34a_100011265682_100000765856 [0,2,0,0,0,0|2,0,0]=4 18340 B18R2.8976 Cc1ccc(cc1Cl)OCCc2ccccc2 7a_100011265682_100000765856 [0,2,0,0,0,0|2,0,0]=4 18341 B18R2.8976 Cc1ccc(cc1Cl)SCCc2ccccc2 62a_100000765856_100011216363 [0,2,0,0,0,0|2,0,0]=4 18342 B18R2.8976 Cc1ccc(cc1Cl)SCCc2ccccc2 62a_100011216363_100011218657 [0,2,0,0,0,0|2,0,0]=4 18343 B18R2.8976 Cc1ccc(cc1F)C=CCc2ccccc2 271570a_200016263579_100000720648 [0,2,0,0,0,0|1,0,1]=4 18344 B18R2.8976 Cc1ccc(cc1F)CNCc2ccccc2 207a_100015324214_100000753222 [0,2,0,0,0,0|1,0,0]=3 18345 B18R2.8976 Cc1ccc(cc1F)CNCc2ccccc2 207a_100102708794_100015611070 [0,2,0,0,0,0|1,0,0]=3 18346 B18R2.8976 Cc1ccc(cc1F)CNCc2ccccc2 2230a_100015324214_100011217369 [0,2,0,0,0,0|1,0,0]=3 18347 B18R2.8976 Cc1ccc(cc1F)CNCc2ccccc2 2230a_100102708794_100015291786 [0,2,0,0,0,0|1,0,0]=3 18348 B18R2.8976 Cc1ccc(cc1F)CNCc2ccccc2 270004a_100015324214_100000753222 [0,2,0,0,0,0|1,0,0]=3 18349 B18R2.8976 Cc1ccc(cc1F)CNCc2ccccc2 270004a_100102708794_100015611070 [0,2,0,0,0,0|1,0,0]=3 18350 B18R2.8976 Cc1ccc(cc1F)CNCc2ccccc2 34a_100015324214_100011217369 [0,2,0,0,0,0|1,0,0]=3 18351 B18R2.8976 Cc1ccc(cc1F)CNCc2ccccc2 34a_100102708794_100015291786 [0,2,0,0,0,0|1,0,0]=3 18352 B18R2.8976 Cc1ccc(cc1F)CNCc2ccccn2 207a_100102708794_100000209966 [0,2,0,0,0,0|2,0,0]=4 18353 B18R2.8976 Cc1ccc(cc1F)CNCc2ccccn2 2230a_100102708794_100000721315 [0,2,0,0,0,0|2,0,0]=4 18354 B18R2.8976 Cc1ccc(cc1F)CNCc2ccccn2 270004a_100000210449_100000753222 [0,2,0,0,0,0|2,0,0]=4 18355 B18R2.8976 Cc1ccc(cc1F)CNCc2ccccn2 270004a_100102708794_100000209966 [0,2,0,0,0,0|2,0,0]=4 18356 B18R2.8976 Cc1ccc(cc1F)CNCc2ccccn2 34a_100102708794_100000721315 [0,2,0,0,0,0|2,0,0]=4 18357 B18R2.8976 Cc1ccc(cc1F)CNCc2cccnc2 207a_100000210453_100000753222 [0,2,0,0,0,0|2,0,0]=4 18358 B18R2.8976 Cc1ccc(cc1F)CNCc2cccnc2 207a_100102708794_100000209961 [0,2,0,0,0,0|2,0,0]=4 18359 B18R2.8976 Cc1ccc(cc1F)CNCc2cccnc2 2230a_100102708794_100000741622 [0,2,0,0,0,0|2,0,0]=4 18360 B18R2.8976 Cc1ccc(cc1F)CNCc2cccnc2 270004a_100000210453_100000753222 [0,2,0,0,0,0|2,0,0]=4 18361 B18R2.8976 Cc1ccc(cc1F)CNCc2cccnc2 270004a_100102708794_100000209961 [0,2,0,0,0,0|2,0,0]=4 18362 B18R2.8976 Cc1ccc(cc1F)CNCc2cccnc2 34a_100102708794_100000733263 [0,2,0,0,0,0|2,0,0]=4 18363 B18R2.8976 Cc1ccc(cc1F)CNCc2ccncc2 207a_100102708794_100000186114 [0,2,0,0,0,0|2,0,0]=4 18364 B18R2.8976 Cc1ccc(cc1F)CNCc2ccncc2 2230a_100102708794_100015193705 [0,2,0,0,0,0|2,0,0]=4 18365 B18R2.8976 Cc1ccc(cc1F)COCc2ccccc2 34a_100000210790_100011217369 [0,2,0,0,0,0|0,0,0]=2 18366 B18R2.8976 Cc1ccc(cc1F)COCc2ccccc2 34a_100000702247_100015291786 [0,2,0,0,0,0|0,0,0]=2 18367 B18R2.8976 Cc1ccc(cc1F)COCc2ccccc2 7a_100000210790_100011217369 [0,2,0,0,0,0|0,0,0]=2 18368 B18R2.8976 Cc1ccc(cc1F)COCc2ccccc2 7a_100000702247_100000211182 [0,2,0,0,0,0|0,0,0]=2 18369 B18R2.8976 Cc1ccc(cc1F)COCc2ccccn2 34a_100000702247_100000721315 [0,2,0,0,0,0|1,0,0]=3 18370 B18R2.8976 Cc1ccc(cc1F)COCc2ccccn2 7a_100000702247_100000721315 [0,2,0,0,0,0|1,0,0]=3 18371 B18R2.8976 Cc1ccc(cc1F)COCc2cccnc2 34a_100000702247_100000733263 [0,2,0,0,0,0|1,0,0]=3 18372 B18R2.8976 Cc1ccc(cc1F)COCc2cccnc2 7a_100000702247_100000741622 [0,2,0,0,0,0|1,0,0]=3 18373 B18R2.8976 Cc1ccc(cc1F)COCc2cccnn2 34a_100000702247_100016990269 [0,2,0,0,0,0|2,0,0]=4 18374 B18R2.8976 Cc1ccc(cc1F)COCc2cccnn2 7a_100000702247_100016990269 [0,2,0,0,0,0|2,0,0]=4 18375 B18R2.8976 Cc1ccc(cc1F)COCc2ccncc2 7a_100000702247_100015193705 [0,2,0,0,0,0|1,0,0]=3 18376 B18R2.8976 Cc1ccc(cc1F)COCc2cnccn2 34a_100000702247_100016995436 [0,2,0,0,0,0|2,0,0]=4 18377 B18R2.8976 Cc1ccc(cc1F)COCc2cnccn2 7a_100000702247_100016995436 [0,2,0,0,0,0|2,0,0]=4 18378 B18R2.8976 Cc1ccc(cc1F)COCc2cncnc2 34a_100000702247_100015196519 [0,2,0,0,0,0|2,0,0]=4 18379 B18R2.8976 Cc1ccc(cc1F)COCc2cncnc2 7a_100000702247_100015196519 [0,2,0,0,0,0|2,0,0]=4 18380 B18R2.8976 Cc1ccc(cc1F)COCc2ncccn2 34a_100000702247_100000703007 [0,2,0,0,0,0|2,0,0]=4 18381 B18R2.8976 Cc1ccc(cc1F)COCc2ncccn2 7a_100000702247_100000703007 [0,2,0,0,0,0|2,0,0]=4 18382 B18R2.8976 Cc1ccc(cc1F)CSCc2ccccc2 62a_100000211182_100011217369 [0,2,0,0,0,0|0,1,0]=3 18383 B18R2.8976 Cc1ccc(cc1F)CSCc2ccccc2 62a_100011217369_100015291786 [0,2,0,0,0,0|0,1,0]=3 18384 B18R2.8976 Cc1ccc(cc1F)CSCc2ccccn2 62a_100000721315_100011217369 [0,2,0,0,0,0|1,1,0]=4 18385 B18R2.8976 Cc1ccc(cc1F)CSCc2ccccn2 62a_100011217369_100000721315 [0,2,0,0,0,0|1,1,0]=4 18386 B18R2.8976 Cc1ccc(cc1F)CSCc2cccnc2 62a_100000741622_100011217369 [0,2,0,0,0,0|1,1,0]=4 18387 B18R2.8976 Cc1ccc(cc1F)CSCc2cccnc2 62a_100011217369_100000741622 [0,2,0,0,0,0|1,1,0]=4 18388 B18R2.8976 Cc1ccc(cc1F)CSCc2ccncc2 62a_100011217369_100015193705 [0,2,0,0,0,0|1,1,0]=4 18389 B18R2.8976 Cc1ccc(cc1F)CSCc2ccncc2 62a_100015193705_100011217369 [0,2,0,0,0,0|1,1,0]=4 18390 B18R2.8976 Cc1ccc(cc1F)NCCc2ccccc2 2230a_100000210958_100000765856 [0,2,0,0,0,0|2,0,0]=4 18391 B18R2.8976 Cc1ccc(cc1F)NCCc2ccccc2 34a_100000210958_100000765856 [0,2,0,0,0,0|2,0,0]=4 18392 B18R2.8976 Cc1ccc(cc1F)NCCc2ccccc2 7a_100000210958_100000765856 [0,2,0,0,0,0|2,0,0]=4 18393 B18R2.8976 Cc1ccc(cc1F)OCCc2ccccc2 34a_100000722560_100000765856 [0,2,0,0,0,0|2,0,0]=4 18394 B18R2.8976 Cc1ccc(cc1F)OCCc2ccccc2 7a_100000722560_100000765856 [0,2,0,0,0,0|2,0,0]=4 18395 B18R2.8976 Cc1ccc(cc1F)SCCc2ccccc2 62a_100000720648_100011218657 [0,2,0,0,0,0|2,0,0]=4 18396 B18R2.8976 Cc1ccc(cc1F)SCCc2ccccc2 62a_100000765856_100000720648 [0,2,0,0,0,0|2,0,0]=4 18397 B18R2.8976 Cc1ccc(cc1I)CNCc2ccccc2 207a_100015324214_100010197721 [0,2,0,0,0,0|1,0,0]=3 18398 B18R2.8976 Cc1ccc(cc1I)CNCc2ccccc2 2230a_100015324214_100010206137 [0,2,0,0,0,0|1,0,0]=3 18399 B18R2.8976 Cc1ccc(cc1I)CNCc2ccccc2 270004a_100015324214_100010197721 [0,2,0,0,0,0|1,0,0]=3 18400 B18R2.8976 Cc1ccc(cc1I)CNCc2ccccc2 34a_100015324214_100010206137 [0,2,0,0,0,0|1,0,0]=3 18401 B18R2.8976 Cc1ccc(cc1I)CNCc2ccccn2 270004a_100000210449_100010197721 [0,2,0,0,0,0|2,0,0]=4 18402 B18R2.8976 Cc1ccc(cc1I)CNCc2cccnc2 207a_100000210453_100010197721 [0,2,0,0,0,0|2,0,0]=4 18403 B18R2.8976 Cc1ccc(cc1I)CNCc2cccnc2 270004a_100000210453_100010197721 [0,2,0,0,0,0|2,0,0]=4 18404 B18R2.8976 Cc1ccc(cc1I)COCc2ccccc2 34a_100000050133_100015291786 [0,2,0,0,0,0|0,0,0]=2 18405 B18R2.8976 Cc1ccc(cc1I)COCc2ccccc2 34a_100000210790_100010206137 [0,2,0,0,0,0|0,0,0]=2 18406 B18R2.8976 Cc1ccc(cc1I)COCc2ccccc2 7a_100000050133_100000211182 [0,2,0,0,0,0|0,0,0]=2 18407 B18R2.8976 Cc1ccc(cc1I)COCc2ccccc2 7a_100000210790_100010206137 [0,2,0,0,0,0|0,0,0]=2 18408 B18R2.8976 Cc1ccc(cc1I)COCc2ccccn2 34a_100000050133_100000721315 [0,2,0,0,0,0|1,0,0]=3 18409 B18R2.8976 Cc1ccc(cc1I)COCc2ccccn2 7a_100000050133_100000721315 [0,2,0,0,0,0|1,0,0]=3 18410 B18R2.8976 Cc1ccc(cc1I)COCc2cccnc2 34a_100000050133_100000733263 [0,2,0,0,0,0|1,0,0]=3 18411 B18R2.8976 Cc1ccc(cc1I)COCc2cccnc2 7a_100000050133_100000741622 [0,2,0,0,0,0|1,0,0]=3 18412 B18R2.8976 Cc1ccc(cc1I)COCc2cccnn2 34a_100000050133_100016990269 [0,2,0,0,0,0|2,0,0]=4 18413 B18R2.8976 Cc1ccc(cc1I)COCc2cccnn2 7a_100000050133_100016990269 [0,2,0,0,0,0|2,0,0]=4 18414 B18R2.8976 Cc1ccc(cc1I)COCc2ccncc2 7a_100000050133_100015193705 [0,2,0,0,0,0|1,0,0]=3 18415 B18R2.8976 Cc1ccc(cc1I)COCc2cnccn2 34a_100000050133_100016995436 [0,2,0,0,0,0|2,0,0]=4 18416 B18R2.8976 Cc1ccc(cc1I)COCc2cnccn2 7a_100000050133_100016995436 [0,2,0,0,0,0|2,0,0]=4 18417 B18R2.8976 Cc1ccc(cc1I)COCc2cncnc2 34a_100000050133_100015196519 [0,2,0,0,0,0|2,0,0]=4 18418 B18R2.8976 Cc1ccc(cc1I)COCc2cncnc2 7a_100000050133_100015196519 [0,2,0,0,0,0|2,0,0]=4 18419 B18R2.8976 Cc1ccc(cc1I)COCc2ncccn2 34a_100000050133_100000703007 [0,2,0,0,0,0|2,0,0]=4 18420 B18R2.8976 Cc1ccc(cc1I)COCc2ncccn2 7a_100000050133_100000703007 [0,2,0,0,0,0|2,0,0]=4 18421 B18R2.8976 Cc1ccc(cc1I)CSCc2ccccc2 62a_100000211182_100010206137 [0,2,0,0,0,0|0,1,0]=3 18422 B18R2.8976 Cc1ccc(cc1I)CSCc2ccccc2 62a_100010206137_100015291786 [0,2,0,0,0,0|0,1,0]=3 18423 B18R2.8976 Cc1ccc(cc1I)CSCc2ccccn2 62a_100000721315_100010206137 [0,2,0,0,0,0|1,1,0]=4 18424 B18R2.8976 Cc1ccc(cc1I)CSCc2ccccn2 62a_100010206137_100000721315 [0,2,0,0,0,0|1,1,0]=4 18425 B18R2.8976 Cc1ccc(cc1I)CSCc2cccnc2 62a_100000741622_100010206137 [0,2,0,0,0,0|1,1,0]=4 18426 B18R2.8976 Cc1ccc(cc1I)CSCc2cccnc2 62a_100010206137_100000741622 [0,2,0,0,0,0|1,1,0]=4 18427 B18R2.8976 Cc1ccc(cc1I)CSCc2ccncc2 62a_100010206137_100015193705 [0,2,0,0,0,0|1,1,0]=4 18428 B18R2.8976 Cc1ccc(cc1I)CSCc2ccncc2 62a_100015193705_100010206137 [0,2,0,0,0,0|1,1,0]=4 18429 B18R2.8976 Cc1ccc(cc1I)NCCc2ccccc2 34a_100000184131_100000765856 [0,2,0,0,0,0|2,0,0]=4 18430 B18R2.8976 Cc1ccc(cc1I)NCCc2ccccc2 7a_100000184131_100000765856 [0,2,0,0,0,0|2,0,0]=4 18431 B18R2.8976 Cc1ccc(cc1N)C=CCc2ccccc2 271570a_200016263579_100000761890 [0,2,0,0,0,0|1,0,1]=4 18432 B18R2.8976 Cc1ccc(cc1N)COCc2ccccc2 34a_100000758420_100015291786 [0,2,0,0,0,0|0,0,0]=2 18433 B18R2.8976 Cc1ccc(cc1N)COCc2ccccn2 34a_100000758420_100000721315 [0,2,0,0,0,0|1,0,0]=3 18434 B18R2.8976 Cc1ccc(cc1N)COCc2cccnc2 34a_100000758420_100000733263 [0,2,0,0,0,0|1,0,0]=3 18435 B18R2.8976 Cc1ccc(cc1N)COCc2cccnn2 34a_100000758420_100016990269 [0,2,0,0,0,0|2,0,0]=4 18436 B18R2.8976 Cc1ccc(cc1N)COCc2cnccn2 34a_100000758420_100016995436 [0,2,0,0,0,0|2,0,0]=4 18437 B18R2.8976 Cc1ccc(cc1N)COCc2cncnc2 34a_100000758420_100015196519 [0,2,0,0,0,0|2,0,0]=4 18438 B18R2.8976 Cc1ccc(cc1N)COCc2ncccn2 34a_100000758420_100000703007 [0,2,0,0,0,0|2,0,0]=4 18439 B18R2.8976 Cc1ccc(cc1N)OCCc2ccccc2 34a_100011216113_100000765856 [0,2,0,0,0,0|2,0,0]=4 18440 B18R2.8976 Cc1ccc(cc1N)OCCc2ccccc2 7a_100011216113_100000765856 [0,2,0,0,0,0|2,0,0]=4 18441 B18R2.8976 Cc1ccc(cc1N)SCCc2ccccc2 62a_100000761890_100011218657 [0,2,0,0,0,0|2,0,0]=4 18442 B18R2.8976 Cc1ccc(cc1N)SCCc2ccccc2 62a_100000765856_100000761890 [0,2,0,0,0,0|2,0,0]=4 18443 B18R2.8976 Cc1ccc(cc1O)C=CCc2ccccc2 271570a_200016263579_100000766334 [0,2,0,0,0,0|1,0,1]=4 18444 B18R2.8976 Cc1ccc(cc1O)NCCc2ccccc2 34a_100000759471_100000765856 [0,2,0,0,0,0|2,0,0]=4 18445 B18R2.8976 Cc1ccc(cc1O)NCCc2ccccc2 7a_100000759471_100000765856 [0,2,0,0,0,0|2,0,0]=4 18446 B18R2.8976 Cc1ccc(cc1O)SCCc2ccccc2 62a_100000685420_100011218657 [0,2,0,0,0,0|2,0,0]=4 18447 B18R2.8976 Cc1ccc(cc1O)SCCc2ccccc2 62a_100000765856_100000685420 [0,2,0,0,0,0|2,0,0]=4 18448 B18R2.8976 Cc1ccc(nc1C)CNCc2ccccc2 2230a_202515432893_100015291786 [0,2,0,0,0,0|2,0,0]=4 18449 B18R2.8976 Cc1ccc(nc1C)CNCc2ccccc2 270004a_202515432893_100015611070 [0,2,0,0,0,0|2,0,0]=4 18450 B18R2.8976 Cc1ccc(nc1C)CNCc2ccccc2 34a_202515432893_100015291786 [0,2,0,0,0,0|2,0,0]=4 18451 B18R2.8976 Cc1cnc(cc1Br)CNCc2ccccc2 207a_100015324214_100010174032 [0,2,0,0,0,0|2,0,0]=4 18452 B18R2.8976 Cc1cnc(cc1Br)CNCc2ccccc2 270004a_100015324214_100010174032 [0,2,0,0,0,0|2,0,0]=4 18453 B18R2.8976 Cc1cnc(cc1Br)COCc2ccccc2 34a_100010113723_100015291786 [0,2,0,0,0,0|1,0,0]=3 18454 B18R2.8976 Cc1cnc(cc1Br)COCc2ccccc2 7a_100010113723_100000211182 [0,2,0,0,0,0|1,0,0]=3 18455 B18R2.8976 Cc1cnc(cc1Br)COCc2ccccn2 34a_100010113723_100000721315 [0,2,0,0,0,0|2,0,0]=4 18456 B18R2.8976 Cc1cnc(cc1Br)COCc2ccccn2 7a_100010113723_100000721315 [0,2,0,0,0,0|2,0,0]=4 18457 B18R2.8976 Cc1cnc(cc1Br)COCc2cccnc2 34a_100010113723_100000733263 [0,2,0,0,0,0|2,0,0]=4 18458 B18R2.8976 Cc1cnc(cc1Br)COCc2cccnc2 7a_100010113723_100000741622 [0,2,0,0,0,0|2,0,0]=4 18459 B18R2.8976 Cc1cnc(cc1Br)COCc2ccncc2 7a_100010113723_100015193705 [0,2,0,0,0,0|2,0,0]=4 18460 B18R2.8976 Cc1cnc(cc1Cl)COCc2ccccc2 34a_200000144627_100015291786 [0,2,0,0,0,0|1,0,0]=3 18461 B18R2.8976 Cc1cnc(cc1Cl)COCc2ccccc2 7a_200000144627_100000211182 [0,2,0,0,0,0|1,0,0]=3 18462 B18R2.8976 Cc1cnc(cc1Cl)COCc2ccccn2 34a_200000144627_100000721315 [0,2,0,0,0,0|2,0,0]=4 18463 B18R2.8976 Cc1cnc(cc1Cl)COCc2ccccn2 7a_200000144627_100000721315 [0,2,0,0,0,0|2,0,0]=4 18464 B18R2.8976 Cc1cnc(cc1Cl)COCc2cccnc2 34a_200000144627_100000733263 [0,2,0,0,0,0|2,0,0]=4 18465 B18R2.8976 Cc1cnc(cc1Cl)COCc2cccnc2 7a_200000144627_100000741622 [0,2,0,0,0,0|2,0,0]=4 18466 B18R2.8976 Cc1cnc(cc1Cl)COCc2ccncc2 7a_200000144627_100015193705 [0,2,0,0,0,0|2,0,0]=4 18467 B18R2.8976 Cc1nc(ccc1Br)CNCc2ccccc2 207a_100015324214_100010238520 [0,2,0,0,0,0|2,0,0]=4 18468 B18R2.8976 Cc1nc(ccc1Br)CNCc2ccccc2 270004a_100015324214_100010238520 [0,2,0,0,0,0|2,0,0]=4 18469 B18R2.8976 Cc1nc(ccc1Br)COCc2ccccc2 34a_100010114280_100015291786 [0,2,0,0,0,0|1,0,0]=3 18470 B18R2.8976 Cc1nc(ccc1Br)COCc2ccccn2 34a_100010114280_100000721315 [0,2,0,0,0,0|2,0,0]=4 18471 B18R2.8976 Cc1nc(ccc1Br)COCc2cccnc2 34a_100010114280_100000733263 [0,2,0,0,0,0|2,0,0]=4 18472 B18R2.8976 Cc1nc(ccc1F)COCc2ccccc2 34a_200009884719_100015291786 [0,2,0,0,0,0|1,0,0]=3 18473 B18R2.8976 Cc1nc(ccc1F)COCc2ccccn2 34a_200009884719_100000721315 [0,2,0,0,0,0|2,0,0]=4 18474 B18R2.8976 Cc1nc(ccc1F)COCc2cccnc2 34a_200009884719_100000733263 [0,2,0,0,0,0|2,0,0]=4 18475 B18R2.8976 Cc1ncc(cc1F)COCc2ccccc2 34a_100009839834_100015291786 [0,2,0,0,0,0|1,0,0]=3 18476 B18R2.8976 Cc1ncc(cc1F)COCc2ccccc2 7a_100009839834_100000211182 [0,2,0,0,0,0|1,0,0]=3 18477 B18R2.8976 Cc1ncc(cc1F)COCc2ccccn2 34a_100009839834_100000721315 [0,2,0,0,0,0|2,0,0]=4 18478 B18R2.8976 Cc1ncc(cc1F)COCc2ccccn2 7a_100009839834_100000721315 [0,2,0,0,0,0|2,0,0]=4 18479 B18R2.8976 Cc1ncc(cc1F)COCc2cccnc2 34a_100009839834_100000733263 [0,2,0,0,0,0|2,0,0]=4 18480 B18R2.8976 Cc1ncc(cc1F)COCc2cccnc2 7a_100009839834_100000741622 [0,2,0,0,0,0|2,0,0]=4 18481 B18R2.8976 Cc1ncc(cc1F)COCc2ccncc2 7a_100009839834_100015193705 [0,2,0,0,0,0|2,0,0]=4 18482 B18R2.8976 Clc1cc(ccc1Br)C=CCc2ccccc2 271570a_200016263579_100012047281 [0,2,0,0,0,0|1,0,1]=4 18483 B18R2.8976 Clc1cc(ccc1Br)CNCc2ccccc2 207a_100012362553_100015611070 [0,2,0,0,0,0|1,0,0]=3 18484 B18R2.8976 Clc1cc(ccc1Br)CNCc2ccccc2 207a_100015324214_100000690054 [0,2,0,0,0,0|1,0,0]=3 18485 B18R2.8976 Clc1cc(ccc1Br)CNCc2ccccc2 2230a_100012362553_100015291786 [0,2,0,0,0,0|1,0,0]=3 18486 B18R2.8976 Clc1cc(ccc1Br)CNCc2ccccc2 2230a_100015324214_100012353895 [0,2,0,0,0,0|1,0,0]=3 18487 B18R2.8976 Clc1cc(ccc1Br)CNCc2ccccc2 270004a_100012362553_100015611070 [0,2,0,0,0,0|1,0,0]=3 18488 B18R2.8976 Clc1cc(ccc1Br)CNCc2ccccc2 270004a_100015324214_100000690054 [0,2,0,0,0,0|1,0,0]=3 18489 B18R2.8976 Clc1cc(ccc1Br)CNCc2ccccc2 34a_100012362553_100015291786 [0,2,0,0,0,0|1,0,0]=3 18490 B18R2.8976 Clc1cc(ccc1Br)CNCc2ccccc2 34a_100015324214_100012353895 [0,2,0,0,0,0|1,0,0]=3 18491 B18R2.8976 Clc1cc(ccc1Br)CNCc2ccccn2 207a_100012362553_100000209966 [0,2,0,0,0,0|2,0,0]=4 18492 B18R2.8976 Clc1cc(ccc1Br)CNCc2ccccn2 2230a_100012362553_100000721315 [0,2,0,0,0,0|2,0,0]=4 18493 B18R2.8976 Clc1cc(ccc1Br)CNCc2ccccn2 270004a_100000210449_100000690054 [0,2,0,0,0,0|2,0,0]=4 18494 B18R2.8976 Clc1cc(ccc1Br)CNCc2ccccn2 270004a_100012362553_100000209966 [0,2,0,0,0,0|2,0,0]=4 18495 B18R2.8976 Clc1cc(ccc1Br)CNCc2ccccn2 34a_100012362553_100000721315 [0,2,0,0,0,0|2,0,0]=4 18496 B18R2.8976 Clc1cc(ccc1Br)CNCc2cccnc2 207a_100000210453_100000690054 [0,2,0,0,0,0|2,0,0]=4 18497 B18R2.8976 Clc1cc(ccc1Br)CNCc2cccnc2 207a_100012362553_100000209961 [0,2,0,0,0,0|2,0,0]=4 18498 B18R2.8976 Clc1cc(ccc1Br)CNCc2cccnc2 2230a_100012362553_100000741622 [0,2,0,0,0,0|2,0,0]=4 18499 B18R2.8976 Clc1cc(ccc1Br)CNCc2cccnc2 270004a_100000210453_100000690054 [0,2,0,0,0,0|2,0,0]=4 18500 B18R2.8976 Clc1cc(ccc1Br)CNCc2cccnc2 270004a_100012362553_100000209961 [0,2,0,0,0,0|2,0,0]=4 18501 B18R2.8976 Clc1cc(ccc1Br)CNCc2cccnc2 34a_100012362553_100000733263 [0,2,0,0,0,0|2,0,0]=4 18502 B18R2.8976 Clc1cc(ccc1Br)CNCc2ccncc2 207a_100012362553_100000186114 [0,2,0,0,0,0|2,0,0]=4 18503 B18R2.8976 Clc1cc(ccc1Br)CNCc2ccncc2 2230a_100012362553_100015193705 [0,2,0,0,0,0|2,0,0]=4 18504 B18R2.8976 Clc1cc(ccc1Br)COCc2ccccc2 34a_100000210790_100012353895 [0,2,0,0,0,0|0,0,0]=2 18505 B18R2.8976 Clc1cc(ccc1Br)COCc2ccccc2 34a_100000709168_100015291786 [0,2,0,0,0,0|0,0,0]=2 18506 B18R2.8976 Clc1cc(ccc1Br)COCc2ccccc2 7a_100000210790_100012353895 [0,2,0,0,0,0|0,0,0]=2 18507 B18R2.8976 Clc1cc(ccc1Br)COCc2ccccc2 7a_100000709168_100000211182 [0,2,0,0,0,0|0,0,0]=2 18508 B18R2.8976 Clc1cc(ccc1Br)COCc2ccccn2 34a_100000709168_100000721315 [0,2,0,0,0,0|1,0,0]=3 18509 B18R2.8976 Clc1cc(ccc1Br)COCc2ccccn2 7a_100000709168_100000721315 [0,2,0,0,0,0|1,0,0]=3 18510 B18R2.8976 Clc1cc(ccc1Br)COCc2cccnc2 34a_100000709168_100000733263 [0,2,0,0,0,0|1,0,0]=3 18511 B18R2.8976 Clc1cc(ccc1Br)COCc2cccnc2 7a_100000709168_100000741622 [0,2,0,0,0,0|1,0,0]=3 18512 B18R2.8976 Clc1cc(ccc1Br)COCc2cccnn2 34a_100000709168_100016990269 [0,2,0,0,0,0|2,0,0]=4 18513 B18R2.8976 Clc1cc(ccc1Br)COCc2cccnn2 7a_100000709168_100016990269 [0,2,0,0,0,0|2,0,0]=4 18514 B18R2.8976 Clc1cc(ccc1Br)COCc2ccncc2 7a_100000709168_100015193705 [0,2,0,0,0,0|1,0,0]=3 18515 B18R2.8976 Clc1cc(ccc1Br)COCc2cnccn2 34a_100000709168_100016995436 [0,2,0,0,0,0|2,0,0]=4 18516 B18R2.8976 Clc1cc(ccc1Br)COCc2cnccn2 7a_100000709168_100016995436 [0,2,0,0,0,0|2,0,0]=4 18517 B18R2.8976 Clc1cc(ccc1Br)COCc2cncnc2 34a_100000709168_100015196519 [0,2,0,0,0,0|2,0,0]=4 18518 B18R2.8976 Clc1cc(ccc1Br)COCc2cncnc2 7a_100000709168_100015196519 [0,2,0,0,0,0|2,0,0]=4 18519 B18R2.8976 Clc1cc(ccc1Br)COCc2ncccn2 34a_100000709168_100000703007 [0,2,0,0,0,0|2,0,0]=4 18520 B18R2.8976 Clc1cc(ccc1Br)COCc2ncccn2 7a_100000709168_100000703007 [0,2,0,0,0,0|2,0,0]=4 18521 B18R2.8976 Clc1cc(ccc1Br)CSCc2ccccc2 62a_100000211182_100012353895 [0,2,0,0,0,0|0,1,0]=3 18522 B18R2.8976 Clc1cc(ccc1Br)CSCc2ccccc2 62a_100012353895_100015291786 [0,2,0,0,0,0|0,1,0]=3 18523 B18R2.8976 Clc1cc(ccc1Br)CSCc2ccccn2 62a_100000721315_100012353895 [0,2,0,0,0,0|1,1,0]=4 18524 B18R2.8976 Clc1cc(ccc1Br)CSCc2ccccn2 62a_100012353895_100000721315 [0,2,0,0,0,0|1,1,0]=4 18525 B18R2.8976 Clc1cc(ccc1Br)CSCc2cccnc2 62a_100000741622_100012353895 [0,2,0,0,0,0|1,1,0]=4 18526 B18R2.8976 Clc1cc(ccc1Br)CSCc2cccnc2 62a_100012353895_100000741622 [0,2,0,0,0,0|1,1,0]=4 18527 B18R2.8976 Clc1cc(ccc1Br)CSCc2ccncc2 62a_100012353895_100015193705 [0,2,0,0,0,0|1,1,0]=4 18528 B18R2.8976 Clc1cc(ccc1Br)CSCc2ccncc2 62a_100015193705_100012353895 [0,2,0,0,0,0|1,1,0]=4 18529 B18R2.8976 Clc1cc(ccc1Br)NCCc2ccccc2 2230a_100000687081_100000765856 [0,2,0,0,0,0|2,0,0]=4 18530 B18R2.8976 Clc1cc(ccc1Br)NCCc2ccccc2 34a_100000687081_100000765856 [0,2,0,0,0,0|2,0,0]=4 18531 B18R2.8976 Clc1cc(ccc1Br)NCCc2ccccc2 7a_100000687081_100000765856 [0,2,0,0,0,0|2,0,0]=4 18532 B18R2.8976 Clc1cc(ccc1Br)OCCc2ccccc2 34a_100011215161_100000765856 [0,2,0,0,0,0|2,0,0]=4 18533 B18R2.8976 Clc1cc(ccc1Br)OCCc2ccccc2 7a_100011215161_100000765856 [0,2,0,0,0,0|2,0,0]=4 18534 B18R2.8976 Clc1cc(ccc1Br)SCCc2ccccc2 62a_100000765856_100012047281 [0,2,0,0,0,0|2,0,0]=4 18535 B18R2.8976 Clc1cc(ccc1Br)SCCc2ccccc2 62a_100012047281_100011218657 [0,2,0,0,0,0|2,0,0]=4 18536 B18R2.8976 Clc1cc(ccc1I)CNCc2ccccc2 2230a_100015324214_100012349665 [0,2,0,0,0,0|1,0,0]=3 18537 B18R2.8976 Clc1cc(ccc1I)CNCc2ccccc2 34a_100015324214_100012349665 [0,2,0,0,0,0|1,0,0]=3 18538 B18R2.8976 Clc1cc(ccc1I)COCc2ccccc2 34a_100000210790_100012349665 [0,2,0,0,0,0|0,0,0]=2 18539 B18R2.8976 Clc1cc(ccc1I)COCc2ccccc2 34a_100000718186_100015291786 [0,2,0,0,0,0|0,0,0]=2 18540 B18R2.8976 Clc1cc(ccc1I)COCc2ccccc2 7a_100000210790_100012349665 [0,2,0,0,0,0|0,0,0]=2 18541 B18R2.8976 Clc1cc(ccc1I)COCc2ccccc2 7a_100000718186_100000211182 [0,2,0,0,0,0|0,0,0]=2 18542 B18R2.8976 Clc1cc(ccc1I)COCc2ccccn2 34a_100000718186_100000721315 [0,2,0,0,0,0|1,0,0]=3 18543 B18R2.8976 Clc1cc(ccc1I)COCc2ccccn2 7a_100000718186_100000721315 [0,2,0,0,0,0|1,0,0]=3 18544 B18R2.8976 Clc1cc(ccc1I)COCc2cccnc2 34a_100000718186_100000733263 [0,2,0,0,0,0|1,0,0]=3 18545 B18R2.8976 Clc1cc(ccc1I)COCc2cccnc2 7a_100000718186_100000741622 [0,2,0,0,0,0|1,0,0]=3 18546 B18R2.8976 Clc1cc(ccc1I)COCc2cccnn2 34a_100000718186_100016990269 [0,2,0,0,0,0|2,0,0]=4 18547 B18R2.8976 Clc1cc(ccc1I)COCc2cccnn2 7a_100000718186_100016990269 [0,2,0,0,0,0|2,0,0]=4 18548 B18R2.8976 Clc1cc(ccc1I)COCc2ccncc2 7a_100000718186_100015193705 [0,2,0,0,0,0|1,0,0]=3 18549 B18R2.8976 Clc1cc(ccc1I)COCc2cnccn2 34a_100000718186_100016995436 [0,2,0,0,0,0|2,0,0]=4 18550 B18R2.8976 Clc1cc(ccc1I)COCc2cnccn2 7a_100000718186_100016995436 [0,2,0,0,0,0|2,0,0]=4 18551 B18R2.8976 Clc1cc(ccc1I)COCc2cncnc2 34a_100000718186_100015196519 [0,2,0,0,0,0|2,0,0]=4 18552 B18R2.8976 Clc1cc(ccc1I)COCc2cncnc2 7a_100000718186_100015196519 [0,2,0,0,0,0|2,0,0]=4 18553 B18R2.8976 Clc1cc(ccc1I)COCc2ncccn2 34a_100000718186_100000703007 [0,2,0,0,0,0|2,0,0]=4 18554 B18R2.8976 Clc1cc(ccc1I)COCc2ncccn2 7a_100000718186_100000703007 [0,2,0,0,0,0|2,0,0]=4 18555 B18R2.8976 Clc1cc(ccc1I)CSCc2ccccc2 62a_100000211182_100012349665 [0,2,0,0,0,0|0,1,0]=3 18556 B18R2.8976 Clc1cc(ccc1I)CSCc2ccccc2 62a_100012349665_100015291786 [0,2,0,0,0,0|0,1,0]=3 18557 B18R2.8976 Clc1cc(ccc1I)CSCc2ccccn2 62a_100000721315_100012349665 [0,2,0,0,0,0|1,1,0]=4 18558 B18R2.8976 Clc1cc(ccc1I)CSCc2ccccn2 62a_100012349665_100000721315 [0,2,0,0,0,0|1,1,0]=4 18559 B18R2.8976 Clc1cc(ccc1I)CSCc2cccnc2 62a_100000741622_100012349665 [0,2,0,0,0,0|1,1,0]=4 18560 B18R2.8976 Clc1cc(ccc1I)CSCc2cccnc2 62a_100012349665_100000741622 [0,2,0,0,0,0|1,1,0]=4 18561 B18R2.8976 Clc1cc(ccc1I)CSCc2ccncc2 62a_100012349665_100015193705 [0,2,0,0,0,0|1,1,0]=4 18562 B18R2.8976 Clc1cc(ccc1I)CSCc2ccncc2 62a_100015193705_100012349665 [0,2,0,0,0,0|1,1,0]=4 18563 B18R2.8976 Clc1cc(ccc1I)NCCc2ccccc2 34a_100000761885_100000765856 [0,2,0,0,0,0|2,0,0]=4 18564 B18R2.8976 Clc1cc(ccc1I)OCCc2ccccc2 34a_100000047559_100000765856 [0,2,0,0,0,0|2,0,0]=4 18565 B18R2.8976 Clc1cc(ccc1I)OCCc2ccccc2 7a_100000047559_100000765856 [0,2,0,0,0,0|2,0,0]=4 18566 B18R2.8976 Clc1cc(cnc1Cl)CNCc2ccccc2 2230a_100015324214_100009843750 [0,2,0,0,0,0|2,0,0]=4 18567 B18R2.8976 Clc1cc(cnc1Cl)CNCc2ccccc2 34a_100015324214_100009843750 [0,2,0,0,0,0|2,0,0]=4 18568 B18R2.8976 Clc1cc(cnc1Cl)COCc2ccccc2 34a_100000042784_100015291786 [0,2,0,0,0,0|1,0,0]=3 18569 B18R2.8976 Clc1cc(cnc1Cl)COCc2ccccc2 34a_100000210790_100009843750 [0,2,0,0,0,0|1,0,0]=3 18570 B18R2.8976 Clc1cc(cnc1Cl)COCc2ccccc2 7a_100000042784_100000211182 [0,2,0,0,0,0|1,0,0]=3 18571 B18R2.8976 Clc1cc(cnc1Cl)COCc2ccccc2 7a_100000210790_100009843750 [0,2,0,0,0,0|1,0,0]=3 18572 B18R2.8976 Clc1cc(cnc1Cl)COCc2ccccn2 34a_100000042784_100000721315 [0,2,0,0,0,0|2,0,0]=4 18573 B18R2.8976 Clc1cc(cnc1Cl)COCc2ccccn2 7a_100000042784_100000721315 [0,2,0,0,0,0|2,0,0]=4 18574 B18R2.8976 Clc1cc(cnc1Cl)COCc2cccnc2 34a_100000042784_100000733263 [0,2,0,0,0,0|2,0,0]=4 18575 B18R2.8976 Clc1cc(cnc1Cl)COCc2cccnc2 7a_100000042784_100000741622 [0,2,0,0,0,0|2,0,0]=4 18576 B18R2.8976 Clc1cc(cnc1Cl)COCc2ccncc2 7a_100000042784_100015193705 [0,2,0,0,0,0|2,0,0]=4 18577 B18R2.8976 Clc1cc(cnc1Cl)CSCc2ccccc2 62a_100000211182_100009843750 [0,2,0,0,0,0|1,1,0]=4 18578 B18R2.8976 Clc1cc(cnc1Cl)CSCc2ccccc2 62a_100009843750_100015291786 [0,2,0,0,0,0|1,1,0]=4 18579 B18R2.8976 Clc1ccc(cc1Br)C=CCc2ccccc2 271570a_200016263579_100012353702 [0,2,0,0,0,0|1,0,1]=4 18580 B18R2.8976 Clc1ccc(cc1Br)CNCc2ccccc2 207a_100012349490_100015611070 [0,2,0,0,0,0|1,0,0]=3 18581 B18R2.8976 Clc1ccc(cc1Br)CNCc2ccccc2 207a_100015324214_100000693810 [0,2,0,0,0,0|1,0,0]=3 18582 B18R2.8976 Clc1ccc(cc1Br)CNCc2ccccc2 2230a_100012349490_100015291786 [0,2,0,0,0,0|1,0,0]=3 18583 B18R2.8976 Clc1ccc(cc1Br)CNCc2ccccc2 2230a_100015324214_100012353894 [0,2,0,0,0,0|1,0,0]=3 18584 B18R2.8976 Clc1ccc(cc1Br)CNCc2ccccc2 270004a_100012349490_100015611070 [0,2,0,0,0,0|1,0,0]=3 18585 B18R2.8976 Clc1ccc(cc1Br)CNCc2ccccc2 270004a_100015324214_100000693810 [0,2,0,0,0,0|1,0,0]=3 18586 B18R2.8976 Clc1ccc(cc1Br)CNCc2ccccc2 34a_100012349490_100015291786 [0,2,0,0,0,0|1,0,0]=3 18587 B18R2.8976 Clc1ccc(cc1Br)CNCc2ccccc2 34a_100015324214_100012353894 [0,2,0,0,0,0|1,0,0]=3 18588 B18R2.8976 Clc1ccc(cc1Br)CNCc2ccccn2 207a_100012349490_100000209966 [0,2,0,0,0,0|2,0,0]=4 18589 B18R2.8976 Clc1ccc(cc1Br)CNCc2ccccn2 2230a_100012349490_100000721315 [0,2,0,0,0,0|2,0,0]=4 18590 B18R2.8976 Clc1ccc(cc1Br)CNCc2ccccn2 270004a_100000210449_100000693810 [0,2,0,0,0,0|2,0,0]=4 18591 B18R2.8976 Clc1ccc(cc1Br)CNCc2ccccn2 270004a_100012349490_100000209966 [0,2,0,0,0,0|2,0,0]=4 18592 B18R2.8976 Clc1ccc(cc1Br)CNCc2ccccn2 34a_100012349490_100000721315 [0,2,0,0,0,0|2,0,0]=4 18593 B18R2.8976 Clc1ccc(cc1Br)CNCc2cccnc2 207a_100000210453_100000693810 [0,2,0,0,0,0|2,0,0]=4 18594 B18R2.8976 Clc1ccc(cc1Br)CNCc2cccnc2 207a_100012349490_100000209961 [0,2,0,0,0,0|2,0,0]=4 18595 B18R2.8976 Clc1ccc(cc1Br)CNCc2cccnc2 2230a_100012349490_100000741622 [0,2,0,0,0,0|2,0,0]=4 18596 B18R2.8976 Clc1ccc(cc1Br)CNCc2cccnc2 270004a_100000210453_100000693810 [0,2,0,0,0,0|2,0,0]=4 18597 B18R2.8976 Clc1ccc(cc1Br)CNCc2cccnc2 270004a_100012349490_100000209961 [0,2,0,0,0,0|2,0,0]=4 18598 B18R2.8976 Clc1ccc(cc1Br)CNCc2cccnc2 34a_100012349490_100000733263 [0,2,0,0,0,0|2,0,0]=4 18599 B18R2.8976 Clc1ccc(cc1Br)CNCc2ccncc2 207a_100012349490_100000186114 [0,2,0,0,0,0|2,0,0]=4 18600 B18R2.8976 Clc1ccc(cc1Br)CNCc2ccncc2 2230a_100012349490_100015193705 [0,2,0,0,0,0|2,0,0]=4 18601 B18R2.8976 Clc1ccc(cc1Br)COCc2ccccc2 34a_100000210790_100012353894 [0,2,0,0,0,0|0,0,0]=2 18602 B18R2.8976 Clc1ccc(cc1Br)COCc2ccccc2 34a_100012353893_100015291786 [0,2,0,0,0,0|0,0,0]=2 18603 B18R2.8976 Clc1ccc(cc1Br)COCc2ccccc2 7a_100000210790_100012353894 [0,2,0,0,0,0|0,0,0]=2 18604 B18R2.8976 Clc1ccc(cc1Br)COCc2ccccc2 7a_100012353893_100000211182 [0,2,0,0,0,0|0,0,0]=2 18605 B18R2.8976 Clc1ccc(cc1Br)COCc2ccccn2 34a_100012353893_100000721315 [0,2,0,0,0,0|1,0,0]=3 18606 B18R2.8976 Clc1ccc(cc1Br)COCc2ccccn2 7a_100012353893_100000721315 [0,2,0,0,0,0|1,0,0]=3 18607 B18R2.8976 Clc1ccc(cc1Br)COCc2cccnc2 34a_100012353893_100000733263 [0,2,0,0,0,0|1,0,0]=3 18608 B18R2.8976 Clc1ccc(cc1Br)COCc2cccnc2 7a_100012353893_100000741622 [0,2,0,0,0,0|1,0,0]=3 18609 B18R2.8976 Clc1ccc(cc1Br)COCc2cccnn2 34a_100012353893_100016990269 [0,2,0,0,0,0|2,0,0]=4 18610 B18R2.8976 Clc1ccc(cc1Br)COCc2cccnn2 7a_100012353893_100016990269 [0,2,0,0,0,0|2,0,0]=4 18611 B18R2.8976 Clc1ccc(cc1Br)COCc2ccncc2 7a_100012353893_100015193705 [0,2,0,0,0,0|1,0,0]=3 18612 B18R2.8976 Clc1ccc(cc1Br)COCc2cnccn2 34a_100012353893_100016995436 [0,2,0,0,0,0|2,0,0]=4 18613 B18R2.8976 Clc1ccc(cc1Br)COCc2cnccn2 7a_100012353893_100016995436 [0,2,0,0,0,0|2,0,0]=4 18614 B18R2.8976 Clc1ccc(cc1Br)COCc2cncnc2 34a_100012353893_100015196519 [0,2,0,0,0,0|2,0,0]=4 18615 B18R2.8976 Clc1ccc(cc1Br)COCc2cncnc2 7a_100012353893_100015196519 [0,2,0,0,0,0|2,0,0]=4 18616 B18R2.8976 Clc1ccc(cc1Br)COCc2ncccn2 34a_100012353893_100000703007 [0,2,0,0,0,0|2,0,0]=4 18617 B18R2.8976 Clc1ccc(cc1Br)COCc2ncccn2 7a_100012353893_100000703007 [0,2,0,0,0,0|2,0,0]=4 18618 B18R2.8976 Clc1ccc(cc1Br)CSCc2ccccc2 62a_100000211182_100012353894 [0,2,0,0,0,0|0,1,0]=3 18619 B18R2.8976 Clc1ccc(cc1Br)CSCc2ccccc2 62a_100012353894_100015291786 [0,2,0,0,0,0|0,1,0]=3 18620 B18R2.8976 Clc1ccc(cc1Br)CSCc2ccccn2 62a_100000721315_100012353894 [0,2,0,0,0,0|1,1,0]=4 18621 B18R2.8976 Clc1ccc(cc1Br)CSCc2ccccn2 62a_100012353894_100000721315 [0,2,0,0,0,0|1,1,0]=4 18622 B18R2.8976 Clc1ccc(cc1Br)CSCc2cccnc2 62a_100000741622_100012353894 [0,2,0,0,0,0|1,1,0]=4 18623 B18R2.8976 Clc1ccc(cc1Br)CSCc2cccnc2 62a_100012353894_100000741622 [0,2,0,0,0,0|1,1,0]=4 18624 B18R2.8976 Clc1ccc(cc1Br)CSCc2ccncc2 62a_100012353894_100015193705 [0,2,0,0,0,0|1,1,0]=4 18625 B18R2.8976 Clc1ccc(cc1Br)CSCc2ccncc2 62a_100015193705_100012353894 [0,2,0,0,0,0|1,1,0]=4 18626 B18R2.8976 Clc1ccc(cc1Br)NCCc2ccccc2 2230a_100000686031_100000765856 [0,2,0,0,0,0|2,0,0]=4 18627 B18R2.8976 Clc1ccc(cc1Br)NCCc2ccccc2 34a_100000686031_100000765856 [0,2,0,0,0,0|2,0,0]=4 18628 B18R2.8976 Clc1ccc(cc1Br)OCCc2ccccc2 34a_100011933957_100000765856 [0,2,0,0,0,0|2,0,0]=4 18629 B18R2.8976 Clc1ccc(cc1Br)OCCc2ccccc2 7a_100011933957_100000765856 [0,2,0,0,0,0|2,0,0]=4 18630 B18R2.8976 Clc1ccc(cc1Br)SCCc2ccccc2 62a_100000765856_100012353702 [0,2,0,0,0,0|2,0,0]=4 18631 B18R2.8976 Clc1ccc(cc1Br)SCCc2ccccc2 62a_100012353702_100011218657 [0,2,0,0,0,0|2,0,0]=4 18632 B18R2.8976 Clc1ccc(cc1Cl)C=CCc2ccccc2 271570a_200016263579_100011214914 [0,2,0,0,0,0|1,0,1]=4 18633 B18R2.8976 Clc1ccc(cc1Cl)CCNc2ccccc2 34a_100000106764_100011713676 [0,2,0,0,0,0|2,0,0]=4 18634 B18R2.8976 Clc1ccc(cc1Cl)CCOc2ccccc2 34a_100000210340_100011713676 [0,2,0,0,0,0|2,0,0]=4 18635 B18R2.8976 Clc1ccc(cc1Cl)CCOc2ccccc2 7a_100000210340_100011713676 [0,2,0,0,0,0|2,0,0]=4 18636 B18R2.8976 Clc1ccc(cc1Cl)CCSc2ccccc2 62a_100000719477_100011713676 [0,2,0,0,0,0|2,0,0]=4 18637 B18R2.8976 Clc1ccc(cc1Cl)CCSc2ccccc2 62a_100011713676_100000041952 [0,2,0,0,0,0|2,0,0]=4 18638 B18R2.8976 Clc1ccc(cc1Cl)CNCc2ccccc2 207a_100000174881_100015611070 [0,2,0,0,0,0|1,0,0]=3 18639 B18R2.8976 Clc1ccc(cc1Cl)CNCc2ccccc2 207a_100015324214_100000188533 [0,2,0,0,0,0|1,0,0]=3 18640 B18R2.8976 Clc1ccc(cc1Cl)CNCc2ccccc2 2230a_100000174881_100015291786 [0,2,0,0,0,0|1,0,0]=3 18641 B18R2.8976 Clc1ccc(cc1Cl)CNCc2ccccc2 2230a_100015324214_100000184707 [0,2,0,0,0,0|1,0,0]=3 18642 B18R2.8976 Clc1ccc(cc1Cl)CNCc2ccccc2 270004a_100000174881_100015611070 [0,2,0,0,0,0|1,0,0]=3 18643 B18R2.8976 Clc1ccc(cc1Cl)CNCc2ccccc2 270004a_100015324214_100000188533 [0,2,0,0,0,0|1,0,0]=3 18644 B18R2.8976 Clc1ccc(cc1Cl)CNCc2ccccc2 34a_100000174881_100015291786 [0,2,0,0,0,0|1,0,0]=3 18645 B18R2.8976 Clc1ccc(cc1Cl)CNCc2ccccc2 34a_100015324214_100000184707 [0,2,0,0,0,0|1,0,0]=3 18646 B18R2.8976 Clc1ccc(cc1Cl)CNCc2ccccn2 207a_100000174881_100000209966 [0,2,0,0,0,0|2,0,0]=4 18647 B18R2.8976 Clc1ccc(cc1Cl)CNCc2ccccn2 2230a_100000174881_100000721315 [0,2,0,0,0,0|2,0,0]=4 18648 B18R2.8976 Clc1ccc(cc1Cl)CNCc2ccccn2 270004a_100000174881_100000209966 [0,2,0,0,0,0|2,0,0]=4 18649 B18R2.8976 Clc1ccc(cc1Cl)CNCc2ccccn2 270004a_100000210449_100000188533 [0,2,0,0,0,0|2,0,0]=4 18650 B18R2.8976 Clc1ccc(cc1Cl)CNCc2ccccn2 34a_100000174881_100000721315 [0,2,0,0,0,0|2,0,0]=4 18651 B18R2.8976 Clc1ccc(cc1Cl)CNCc2cccnc2 207a_100000174881_100000209961 [0,2,0,0,0,0|2,0,0]=4 18652 B18R2.8976 Clc1ccc(cc1Cl)CNCc2cccnc2 207a_100000210453_100000188533 [0,2,0,0,0,0|2,0,0]=4 18653 B18R2.8976 Clc1ccc(cc1Cl)CNCc2cccnc2 2230a_100000174881_100000741622 [0,2,0,0,0,0|2,0,0]=4 18654 B18R2.8976 Clc1ccc(cc1Cl)CNCc2cccnc2 270004a_100000174881_100000209961 [0,2,0,0,0,0|2,0,0]=4 18655 B18R2.8976 Clc1ccc(cc1Cl)CNCc2cccnc2 270004a_100000210453_100000188533 [0,2,0,0,0,0|2,0,0]=4 18656 B18R2.8976 Clc1ccc(cc1Cl)CNCc2cccnc2 34a_100000174881_100000733263 [0,2,0,0,0,0|2,0,0]=4 18657 B18R2.8976 Clc1ccc(cc1Cl)CNCc2ccncc2 207a_100000174881_100000186114 [0,2,0,0,0,0|2,0,0]=4 18658 B18R2.8976 Clc1ccc(cc1Cl)CNCc2ccncc2 2230a_100000174881_100015193705 [0,2,0,0,0,0|2,0,0]=4 18659 B18R2.8976 Clc1ccc(cc1Cl)COCc2ccccc2 34a_100000210790_100000184707 [0,2,0,0,0,0|0,0,0]=2 18660 B18R2.8976 Clc1ccc(cc1Cl)COCc2ccccc2 34a_100000211588_100015291786 [0,2,0,0,0,0|0,0,0]=2 18661 B18R2.8976 Clc1ccc(cc1Cl)COCc2ccccc2 7a_100000210790_100000184707 [0,2,0,0,0,0|0,0,0]=2 18662 B18R2.8976 Clc1ccc(cc1Cl)COCc2ccccc2 7a_100000211588_100000211182 [0,2,0,0,0,0|0,0,0]=2 18663 B18R2.8976 Clc1ccc(cc1Cl)COCc2ccccn2 34a_100000211588_100000721315 [0,2,0,0,0,0|1,0,0]=3 18664 B18R2.8976 Clc1ccc(cc1Cl)COCc2ccccn2 7a_100000211588_100000721315 [0,2,0,0,0,0|1,0,0]=3 18665 B18R2.8976 Clc1ccc(cc1Cl)COCc2cccnc2 34a_100000211588_100000733263 [0,2,0,0,0,0|1,0,0]=3 18666 B18R2.8976 Clc1ccc(cc1Cl)COCc2cccnc2 7a_100000211588_100000741622 [0,2,0,0,0,0|1,0,0]=3 18667 B18R2.8976 Clc1ccc(cc1Cl)COCc2cccnn2 34a_100000211588_100016990269 [0,2,0,0,0,0|2,0,0]=4 18668 B18R2.8976 Clc1ccc(cc1Cl)COCc2cccnn2 7a_100000211588_100016990269 [0,2,0,0,0,0|2,0,0]=4 18669 B18R2.8976 Clc1ccc(cc1Cl)COCc2ccncc2 7a_100000211588_100015193705 [0,2,0,0,0,0|1,0,0]=3 18670 B18R2.8976 Clc1ccc(cc1Cl)COCc2cnccn2 34a_100000211588_100016995436 [0,2,0,0,0,0|2,0,0]=4 18671 B18R2.8976 Clc1ccc(cc1Cl)COCc2cnccn2 7a_100000211588_100016995436 [0,2,0,0,0,0|2,0,0]=4 18672 B18R2.8976 Clc1ccc(cc1Cl)COCc2cncnc2 34a_100000211588_100015196519 [0,2,0,0,0,0|2,0,0]=4 18673 B18R2.8976 Clc1ccc(cc1Cl)COCc2cncnc2 7a_100000211588_100015196519 [0,2,0,0,0,0|2,0,0]=4 18674 B18R2.8976 Clc1ccc(cc1Cl)COCc2ncccn2 34a_100000211588_100000703007 [0,2,0,0,0,0|2,0,0]=4 18675 B18R2.8976 Clc1ccc(cc1Cl)COCc2ncccn2 7a_100000211588_100000703007 [0,2,0,0,0,0|2,0,0]=4 18676 B18R2.8976 Clc1ccc(cc1Cl)CSCc2ccccc2 62a_100000184707_100015291786 [0,2,0,0,0,0|0,1,0]=3 18677 B18R2.8976 Clc1ccc(cc1Cl)CSCc2ccccc2 62a_100000211182_100000184707 [0,2,0,0,0,0|0,1,0]=3 18678 B18R2.8976 Clc1ccc(cc1Cl)CSCc2ccccn2 62a_100000184707_100000721315 [0,2,0,0,0,0|1,1,0]=4 18679 B18R2.8976 Clc1ccc(cc1Cl)CSCc2ccccn2 62a_100000721315_100000184707 [0,2,0,0,0,0|1,1,0]=4 18680 B18R2.8976 Clc1ccc(cc1Cl)CSCc2cccnc2 62a_100000184707_100000741622 [0,2,0,0,0,0|1,1,0]=4 18681 B18R2.8976 Clc1ccc(cc1Cl)CSCc2cccnc2 62a_100000741622_100000184707 [0,2,0,0,0,0|1,1,0]=4 18682 B18R2.8976 Clc1ccc(cc1Cl)CSCc2ccncc2 62a_100000184707_100015193705 [0,2,0,0,0,0|1,1,0]=4 18683 B18R2.8976 Clc1ccc(cc1Cl)CSCc2ccncc2 62a_100015193705_100000184707 [0,2,0,0,0,0|1,1,0]=4 18684 B18R2.8976 Clc1ccc(cc1Cl)NCCc2ccccc2 2230a_100000184108_100000765856 [0,2,0,0,0,0|2,0,0]=4 18685 B18R2.8976 Clc1ccc(cc1Cl)NCCc2ccccc2 34a_100000184108_100000765856 [0,2,0,0,0,0|2,0,0]=4 18686 B18R2.8976 Clc1ccc(cc1Cl)OCCc2ccccc2 34a_100000211054_100000765856 [0,2,0,0,0,0|2,0,0]=4 18687 B18R2.8976 Clc1ccc(cc1Cl)OCCc2ccccc2 7a_100000211054_100000765856 [0,2,0,0,0,0|2,0,0]=4 18688 B18R2.8976 Clc1ccc(cc1Cl)SCCc2ccccc2 62a_100000765856_100011214914 [0,2,0,0,0,0|2,0,0]=4 18689 B18R2.8976 Clc1ccc(cc1Cl)SCCc2ccccc2 62a_100011214914_100011218657 [0,2,0,0,0,0|2,0,0]=4 18690 B18R2.8976 Clc1ccc(cc1I)CNCc2ccccc2 207a_100015324214_100010209939 [0,2,0,0,0,0|1,0,0]=3 18691 B18R2.8976 Clc1ccc(cc1I)CNCc2ccccc2 270004a_100015324214_100010209939 [0,2,0,0,0,0|1,0,0]=3 18692 B18R2.8976 Clc1ccc(cc1I)CNCc2ccccn2 270004a_100000210449_100010209939 [0,2,0,0,0,0|2,0,0]=4 18693 B18R2.8976 Clc1ccc(cc1I)CNCc2cccnc2 207a_100000210453_100010209939 [0,2,0,0,0,0|2,0,0]=4 18694 B18R2.8976 Clc1ccc(cc1I)CNCc2cccnc2 270004a_100000210453_100010209939 [0,2,0,0,0,0|2,0,0]=4 18695 B18R2.8976 Clc1ccc(cc1I)NCCc2ccccc2 34a_100012360549_100000765856 [0,2,0,0,0,0|2,0,0]=4 18696 B18R2.8976 Clc1ccc(cc1I)OCCc2ccccc2 34a_100000049588_100000765856 [0,2,0,0,0,0|2,0,0]=4 18697 B18R2.8976 Clc1ccc(cc1I)OCCc2ccccc2 7a_100000049588_100000765856 [0,2,0,0,0,0|2,0,0]=4 18698 B18R2.8976 Clc1ccc(nc1Cl)CNCc2ccccc2 2230a_100009887527_100015291786 [0,2,0,0,0,0|2,0,0]=4 18699 B18R2.8976 Clc1ccc(nc1Cl)CNCc2ccccc2 34a_100009887527_100015291786 [0,2,0,0,0,0|2,0,0]=4 18700 B18R2.8976 Clc1nc(ccc1Br)COCc2ccccc2 34a_100010065236_100015291786 [0,2,0,0,0,0|1,0,0]=3 18701 B18R2.8976 Clc1nc(ccc1Br)COCc2ccccn2 34a_100010065236_100000721315 [0,2,0,0,0,0|2,0,0]=4 18702 B18R2.8976 Clc1nc(ccc1Br)COCc2cccnc2 34a_100010065236_100000733263 [0,2,0,0,0,0|2,0,0]=4 18703 B18R2.8976 Clc1ncc(cc1Br)CNCc2ccccc2 207a_100015324214_100010244460 [0,2,0,0,0,0|2,0,0]=4 18704 B18R2.8976 Clc1ncc(cc1Br)COCc2ccccc2 34a_100010201731_100015291786 [0,2,0,0,0,0|1,0,0]=3 18705 B18R2.8976 Clc1ncc(cc1Br)COCc2ccccc2 7a_100010201731_100000211182 [0,2,0,0,0,0|1,0,0]=3 18706 B18R2.8976 Clc1ncc(cc1Br)COCc2ccccn2 34a_100010201731_100000721315 [0,2,0,0,0,0|2,0,0]=4 18707 B18R2.8976 Clc1ncc(cc1Br)COCc2ccccn2 7a_100010201731_100000721315 [0,2,0,0,0,0|2,0,0]=4 18708 B18R2.8976 Clc1ncc(cc1Br)COCc2cccnc2 34a_100010201731_100000733263 [0,2,0,0,0,0|2,0,0]=4 18709 B18R2.8976 Clc1ncc(cc1Br)COCc2cccnc2 7a_100010201731_100000741622 [0,2,0,0,0,0|2,0,0]=4 18710 B18R2.8976 Clc1ncc(cc1Br)COCc2ccncc2 7a_100010201731_100015193705 [0,2,0,0,0,0|2,0,0]=4 18711 B18R2.8976 Clc1ncc(cc1I)CNCc2ccccc2 2230a_100015324214_100011072623 [0,2,0,0,0,0|2,0,0]=4 18712 B18R2.8976 Clc1ncc(cc1I)CNCc2ccccc2 34a_100015324214_100011072623 [0,2,0,0,0,0|2,0,0]=4 18713 B18R2.8976 Clc1ncc(cc1I)COCc2ccccc2 34a_100000210790_100011072623 [0,2,0,0,0,0|1,0,0]=3 18714 B18R2.8976 Clc1ncc(cc1I)COCc2ccccc2 34a_200015217190_100015291786 [0,2,0,0,0,0|1,0,0]=3 18715 B18R2.8976 Clc1ncc(cc1I)COCc2ccccc2 7a_100000210790_100011072623 [0,2,0,0,0,0|1,0,0]=3 18716 B18R2.8976 Clc1ncc(cc1I)COCc2ccccc2 7a_200015217190_100000211182 [0,2,0,0,0,0|1,0,0]=3 18717 B18R2.8976 Clc1ncc(cc1I)COCc2ccccn2 34a_200015217190_100000721315 [0,2,0,0,0,0|2,0,0]=4 18718 B18R2.8976 Clc1ncc(cc1I)COCc2ccccn2 7a_200015217190_100000721315 [0,2,0,0,0,0|2,0,0]=4 18719 B18R2.8976 Clc1ncc(cc1I)COCc2cccnc2 34a_200015217190_100000733263 [0,2,0,0,0,0|2,0,0]=4 18720 B18R2.8976 Clc1ncc(cc1I)COCc2cccnc2 7a_200015217190_100000741622 [0,2,0,0,0,0|2,0,0]=4 18721 B18R2.8976 Clc1ncc(cc1I)COCc2ccncc2 7a_200015217190_100015193705 [0,2,0,0,0,0|2,0,0]=4 18722 B18R2.8976 Clc1ncc(cc1I)CSCc2ccccc2 62a_100000211182_100011072623 [0,2,0,0,0,0|1,1,0]=4 18723 B18R2.8976 Clc1ncc(cc1I)CSCc2ccccc2 62a_100011072623_100015291786 [0,2,0,0,0,0|1,1,0]=4 18724 B18R2.8976 Cn1cc(ccc1=O)CNCc2ccccc2 207a_100015324214_100010620449 [0,2,0,0,0,0|2,0,0]=4 18725 B18R2.8976 Cn1cc(ccc1=O)CNCc2ccccc2 270004a_100015324214_100010620449 [0,2,0,0,0,0|2,0,0]=4 18726 B18R2.8976 Fc1cc(ccc1Br)C=CCc2ccccc2 271570a_200016263579_100000685389 [0,2,0,0,0,0|1,0,1]=4 18727 B18R2.8976 Fc1cc(ccc1Br)CNCc2ccccc2 207a_100000755036_100015611070 [0,2,0,0,0,0|1,0,0]=3 18728 B18R2.8976 Fc1cc(ccc1Br)CNCc2ccccc2 207a_100015324214_100000686674 [0,2,0,0,0,0|1,0,0]=3 18729 B18R2.8976 Fc1cc(ccc1Br)CNCc2ccccc2 2230a_100000755036_100015291786 [0,2,0,0,0,0|1,0,0]=3 18730 B18R2.8976 Fc1cc(ccc1Br)CNCc2ccccc2 2230a_100015324214_100000767054 [0,2,0,0,0,0|1,0,0]=3 18731 B18R2.8976 Fc1cc(ccc1Br)CNCc2ccccc2 270004a_100000755036_100015611070 [0,2,0,0,0,0|1,0,0]=3 18732 B18R2.8976 Fc1cc(ccc1Br)CNCc2ccccc2 270004a_100015324214_100000686674 [0,2,0,0,0,0|1,0,0]=3 18733 B18R2.8976 Fc1cc(ccc1Br)CNCc2ccccc2 34a_100000755036_100015291786 [0,2,0,0,0,0|1,0,0]=3 18734 B18R2.8976 Fc1cc(ccc1Br)CNCc2ccccc2 34a_100015324214_100000767054 [0,2,0,0,0,0|1,0,0]=3 18735 B18R2.8976 Fc1cc(ccc1Br)CNCc2ccccn2 207a_100000755036_100000209966 [0,2,0,0,0,0|2,0,0]=4 18736 B18R2.8976 Fc1cc(ccc1Br)CNCc2ccccn2 2230a_100000755036_100000721315 [0,2,0,0,0,0|2,0,0]=4 18737 B18R2.8976 Fc1cc(ccc1Br)CNCc2ccccn2 270004a_100000210449_100000686674 [0,2,0,0,0,0|2,0,0]=4 18738 B18R2.8976 Fc1cc(ccc1Br)CNCc2ccccn2 270004a_100000755036_100000209966 [0,2,0,0,0,0|2,0,0]=4 18739 B18R2.8976 Fc1cc(ccc1Br)CNCc2ccccn2 34a_100000755036_100000721315 [0,2,0,0,0,0|2,0,0]=4 18740 B18R2.8976 Fc1cc(ccc1Br)CNCc2cccnc2 207a_100000210453_100000686674 [0,2,0,0,0,0|2,0,0]=4 18741 B18R2.8976 Fc1cc(ccc1Br)CNCc2cccnc2 207a_100000755036_100000209961 [0,2,0,0,0,0|2,0,0]=4 18742 B18R2.8976 Fc1cc(ccc1Br)CNCc2cccnc2 2230a_100000755036_100000741622 [0,2,0,0,0,0|2,0,0]=4 18743 B18R2.8976 Fc1cc(ccc1Br)CNCc2cccnc2 270004a_100000210453_100000686674 [0,2,0,0,0,0|2,0,0]=4 18744 B18R2.8976 Fc1cc(ccc1Br)CNCc2cccnc2 270004a_100000755036_100000209961 [0,2,0,0,0,0|2,0,0]=4 18745 B18R2.8976 Fc1cc(ccc1Br)CNCc2cccnc2 34a_100000755036_100000733263 [0,2,0,0,0,0|2,0,0]=4 18746 B18R2.8976 Fc1cc(ccc1Br)CNCc2ccncc2 207a_100000755036_100000186114 [0,2,0,0,0,0|2,0,0]=4 18747 B18R2.8976 Fc1cc(ccc1Br)CNCc2ccncc2 2230a_100000755036_100015193705 [0,2,0,0,0,0|2,0,0]=4 18748 B18R2.8976 Fc1cc(ccc1Br)COCc2ccccc2 34a_100000210790_100000767054 [0,2,0,0,0,0|0,0,0]=2 18749 B18R2.8976 Fc1cc(ccc1Br)COCc2ccccc2 34a_100011533735_100015291786 [0,2,0,0,0,0|0,0,0]=2 18750 B18R2.8976 Fc1cc(ccc1Br)COCc2ccccc2 7a_100000210790_100000767054 [0,2,0,0,0,0|0,0,0]=2 18751 B18R2.8976 Fc1cc(ccc1Br)COCc2ccccc2 7a_100011533735_100000211182 [0,2,0,0,0,0|0,0,0]=2 18752 B18R2.8976 Fc1cc(ccc1Br)COCc2ccccn2 34a_100011533735_100000721315 [0,2,0,0,0,0|1,0,0]=3 18753 B18R2.8976 Fc1cc(ccc1Br)COCc2ccccn2 7a_100011533735_100000721315 [0,2,0,0,0,0|1,0,0]=3 18754 B18R2.8976 Fc1cc(ccc1Br)COCc2cccnc2 34a_100011533735_100000733263 [0,2,0,0,0,0|1,0,0]=3 18755 B18R2.8976 Fc1cc(ccc1Br)COCc2cccnc2 7a_100011533735_100000741622 [0,2,0,0,0,0|1,0,0]=3 18756 B18R2.8976 Fc1cc(ccc1Br)COCc2cccnn2 34a_100011533735_100016990269 [0,2,0,0,0,0|2,0,0]=4 18757 B18R2.8976 Fc1cc(ccc1Br)COCc2cccnn2 7a_100011533735_100016990269 [0,2,0,0,0,0|2,0,0]=4 18758 B18R2.8976 Fc1cc(ccc1Br)COCc2ccncc2 7a_100011533735_100015193705 [0,2,0,0,0,0|1,0,0]=3 18759 B18R2.8976 Fc1cc(ccc1Br)COCc2cnccn2 34a_100011533735_100016995436 [0,2,0,0,0,0|2,0,0]=4 18760 B18R2.8976 Fc1cc(ccc1Br)COCc2cnccn2 7a_100011533735_100016995436 [0,2,0,0,0,0|2,0,0]=4 18761 B18R2.8976 Fc1cc(ccc1Br)COCc2cncnc2 34a_100011533735_100015196519 [0,2,0,0,0,0|2,0,0]=4 18762 B18R2.8976 Fc1cc(ccc1Br)COCc2cncnc2 7a_100011533735_100015196519 [0,2,0,0,0,0|2,0,0]=4 18763 B18R2.8976 Fc1cc(ccc1Br)COCc2ncccn2 34a_100011533735_100000703007 [0,2,0,0,0,0|2,0,0]=4 18764 B18R2.8976 Fc1cc(ccc1Br)COCc2ncccn2 7a_100011533735_100000703007 [0,2,0,0,0,0|2,0,0]=4 18765 B18R2.8976 Fc1cc(ccc1Br)CSCc2ccccc2 62a_100000211182_100000767054 [0,2,0,0,0,0|0,1,0]=3 18766 B18R2.8976 Fc1cc(ccc1Br)CSCc2ccccc2 62a_100000767054_100015291786 [0,2,0,0,0,0|0,1,0]=3 18767 B18R2.8976 Fc1cc(ccc1Br)CSCc2ccccn2 62a_100000721315_100000767054 [0,2,0,0,0,0|1,1,0]=4 18768 B18R2.8976 Fc1cc(ccc1Br)CSCc2ccccn2 62a_100000767054_100000721315 [0,2,0,0,0,0|1,1,0]=4 18769 B18R2.8976 Fc1cc(ccc1Br)CSCc2cccnc2 62a_100000741622_100000767054 [0,2,0,0,0,0|1,1,0]=4 18770 B18R2.8976 Fc1cc(ccc1Br)CSCc2cccnc2 62a_100000767054_100000741622 [0,2,0,0,0,0|1,1,0]=4 18771 B18R2.8976 Fc1cc(ccc1Br)CSCc2ccncc2 62a_100000767054_100015193705 [0,2,0,0,0,0|1,1,0]=4 18772 B18R2.8976 Fc1cc(ccc1Br)CSCc2ccncc2 62a_100015193705_100000767054 [0,2,0,0,0,0|1,1,0]=4 18773 B18R2.8976 Fc1cc(ccc1Br)NCCc2ccccc2 2230a_100000759894_100000765856 [0,2,0,0,0,0|2,0,0]=4 18774 B18R2.8976 Fc1cc(ccc1Br)NCCc2ccccc2 34a_100000759894_100000765856 [0,2,0,0,0,0|2,0,0]=4 18775 B18R2.8976 Fc1cc(ccc1Br)NCCc2ccccc2 7a_100000759894_100000765856 [0,2,0,0,0,0|2,0,0]=4 18776 B18R2.8976 Fc1cc(ccc1Br)OCCc2ccccc2 34a_100000755031_100000765856 [0,2,0,0,0,0|2,0,0]=4 18777 B18R2.8976 Fc1cc(ccc1Br)OCCc2ccccc2 7a_100000755031_100000765856 [0,2,0,0,0,0|2,0,0]=4 18778 B18R2.8976 Fc1cc(ccc1Br)SCCc2ccccc2 62a_100000685389_100011218657 [0,2,0,0,0,0|2,0,0]=4 18779 B18R2.8976 Fc1cc(ccc1Br)SCCc2ccccc2 62a_100000765856_100000685389 [0,2,0,0,0,0|2,0,0]=4 18780 B18R2.8976 Fc1cc(ccc1Cl)C=CCc2ccccc2 271570a_200016263579_100011216805 [0,2,0,0,0,0|1,0,1]=4 18781 B18R2.8976 Fc1cc(ccc1Cl)CNCc2ccccc2 207a_100011219866_100015611070 [0,2,0,0,0,0|1,0,0]=3 18782 B18R2.8976 Fc1cc(ccc1Cl)CNCc2ccccc2 207a_100015324214_100000745630 [0,2,0,0,0,0|1,0,0]=3 18783 B18R2.8976 Fc1cc(ccc1Cl)CNCc2ccccc2 2230a_100011219866_100015291786 [0,2,0,0,0,0|1,0,0]=3 18784 B18R2.8976 Fc1cc(ccc1Cl)CNCc2ccccc2 2230a_100015324214_100000716492 [0,2,0,0,0,0|1,0,0]=3 18785 B18R2.8976 Fc1cc(ccc1Cl)CNCc2ccccc2 270004a_100011219866_100015611070 [0,2,0,0,0,0|1,0,0]=3 18786 B18R2.8976 Fc1cc(ccc1Cl)CNCc2ccccc2 270004a_100015324214_100000745630 [0,2,0,0,0,0|1,0,0]=3 18787 B18R2.8976 Fc1cc(ccc1Cl)CNCc2ccccc2 34a_100011219866_100015291786 [0,2,0,0,0,0|1,0,0]=3 18788 B18R2.8976 Fc1cc(ccc1Cl)CNCc2ccccc2 34a_100015324214_100011519011 [0,2,0,0,0,0|1,0,0]=3 18789 B18R2.8976 Fc1cc(ccc1Cl)CNCc2ccccn2 207a_100011219866_100000209966 [0,2,0,0,0,0|2,0,0]=4 18790 B18R2.8976 Fc1cc(ccc1Cl)CNCc2ccccn2 2230a_100011219866_100000721315 [0,2,0,0,0,0|2,0,0]=4 18791 B18R2.8976 Fc1cc(ccc1Cl)CNCc2ccccn2 270004a_100000210449_100000745630 [0,2,0,0,0,0|2,0,0]=4 18792 B18R2.8976 Fc1cc(ccc1Cl)CNCc2ccccn2 270004a_100011219866_100000209966 [0,2,0,0,0,0|2,0,0]=4 18793 B18R2.8976 Fc1cc(ccc1Cl)CNCc2ccccn2 34a_100011219866_100000721315 [0,2,0,0,0,0|2,0,0]=4 18794 B18R2.8976 Fc1cc(ccc1Cl)CNCc2cccnc2 207a_100000210453_100000745630 [0,2,0,0,0,0|2,0,0]=4 18795 B18R2.8976 Fc1cc(ccc1Cl)CNCc2cccnc2 207a_100011219866_100000209961 [0,2,0,0,0,0|2,0,0]=4 18796 B18R2.8976 Fc1cc(ccc1Cl)CNCc2cccnc2 2230a_100011219866_100000741622 [0,2,0,0,0,0|2,0,0]=4 18797 B18R2.8976 Fc1cc(ccc1Cl)CNCc2cccnc2 270004a_100000210453_100000745630 [0,2,0,0,0,0|2,0,0]=4 18798 B18R2.8976 Fc1cc(ccc1Cl)CNCc2cccnc2 270004a_100011219866_100000209961 [0,2,0,0,0,0|2,0,0]=4 18799 B18R2.8976 Fc1cc(ccc1Cl)CNCc2cccnc2 34a_100011219866_100000733263 [0,2,0,0,0,0|2,0,0]=4 18800 B18R2.8976 Fc1cc(ccc1Cl)CNCc2ccncc2 207a_100011219866_100000186114 [0,2,0,0,0,0|2,0,0]=4 18801 B18R2.8976 Fc1cc(ccc1Cl)CNCc2ccncc2 2230a_100011219866_100015193705 [0,2,0,0,0,0|2,0,0]=4 18802 B18R2.8976 Fc1cc(ccc1Cl)COCc2ccccc2 34a_100000210790_100011519011 [0,2,0,0,0,0|0,0,0]=2 18803 B18R2.8976 Fc1cc(ccc1Cl)COCc2ccccc2 34a_100011218299_100015291786 [0,2,0,0,0,0|0,0,0]=2 18804 B18R2.8976 Fc1cc(ccc1Cl)COCc2ccccc2 7a_100000210790_100000716492 [0,2,0,0,0,0|0,0,0]=2 18805 B18R2.8976 Fc1cc(ccc1Cl)COCc2ccccc2 7a_100011218299_100000211182 [0,2,0,0,0,0|0,0,0]=2 18806 B18R2.8976 Fc1cc(ccc1Cl)COCc2ccccn2 34a_100011218299_100000721315 [0,2,0,0,0,0|1,0,0]=3 18807 B18R2.8976 Fc1cc(ccc1Cl)COCc2ccccn2 7a_100011218299_100000721315 [0,2,0,0,0,0|1,0,0]=3 18808 B18R2.8976 Fc1cc(ccc1Cl)COCc2cccnc2 34a_100011218299_100000733263 [0,2,0,0,0,0|1,0,0]=3 18809 B18R2.8976 Fc1cc(ccc1Cl)COCc2cccnc2 7a_100011218299_100000741622 [0,2,0,0,0,0|1,0,0]=3 18810 B18R2.8976 Fc1cc(ccc1Cl)COCc2cccnn2 34a_100011218299_100016990269 [0,2,0,0,0,0|2,0,0]=4 18811 B18R2.8976 Fc1cc(ccc1Cl)COCc2cccnn2 7a_100011218299_100016990269 [0,2,0,0,0,0|2,0,0]=4 18812 B18R2.8976 Fc1cc(ccc1Cl)COCc2ccncc2 7a_100011218299_100015193705 [0,2,0,0,0,0|1,0,0]=3 18813 B18R2.8976 Fc1cc(ccc1Cl)COCc2cnccn2 34a_100011218299_100016995436 [0,2,0,0,0,0|2,0,0]=4 18814 B18R2.8976 Fc1cc(ccc1Cl)COCc2cnccn2 7a_100011218299_100016995436 [0,2,0,0,0,0|2,0,0]=4 18815 B18R2.8976 Fc1cc(ccc1Cl)COCc2cncnc2 34a_100011218299_100015196519 [0,2,0,0,0,0|2,0,0]=4 18816 B18R2.8976 Fc1cc(ccc1Cl)COCc2cncnc2 7a_100011218299_100015196519 [0,2,0,0,0,0|2,0,0]=4 18817 B18R2.8976 Fc1cc(ccc1Cl)COCc2ncccn2 34a_100011218299_100000703007 [0,2,0,0,0,0|2,0,0]=4 18818 B18R2.8976 Fc1cc(ccc1Cl)COCc2ncccn2 7a_100011218299_100000703007 [0,2,0,0,0,0|2,0,0]=4 18819 B18R2.8976 Fc1cc(ccc1Cl)CSCc2ccccc2 62a_100000211182_100000716492 [0,2,0,0,0,0|0,1,0]=3 18820 B18R2.8976 Fc1cc(ccc1Cl)CSCc2ccccc2 62a_100000716492_100015291786 [0,2,0,0,0,0|0,1,0]=3 18821 B18R2.8976 Fc1cc(ccc1Cl)CSCc2ccccn2 62a_100000716492_100000721315 [0,2,0,0,0,0|1,1,0]=4 18822 B18R2.8976 Fc1cc(ccc1Cl)CSCc2ccccn2 62a_100000721315_100000716492 [0,2,0,0,0,0|1,1,0]=4 18823 B18R2.8976 Fc1cc(ccc1Cl)CSCc2cccnc2 62a_100000716492_100000741622 [0,2,0,0,0,0|1,1,0]=4 18824 B18R2.8976 Fc1cc(ccc1Cl)CSCc2cccnc2 62a_100000741622_100000716492 [0,2,0,0,0,0|1,1,0]=4 18825 B18R2.8976 Fc1cc(ccc1Cl)CSCc2ccncc2 62a_100000716492_100015193705 [0,2,0,0,0,0|1,1,0]=4 18826 B18R2.8976 Fc1cc(ccc1Cl)CSCc2ccncc2 62a_100015193705_100000716492 [0,2,0,0,0,0|1,1,0]=4 18827 B18R2.8976 Fc1cc(ccc1Cl)NCCc2ccccc2 2230a_100000739366_100000765856 [0,2,0,0,0,0|2,0,0]=4 18828 B18R2.8976 Fc1cc(ccc1Cl)NCCc2ccccc2 34a_100000739366_100000765856 [0,2,0,0,0,0|2,0,0]=4 18829 B18R2.8976 Fc1cc(ccc1Cl)NCCc2ccccc2 7a_100000739366_100000765856 [0,2,0,0,0,0|2,0,0]=4 18830 B18R2.8976 Fc1cc(ccc1Cl)OCCc2ccccc2 34a_100000691581_100000765856 [0,2,0,0,0,0|2,0,0]=4 18831 B18R2.8976 Fc1cc(ccc1Cl)OCCc2ccccc2 7a_100000691581_100000765856 [0,2,0,0,0,0|2,0,0]=4 18832 B18R2.8976 Fc1cc(ccc1Cl)SCCc2ccccc2 62a_100000765856_100011216805 [0,2,0,0,0,0|2,0,0]=4 18833 B18R2.8976 Fc1cc(ccc1Cl)SCCc2ccccc2 62a_100011216805_100011218657 [0,2,0,0,0,0|2,0,0]=4 18834 B18R2.8976 Fc1cc(ccc1I)CNCc2ccccc2 207a_100015324214_100000050832 [0,2,0,0,0,0|1,0,0]=3 18835 B18R2.8976 Fc1cc(ccc1I)CNCc2ccccc2 2230a_100015324214_100010149604 [0,2,0,0,0,0|1,0,0]=3 18836 B18R2.8976 Fc1cc(ccc1I)CNCc2ccccc2 270004a_100015324214_100000050832 [0,2,0,0,0,0|1,0,0]=3 18837 B18R2.8976 Fc1cc(ccc1I)CNCc2ccccc2 34a_100015324214_100010149604 [0,2,0,0,0,0|1,0,0]=3 18838 B18R2.8976 Fc1cc(ccc1I)CNCc2ccccn2 270004a_100000210449_100000050832 [0,2,0,0,0,0|2,0,0]=4 18839 B18R2.8976 Fc1cc(ccc1I)CNCc2cccnc2 207a_100000210453_100000050832 [0,2,0,0,0,0|2,0,0]=4 18840 B18R2.8976 Fc1cc(ccc1I)CNCc2cccnc2 270004a_100000210453_100000050832 [0,2,0,0,0,0|2,0,0]=4 18841 B18R2.8976 Fc1cc(ccc1I)COCc2ccccc2 34a_100000210790_100010149604 [0,2,0,0,0,0|0,0,0]=2 18842 B18R2.8976 Fc1cc(ccc1I)COCc2ccccc2 34a_100010149597_100015291786 [0,2,0,0,0,0|0,0,0]=2 18843 B18R2.8976 Fc1cc(ccc1I)COCc2ccccc2 7a_100000210790_100010149604 [0,2,0,0,0,0|0,0,0]=2 18844 B18R2.8976 Fc1cc(ccc1I)COCc2ccccc2 7a_100010149597_100000211182 [0,2,0,0,0,0|0,0,0]=2 18845 B18R2.8976 Fc1cc(ccc1I)COCc2ccccn2 34a_100010149597_100000721315 [0,2,0,0,0,0|1,0,0]=3 18846 B18R2.8976 Fc1cc(ccc1I)COCc2ccccn2 7a_100010149597_100000721315 [0,2,0,0,0,0|1,0,0]=3 18847 B18R2.8976 Fc1cc(ccc1I)COCc2cccnc2 34a_100010149597_100000733263 [0,2,0,0,0,0|1,0,0]=3 18848 B18R2.8976 Fc1cc(ccc1I)COCc2cccnc2 7a_100010149597_100000741622 [0,2,0,0,0,0|1,0,0]=3 18849 B18R2.8976 Fc1cc(ccc1I)COCc2cccnn2 34a_100010149597_100016990269 [0,2,0,0,0,0|2,0,0]=4 18850 B18R2.8976 Fc1cc(ccc1I)COCc2cccnn2 7a_100010149597_100016990269 [0,2,0,0,0,0|2,0,0]=4 18851 B18R2.8976 Fc1cc(ccc1I)COCc2ccncc2 7a_100010149597_100015193705 [0,2,0,0,0,0|1,0,0]=3 18852 B18R2.8976 Fc1cc(ccc1I)COCc2cnccn2 34a_100010149597_100016995436 [0,2,0,0,0,0|2,0,0]=4 18853 B18R2.8976 Fc1cc(ccc1I)COCc2cnccn2 7a_100010149597_100016995436 [0,2,0,0,0,0|2,0,0]=4 18854 B18R2.8976 Fc1cc(ccc1I)COCc2cncnc2 34a_100010149597_100015196519 [0,2,0,0,0,0|2,0,0]=4 18855 B18R2.8976 Fc1cc(ccc1I)COCc2cncnc2 7a_100010149597_100015196519 [0,2,0,0,0,0|2,0,0]=4 18856 B18R2.8976 Fc1cc(ccc1I)COCc2ncccn2 34a_100010149597_100000703007 [0,2,0,0,0,0|2,0,0]=4 18857 B18R2.8976 Fc1cc(ccc1I)COCc2ncccn2 7a_100010149597_100000703007 [0,2,0,0,0,0|2,0,0]=4 18858 B18R2.8976 Fc1cc(ccc1I)CSCc2ccccc2 62a_100000211182_100010149604 [0,2,0,0,0,0|0,1,0]=3 18859 B18R2.8976 Fc1cc(ccc1I)CSCc2ccccc2 62a_100010149604_100015291786 [0,2,0,0,0,0|0,1,0]=3 18860 B18R2.8976 Fc1cc(ccc1I)CSCc2ccccn2 62a_100000721315_100010149604 [0,2,0,0,0,0|1,1,0]=4 18861 B18R2.8976 Fc1cc(ccc1I)CSCc2ccccn2 62a_100010149604_100000721315 [0,2,0,0,0,0|1,1,0]=4 18862 B18R2.8976 Fc1cc(ccc1I)CSCc2cccnc2 62a_100000741622_100010149604 [0,2,0,0,0,0|1,1,0]=4 18863 B18R2.8976 Fc1cc(ccc1I)CSCc2cccnc2 62a_100010149604_100000741622 [0,2,0,0,0,0|1,1,0]=4 18864 B18R2.8976 Fc1cc(ccc1I)CSCc2ccncc2 62a_100010149604_100015193705 [0,2,0,0,0,0|1,1,0]=4 18865 B18R2.8976 Fc1cc(ccc1I)CSCc2ccncc2 62a_100015193705_100010149604 [0,2,0,0,0,0|1,1,0]=4 18866 B18R2.8976 Fc1cc(ccc1I)NCCc2ccccc2 34a_100011356925_100000765856 [0,2,0,0,0,0|2,0,0]=4 18867 B18R2.8976 Fc1cc(ccc1I)NCCc2ccccc2 7a_100011356925_100000765856 [0,2,0,0,0,0|2,0,0]=4 18868 B18R2.8976 Fc1cc(ccc1I)OCCc2ccccc2 34a_100009990212_100000765856 [0,2,0,0,0,0|2,0,0]=4 18869 B18R2.8976 Fc1cc(ccc1I)OCCc2ccccc2 7a_100009990212_100000765856 [0,2,0,0,0,0|2,0,0]=4 18870 B18R2.8976 Fc1cc(cnc1Br)CNCc2ccccc2 270004a_100015324214_100010064875 [0,2,0,0,0,0|2,0,0]=4 18871 B18R2.8976 Fc1cc(cnc1Br)COCc2ccccc2 34a_100010065243_100015291786 [0,2,0,0,0,0|1,0,0]=3 18872 B18R2.8976 Fc1cc(cnc1Br)COCc2ccccc2 7a_100010065243_100000211182 [0,2,0,0,0,0|1,0,0]=3 18873 B18R2.8976 Fc1cc(cnc1Br)COCc2ccccn2 34a_100010065243_100000721315 [0,2,0,0,0,0|2,0,0]=4 18874 B18R2.8976 Fc1cc(cnc1Br)COCc2ccccn2 7a_100010065243_100000721315 [0,2,0,0,0,0|2,0,0]=4 18875 B18R2.8976 Fc1cc(cnc1Br)COCc2cccnc2 34a_100010065243_100000733263 [0,2,0,0,0,0|2,0,0]=4 18876 B18R2.8976 Fc1cc(cnc1Br)COCc2cccnc2 7a_100010065243_100000741622 [0,2,0,0,0,0|2,0,0]=4 18877 B18R2.8976 Fc1cc(cnc1Br)COCc2ccncc2 7a_100010065243_100015193705 [0,2,0,0,0,0|2,0,0]=4 18878 B18R2.8976 Fc1cc(cnc1Cl)CNCc2ccccc2 270004a_100015324214_100009866847 [0,2,0,0,0,0|2,0,0]=4 18879 B18R2.8976 Fc1ccc(cc1Br)C=CCc2ccccc2 271570a_200016263579_100012047266 [0,2,0,0,0,0|1,0,1]=4 18880 B18R2.8976 Fc1ccc(cc1Br)CNCc2ccccc2 207a_100015193890_100015611070 [0,2,0,0,0,0|1,0,0]=3 18881 B18R2.8976 Fc1ccc(cc1Br)CNCc2ccccc2 207a_100015324214_100000211747 [0,2,0,0,0,0|1,0,0]=3 18882 B18R2.8976 Fc1ccc(cc1Br)CNCc2ccccc2 2230a_100015193890_100015291786 [0,2,0,0,0,0|1,0,0]=3 18883 B18R2.8976 Fc1ccc(cc1Br)CNCc2ccccc2 2230a_100015324214_100011206884 [0,2,0,0,0,0|1,0,0]=3 18884 B18R2.8976 Fc1ccc(cc1Br)CNCc2ccccc2 270004a_100015193890_100015611070 [0,2,0,0,0,0|1,0,0]=3 18885 B18R2.8976 Fc1ccc(cc1Br)CNCc2ccccc2 270004a_100015324214_100000211747 [0,2,0,0,0,0|1,0,0]=3 18886 B18R2.8976 Fc1ccc(cc1Br)CNCc2ccccc2 34a_100015193890_100015291786 [0,2,0,0,0,0|1,0,0]=3 18887 B18R2.8976 Fc1ccc(cc1Br)CNCc2ccccc2 34a_100015324214_100011206884 [0,2,0,0,0,0|1,0,0]=3 18888 B18R2.8976 Fc1ccc(cc1Br)CNCc2ccccn2 207a_100015193890_100000209966 [0,2,0,0,0,0|2,0,0]=4 18889 B18R2.8976 Fc1ccc(cc1Br)CNCc2ccccn2 2230a_100015193890_100000721315 [0,2,0,0,0,0|2,0,0]=4 18890 B18R2.8976 Fc1ccc(cc1Br)CNCc2ccccn2 270004a_100000210449_100000211747 [0,2,0,0,0,0|2,0,0]=4 18891 B18R2.8976 Fc1ccc(cc1Br)CNCc2ccccn2 270004a_100015193890_100000209966 [0,2,0,0,0,0|2,0,0]=4 18892 B18R2.8976 Fc1ccc(cc1Br)CNCc2ccccn2 34a_100015193890_100000721315 [0,2,0,0,0,0|2,0,0]=4 18893 B18R2.8976 Fc1ccc(cc1Br)CNCc2cccnc2 207a_100000210453_100000211747 [0,2,0,0,0,0|2,0,0]=4 18894 B18R2.8976 Fc1ccc(cc1Br)CNCc2cccnc2 207a_100015193890_100000209961 [0,2,0,0,0,0|2,0,0]=4 18895 B18R2.8976 Fc1ccc(cc1Br)CNCc2cccnc2 2230a_100015193890_100000741622 [0,2,0,0,0,0|2,0,0]=4 18896 B18R2.8976 Fc1ccc(cc1Br)CNCc2cccnc2 270004a_100000210453_100000211747 [0,2,0,0,0,0|2,0,0]=4 18897 B18R2.8976 Fc1ccc(cc1Br)CNCc2cccnc2 270004a_100015193890_100000209961 [0,2,0,0,0,0|2,0,0]=4 18898 B18R2.8976 Fc1ccc(cc1Br)CNCc2cccnc2 34a_100015193890_100000733263 [0,2,0,0,0,0|2,0,0]=4 18899 B18R2.8976 Fc1ccc(cc1Br)CNCc2ccncc2 207a_100015193890_100000186114 [0,2,0,0,0,0|2,0,0]=4 18900 B18R2.8976 Fc1ccc(cc1Br)CNCc2ccncc2 2230a_100015193890_100015193705 [0,2,0,0,0,0|2,0,0]=4 18901 B18R2.8976 Fc1ccc(cc1Br)COCc2ccccc2 34a_100000210790_100011206884 [0,2,0,0,0,0|0,0,0]=2 18902 B18R2.8976 Fc1ccc(cc1Br)COCc2ccccc2 34a_100000246287_100015291786 [0,2,0,0,0,0|0,0,0]=2 18903 B18R2.8976 Fc1ccc(cc1Br)COCc2ccccc2 7a_100000210790_100011206884 [0,2,0,0,0,0|0,0,0]=2 18904 B18R2.8976 Fc1ccc(cc1Br)COCc2ccccc2 7a_100000246287_100000211182 [0,2,0,0,0,0|0,0,0]=2 18905 B18R2.8976 Fc1ccc(cc1Br)COCc2ccccn2 34a_100000246287_100000721315 [0,2,0,0,0,0|1,0,0]=3 18906 B18R2.8976 Fc1ccc(cc1Br)COCc2ccccn2 7a_100000246287_100000721315 [0,2,0,0,0,0|1,0,0]=3 18907 B18R2.8976 Fc1ccc(cc1Br)COCc2cccnc2 34a_100000246287_100000733263 [0,2,0,0,0,0|1,0,0]=3 18908 B18R2.8976 Fc1ccc(cc1Br)COCc2cccnc2 7a_100000246287_100000741622 [0,2,0,0,0,0|1,0,0]=3 18909 B18R2.8976 Fc1ccc(cc1Br)COCc2cccnn2 34a_100000246287_100016990269 [0,2,0,0,0,0|2,0,0]=4 18910 B18R2.8976 Fc1ccc(cc1Br)COCc2cccnn2 7a_100000246287_100016990269 [0,2,0,0,0,0|2,0,0]=4 18911 B18R2.8976 Fc1ccc(cc1Br)COCc2ccncc2 7a_100000246287_100015193705 [0,2,0,0,0,0|1,0,0]=3 18912 B18R2.8976 Fc1ccc(cc1Br)COCc2cnccn2 34a_100000246287_100016995436 [0,2,0,0,0,0|2,0,0]=4 18913 B18R2.8976 Fc1ccc(cc1Br)COCc2cnccn2 7a_100000246287_100016995436 [0,2,0,0,0,0|2,0,0]=4 18914 B18R2.8976 Fc1ccc(cc1Br)COCc2cncnc2 34a_100000246287_100015196519 [0,2,0,0,0,0|2,0,0]=4 18915 B18R2.8976 Fc1ccc(cc1Br)COCc2cncnc2 7a_100000246287_100015196519 [0,2,0,0,0,0|2,0,0]=4 18916 B18R2.8976 Fc1ccc(cc1Br)COCc2ncccn2 34a_100000246287_100000703007 [0,2,0,0,0,0|2,0,0]=4 18917 B18R2.8976 Fc1ccc(cc1Br)COCc2ncccn2 7a_100000246287_100000703007 [0,2,0,0,0,0|2,0,0]=4 18918 B18R2.8976 Fc1ccc(cc1Br)CSCc2ccccc2 62a_100000211182_100011206884 [0,2,0,0,0,0|0,1,0]=3 18919 B18R2.8976 Fc1ccc(cc1Br)CSCc2ccccc2 62a_100011206884_100015291786 [0,2,0,0,0,0|0,1,0]=3 18920 B18R2.8976 Fc1ccc(cc1Br)CSCc2ccccn2 62a_100000721315_100011206884 [0,2,0,0,0,0|1,1,0]=4 18921 B18R2.8976 Fc1ccc(cc1Br)CSCc2ccccn2 62a_100011206884_100000721315 [0,2,0,0,0,0|1,1,0]=4 18922 B18R2.8976 Fc1ccc(cc1Br)CSCc2cccnc2 62a_100000741622_100011206884 [0,2,0,0,0,0|1,1,0]=4 18923 B18R2.8976 Fc1ccc(cc1Br)CSCc2cccnc2 62a_100011206884_100000741622 [0,2,0,0,0,0|1,1,0]=4 18924 B18R2.8976 Fc1ccc(cc1Br)CSCc2ccncc2 62a_100011206884_100015193705 [0,2,0,0,0,0|1,1,0]=4 18925 B18R2.8976 Fc1ccc(cc1Br)CSCc2ccncc2 62a_100015193705_100011206884 [0,2,0,0,0,0|1,1,0]=4 18926 B18R2.8976 Fc1ccc(cc1Br)NCCc2ccccc2 2230a_100000760356_100000765856 [0,2,0,0,0,0|2,0,0]=4 18927 B18R2.8976 Fc1ccc(cc1Br)NCCc2ccccc2 34a_100000760356_100000765856 [0,2,0,0,0,0|2,0,0]=4 18928 B18R2.8976 Fc1ccc(cc1Br)NCCc2ccccc2 7a_100000760356_100000765856 [0,2,0,0,0,0|2,0,0]=4 18929 B18R2.8976 Fc1ccc(cc1Br)OCCc2ccccc2 34a_100000693481_100000765856 [0,2,0,0,0,0|2,0,0]=4 18930 B18R2.8976 Fc1ccc(cc1Br)OCCc2ccccc2 7a_100000693481_100000765856 [0,2,0,0,0,0|2,0,0]=4 18931 B18R2.8976 Fc1ccc(cc1Br)SCCc2ccccc2 62a_100000765856_100012047266 [0,2,0,0,0,0|2,0,0]=4 18932 B18R2.8976 Fc1ccc(cc1Br)SCCc2ccccc2 62a_100012047266_100011218657 [0,2,0,0,0,0|2,0,0]=4 18933 B18R2.8976 Fc1ccc(cc1Cl)C=CCc2ccccc2 271570a_200016263579_100011215976 [0,2,0,0,0,0|1,0,1]=4 18934 B18R2.8976 Fc1ccc(cc1Cl)CCNc2ccccc2 34a_100000106764_100012361305 [0,2,0,0,0,0|2,0,0]=4 18935 B18R2.8976 Fc1ccc(cc1Cl)CCOc2ccccc2 34a_100000210340_100012361305 [0,2,0,0,0,0|2,0,0]=4 18936 B18R2.8976 Fc1ccc(cc1Cl)CCOc2ccccc2 7a_100000210340_100012361305 [0,2,0,0,0,0|2,0,0]=4 18937 B18R2.8976 Fc1ccc(cc1Cl)CCSc2ccccc2 62a_100000719477_100012361305 [0,2,0,0,0,0|2,0,0]=4 18938 B18R2.8976 Fc1ccc(cc1Cl)CCSc2ccccc2 62a_100012361305_100000041952 [0,2,0,0,0,0|2,0,0]=4 18939 B18R2.8976 Fc1ccc(cc1Cl)CNCc2ccccc2 207a_100000749334_100015611070 [0,2,0,0,0,0|1,0,0]=3 18940 B18R2.8976 Fc1ccc(cc1Cl)CNCc2ccccc2 207a_100015324214_100000742290 [0,2,0,0,0,0|1,0,0]=3 18941 B18R2.8976 Fc1ccc(cc1Cl)CNCc2ccccc2 2230a_100000749334_100015291786 [0,2,0,0,0,0|1,0,0]=3 18942 B18R2.8976 Fc1ccc(cc1Cl)CNCc2ccccc2 2230a_100015324214_100000717365 [0,2,0,0,0,0|1,0,0]=3 18943 B18R2.8976 Fc1ccc(cc1Cl)CNCc2ccccc2 270004a_100000749334_100015611070 [0,2,0,0,0,0|1,0,0]=3 18944 B18R2.8976 Fc1ccc(cc1Cl)CNCc2ccccc2 270004a_100015324214_100000742290 [0,2,0,0,0,0|1,0,0]=3 18945 B18R2.8976 Fc1ccc(cc1Cl)CNCc2ccccc2 34a_100000749334_100015291786 [0,2,0,0,0,0|1,0,0]=3 18946 B18R2.8976 Fc1ccc(cc1Cl)CNCc2ccccc2 34a_100015324214_100011934319 [0,2,0,0,0,0|1,0,0]=3 18947 B18R2.8976 Fc1ccc(cc1Cl)CNCc2ccccn2 207a_100000749334_100000209966 [0,2,0,0,0,0|2,0,0]=4 18948 B18R2.8976 Fc1ccc(cc1Cl)CNCc2ccccn2 2230a_100000749334_100000721315 [0,2,0,0,0,0|2,0,0]=4 18949 B18R2.8976 Fc1ccc(cc1Cl)CNCc2ccccn2 270004a_100000210449_100000742290 [0,2,0,0,0,0|2,0,0]=4 18950 B18R2.8976 Fc1ccc(cc1Cl)CNCc2ccccn2 270004a_100000749334_100000209966 [0,2,0,0,0,0|2,0,0]=4 18951 B18R2.8976 Fc1ccc(cc1Cl)CNCc2ccccn2 34a_100000749334_100000721315 [0,2,0,0,0,0|2,0,0]=4 18952 B18R2.8976 Fc1ccc(cc1Cl)CNCc2cccnc2 207a_100000210453_100000742290 [0,2,0,0,0,0|2,0,0]=4 18953 B18R2.8976 Fc1ccc(cc1Cl)CNCc2cccnc2 207a_100000749334_100000209961 [0,2,0,0,0,0|2,0,0]=4 18954 B18R2.8976 Fc1ccc(cc1Cl)CNCc2cccnc2 2230a_100000749334_100000741622 [0,2,0,0,0,0|2,0,0]=4 18955 B18R2.8976 Fc1ccc(cc1Cl)CNCc2cccnc2 270004a_100000210453_100000742290 [0,2,0,0,0,0|2,0,0]=4 18956 B18R2.8976 Fc1ccc(cc1Cl)CNCc2cccnc2 270004a_100000749334_100000209961 [0,2,0,0,0,0|2,0,0]=4 18957 B18R2.8976 Fc1ccc(cc1Cl)CNCc2cccnc2 34a_100000749334_100000733263 [0,2,0,0,0,0|2,0,0]=4 18958 B18R2.8976 Fc1ccc(cc1Cl)CNCc2ccncc2 207a_100000749334_100000186114 [0,2,0,0,0,0|2,0,0]=4 18959 B18R2.8976 Fc1ccc(cc1Cl)CNCc2ccncc2 2230a_100000749334_100015193705 [0,2,0,0,0,0|2,0,0]=4 18960 B18R2.8976 Fc1ccc(cc1Cl)COCc2ccccc2 34a_100000210790_100011934319 [0,2,0,0,0,0|0,0,0]=2 18961 B18R2.8976 Fc1ccc(cc1Cl)COCc2ccccc2 34a_100011217911_100015291786 [0,2,0,0,0,0|0,0,0]=2 18962 B18R2.8976 Fc1ccc(cc1Cl)COCc2ccccc2 7a_100000210790_100000717365 [0,2,0,0,0,0|0,0,0]=2 18963 B18R2.8976 Fc1ccc(cc1Cl)COCc2ccccc2 7a_100011217911_100000211182 [0,2,0,0,0,0|0,0,0]=2 18964 B18R2.8976 Fc1ccc(cc1Cl)COCc2ccccn2 34a_100011217911_100000721315 [0,2,0,0,0,0|1,0,0]=3 18965 B18R2.8976 Fc1ccc(cc1Cl)COCc2ccccn2 7a_100011217911_100000721315 [0,2,0,0,0,0|1,0,0]=3 18966 B18R2.8976 Fc1ccc(cc1Cl)COCc2cccnc2 34a_100011217911_100000733263 [0,2,0,0,0,0|1,0,0]=3 18967 B18R2.8976 Fc1ccc(cc1Cl)COCc2cccnc2 7a_100011217911_100000741622 [0,2,0,0,0,0|1,0,0]=3 18968 B18R2.8976 Fc1ccc(cc1Cl)COCc2cccnn2 34a_100011217911_100016990269 [0,2,0,0,0,0|2,0,0]=4 18969 B18R2.8976 Fc1ccc(cc1Cl)COCc2cccnn2 7a_100011217911_100016990269 [0,2,0,0,0,0|2,0,0]=4 18970 B18R2.8976 Fc1ccc(cc1Cl)COCc2ccncc2 7a_100011217911_100015193705 [0,2,0,0,0,0|1,0,0]=3 18971 B18R2.8976 Fc1ccc(cc1Cl)COCc2cnccn2 34a_100011217911_100016995436 [0,2,0,0,0,0|2,0,0]=4 18972 B18R2.8976 Fc1ccc(cc1Cl)COCc2cnccn2 7a_100011217911_100016995436 [0,2,0,0,0,0|2,0,0]=4 18973 B18R2.8976 Fc1ccc(cc1Cl)COCc2cncnc2 34a_100011217911_100015196519 [0,2,0,0,0,0|2,0,0]=4 18974 B18R2.8976 Fc1ccc(cc1Cl)COCc2cncnc2 7a_100011217911_100015196519 [0,2,0,0,0,0|2,0,0]=4 18975 B18R2.8976 Fc1ccc(cc1Cl)COCc2ncccn2 34a_100011217911_100000703007 [0,2,0,0,0,0|2,0,0]=4 18976 B18R2.8976 Fc1ccc(cc1Cl)COCc2ncccn2 7a_100011217911_100000703007 [0,2,0,0,0,0|2,0,0]=4 18977 B18R2.8976 Fc1ccc(cc1Cl)CSCc2ccccc2 62a_100000211182_100011934319 [0,2,0,0,0,0|0,1,0]=3 18978 B18R2.8976 Fc1ccc(cc1Cl)CSCc2ccccc2 62a_100000717365_100015291786 [0,2,0,0,0,0|0,1,0]=3 18979 B18R2.8976 Fc1ccc(cc1Cl)CSCc2ccccn2 62a_100000717365_100000721315 [0,2,0,0,0,0|1,1,0]=4 18980 B18R2.8976 Fc1ccc(cc1Cl)CSCc2ccccn2 62a_100000721315_100011934319 [0,2,0,0,0,0|1,1,0]=4 18981 B18R2.8976 Fc1ccc(cc1Cl)CSCc2cccnc2 62a_100000717365_100000741622 [0,2,0,0,0,0|1,1,0]=4 18982 B18R2.8976 Fc1ccc(cc1Cl)CSCc2cccnc2 62a_100000741622_100011934319 [0,2,0,0,0,0|1,1,0]=4 18983 B18R2.8976 Fc1ccc(cc1Cl)CSCc2ccncc2 62a_100000717365_100015193705 [0,2,0,0,0,0|1,1,0]=4 18984 B18R2.8976 Fc1ccc(cc1Cl)CSCc2ccncc2 62a_100015193705_100011934319 [0,2,0,0,0,0|1,1,0]=4 18985 B18R2.8976 Fc1ccc(cc1Cl)NCCc2ccccc2 2230a_100000211060_100000765856 [0,2,0,0,0,0|2,0,0]=4 18986 B18R2.8976 Fc1ccc(cc1Cl)NCCc2ccccc2 34a_100000211060_100000765856 [0,2,0,0,0,0|2,0,0]=4 18987 B18R2.8976 Fc1ccc(cc1Cl)NCCc2ccccc2 7a_100000211060_100000765856 [0,2,0,0,0,0|2,0,0]=4 18988 B18R2.8976 Fc1ccc(cc1Cl)OCCc2ccccc2 34a_100000211030_100000765856 [0,2,0,0,0,0|2,0,0]=4 18989 B18R2.8976 Fc1ccc(cc1Cl)OCCc2ccccc2 7a_100000211030_100000765856 [0,2,0,0,0,0|2,0,0]=4 18990 B18R2.8976 Fc1ccc(cc1Cl)SCCc2ccccc2 62a_100000765856_100011215976 [0,2,0,0,0,0|2,0,0]=4 18991 B18R2.8976 Fc1ccc(cc1Cl)SCCc2ccccc2 62a_100011215976_100011218657 [0,2,0,0,0,0|2,0,0]=4 18992 B18R2.8976 Fc1ccc(cc1F)C=CCc2ccccc2 271570a_200016263579_100000750028 [0,2,0,0,0,0|1,0,1]=4 18993 B18R2.8976 Fc1ccc(cc1F)CCNc2ccccc2 34a_100000106764_100000690553 [0,2,0,0,0,0|2,0,0]=4 18994 B18R2.8976 Fc1ccc(cc1F)CCOc2ccccc2 34a_100000210340_100000690553 [0,2,0,0,0,0|2,0,0]=4 18995 B18R2.8976 Fc1ccc(cc1F)CCOc2ccccc2 7a_100000210340_100000690553 [0,2,0,0,0,0|2,0,0]=4 18996 B18R2.8976 Fc1ccc(cc1F)CCSc2ccccc2 62a_100000690553_100000041952 [0,2,0,0,0,0|2,0,0]=4 18997 B18R2.8976 Fc1ccc(cc1F)CCSc2ccccc2 62a_100000719477_100000690553 [0,2,0,0,0,0|2,0,0]=4 18998 B18R2.8976 Fc1ccc(cc1F)CNCc2ccccc2 207a_100000737897_100015611070 [0,2,0,0,0,0|1,0,0]=3 18999 B18R2.8976 Fc1ccc(cc1F)CNCc2ccccc2 207a_100015324214_100000211062 [0,2,0,0,0,0|1,0,0]=3 19000 B18R2.8976 Fc1ccc(cc1F)CNCc2ccccc2 2230a_100000737897_100015291786 [0,2,0,0,0,0|1,0,0]=3 19001 B18R2.8976 Fc1ccc(cc1F)CNCc2ccccc2 2230a_100015324214_100000757363 [0,2,0,0,0,0|1,0,0]=3 19002 B18R2.8976 Fc1ccc(cc1F)CNCc2ccccc2 270004a_100000737897_100015611070 [0,2,0,0,0,0|1,0,0]=3 19003 B18R2.8976 Fc1ccc(cc1F)CNCc2ccccc2 270004a_100015324214_100000211062 [0,2,0,0,0,0|1,0,0]=3 19004 B18R2.8976 Fc1ccc(cc1F)CNCc2ccccc2 34a_100000737897_100015291786 [0,2,0,0,0,0|1,0,0]=3 19005 B18R2.8976 Fc1ccc(cc1F)CNCc2ccccc2 34a_100015324214_100000757363 [0,2,0,0,0,0|1,0,0]=3 19006 B18R2.8976 Fc1ccc(cc1F)CNCc2ccccn2 207a_100000737897_100000209966 [0,2,0,0,0,0|2,0,0]=4 19007 B18R2.8976 Fc1ccc(cc1F)CNCc2ccccn2 2230a_100000737897_100000721315 [0,2,0,0,0,0|2,0,0]=4 19008 B18R2.8976 Fc1ccc(cc1F)CNCc2ccccn2 270004a_100000210449_100000211062 [0,2,0,0,0,0|2,0,0]=4 19009 B18R2.8976 Fc1ccc(cc1F)CNCc2ccccn2 270004a_100000737897_100000209966 [0,2,0,0,0,0|2,0,0]=4 19010 B18R2.8976 Fc1ccc(cc1F)CNCc2ccccn2 34a_100000737897_100000721315 [0,2,0,0,0,0|2,0,0]=4 19011 B18R2.8976 Fc1ccc(cc1F)CNCc2cccnc2 207a_100000210453_100000211062 [0,2,0,0,0,0|2,0,0]=4 19012 B18R2.8976 Fc1ccc(cc1F)CNCc2cccnc2 207a_100000737897_100000209961 [0,2,0,0,0,0|2,0,0]=4 19013 B18R2.8976 Fc1ccc(cc1F)CNCc2cccnc2 2230a_100000737897_100000741622 [0,2,0,0,0,0|2,0,0]=4 19014 B18R2.8976 Fc1ccc(cc1F)CNCc2cccnc2 270004a_100000210453_100000211062 [0,2,0,0,0,0|2,0,0]=4 19015 B18R2.8976 Fc1ccc(cc1F)CNCc2cccnc2 270004a_100000737897_100000209961 [0,2,0,0,0,0|2,0,0]=4 19016 B18R2.8976 Fc1ccc(cc1F)CNCc2cccnc2 34a_100000737897_100000733263 [0,2,0,0,0,0|2,0,0]=4 19017 B18R2.8976 Fc1ccc(cc1F)CNCc2ccncc2 207a_100000737897_100000186114 [0,2,0,0,0,0|2,0,0]=4 19018 B18R2.8976 Fc1ccc(cc1F)CNCc2ccncc2 2230a_100000737897_100015193705 [0,2,0,0,0,0|2,0,0]=4 19019 B18R2.8976 Fc1ccc(cc1F)COCc2ccccc2 34a_100000210790_100000757363 [0,2,0,0,0,0|0,0,0]=2 19020 B18R2.8976 Fc1ccc(cc1F)COCc2ccccc2 34a_100011215442_100015291786 [0,2,0,0,0,0|0,0,0]=2 19021 B18R2.8976 Fc1ccc(cc1F)COCc2ccccc2 7a_100000210790_100000757363 [0,2,0,0,0,0|0,0,0]=2 19022 B18R2.8976 Fc1ccc(cc1F)COCc2ccccc2 7a_100011215442_100000211182 [0,2,0,0,0,0|0,0,0]=2 19023 B18R2.8976 Fc1ccc(cc1F)COCc2ccccn2 34a_100011215442_100000721315 [0,2,0,0,0,0|1,0,0]=3 19024 B18R2.8976 Fc1ccc(cc1F)COCc2ccccn2 7a_100011215442_100000721315 [0,2,0,0,0,0|1,0,0]=3 19025 B18R2.8976 Fc1ccc(cc1F)COCc2cccnc2 34a_100011215442_100000733263 [0,2,0,0,0,0|1,0,0]=3 19026 B18R2.8976 Fc1ccc(cc1F)COCc2cccnc2 7a_100011215442_100000741622 [0,2,0,0,0,0|1,0,0]=3 19027 B18R2.8976 Fc1ccc(cc1F)COCc2cccnn2 34a_100011215442_100016990269 [0,2,0,0,0,0|2,0,0]=4 19028 B18R2.8976 Fc1ccc(cc1F)COCc2cccnn2 7a_100011215442_100016990269 [0,2,0,0,0,0|2,0,0]=4 19029 B18R2.8976 Fc1ccc(cc1F)COCc2ccncc2 7a_100011215442_100015193705 [0,2,0,0,0,0|1,0,0]=3 19030 B18R2.8976 Fc1ccc(cc1F)COCc2cnccn2 34a_100011215442_100016995436 [0,2,0,0,0,0|2,0,0]=4 19031 B18R2.8976 Fc1ccc(cc1F)COCc2cnccn2 7a_100011215442_100016995436 [0,2,0,0,0,0|2,0,0]=4 19032 B18R2.8976 Fc1ccc(cc1F)COCc2cncnc2 34a_100011215442_100015196519 [0,2,0,0,0,0|2,0,0]=4 19033 B18R2.8976 Fc1ccc(cc1F)COCc2cncnc2 7a_100011215442_100015196519 [0,2,0,0,0,0|2,0,0]=4 19034 B18R2.8976 Fc1ccc(cc1F)COCc2ncccn2 34a_100011215442_100000703007 [0,2,0,0,0,0|2,0,0]=4 19035 B18R2.8976 Fc1ccc(cc1F)COCc2ncccn2 7a_100011215442_100000703007 [0,2,0,0,0,0|2,0,0]=4 19036 B18R2.8976 Fc1ccc(cc1F)CSCc2ccccc2 62a_100000211182_100000757363 [0,2,0,0,0,0|0,1,0]=3 19037 B18R2.8976 Fc1ccc(cc1F)CSCc2ccccc2 62a_100000757363_100015291786 [0,2,0,0,0,0|0,1,0]=3 19038 B18R2.8976 Fc1ccc(cc1F)CSCc2ccccn2 62a_100000721315_100000757363 [0,2,0,0,0,0|1,1,0]=4 19039 B18R2.8976 Fc1ccc(cc1F)CSCc2ccccn2 62a_100000757363_100000721315 [0,2,0,0,0,0|1,1,0]=4 19040 B18R2.8976 Fc1ccc(cc1F)CSCc2cccnc2 62a_100000741622_100000757363 [0,2,0,0,0,0|1,1,0]=4 19041 B18R2.8976 Fc1ccc(cc1F)CSCc2cccnc2 62a_100000757363_100000741622 [0,2,0,0,0,0|1,1,0]=4 19042 B18R2.8976 Fc1ccc(cc1F)CSCc2ccncc2 62a_100000757363_100015193705 [0,2,0,0,0,0|1,1,0]=4 19043 B18R2.8976 Fc1ccc(cc1F)CSCc2ccncc2 62a_100015193705_100000757363 [0,2,0,0,0,0|1,1,0]=4 19044 B18R2.8976 Fc1ccc(cc1F)NCCc2ccccc2 2230a_100000210724_100000765856 [0,2,0,0,0,0|2,0,0]=4 19045 B18R2.8976 Fc1ccc(cc1F)NCCc2ccccc2 34a_100000210724_100000765856 [0,2,0,0,0,0|2,0,0]=4 19046 B18R2.8976 Fc1ccc(cc1F)NCCc2ccccc2 7a_100000210724_100000765856 [0,2,0,0,0,0|2,0,0]=4 19047 B18R2.8976 Fc1ccc(cc1F)OCCc2ccccc2 34a_100000181275_100000765856 [0,2,0,0,0,0|2,0,0]=4 19048 B18R2.8976 Fc1ccc(cc1F)OCCc2ccccc2 7a_100000181275_100000765856 [0,2,0,0,0,0|2,0,0]=4 19049 B18R2.8976 Fc1ccc(cc1F)SCCc2ccccc2 62a_100000703953_100011218657 [0,2,0,0,0,0|2,0,0]=4 19050 B18R2.8976 Fc1ccc(cc1F)SCCc2ccccc2 62a_100000765856_100000703953 [0,2,0,0,0,0|2,0,0]=4 19051 B18R2.8976 Fc1ccc(cc1I)CNCc2ccccc2 207a_100015324214_100010188209 [0,2,0,0,0,0|1,0,0]=3 19052 B18R2.8976 Fc1ccc(cc1I)CNCc2ccccc2 2230a_100015324214_100010188208 [0,2,0,0,0,0|1,0,0]=3 19053 B18R2.8976 Fc1ccc(cc1I)CNCc2ccccc2 270004a_100015324214_100010188209 [0,2,0,0,0,0|1,0,0]=3 19054 B18R2.8976 Fc1ccc(cc1I)CNCc2ccccc2 34a_100015324214_100010188208 [0,2,0,0,0,0|1,0,0]=3 19055 B18R2.8976 Fc1ccc(cc1I)CNCc2ccccn2 270004a_100000210449_100010188209 [0,2,0,0,0,0|2,0,0]=4 19056 B18R2.8976 Fc1ccc(cc1I)CNCc2cccnc2 207a_100000210453_100010188209 [0,2,0,0,0,0|2,0,0]=4 19057 B18R2.8976 Fc1ccc(cc1I)CNCc2cccnc2 270004a_100000210453_100010188209 [0,2,0,0,0,0|2,0,0]=4 19058 B18R2.8976 Fc1ccc(cc1I)COCc2ccccc2 34a_100000049585_100015291786 [0,2,0,0,0,0|0,0,0]=2 19059 B18R2.8976 Fc1ccc(cc1I)COCc2ccccc2 34a_100000210790_100010188208 [0,2,0,0,0,0|0,0,0]=2 19060 B18R2.8976 Fc1ccc(cc1I)COCc2ccccc2 7a_100000049585_100000211182 [0,2,0,0,0,0|0,0,0]=2 19061 B18R2.8976 Fc1ccc(cc1I)COCc2ccccc2 7a_100000210790_100010188208 [0,2,0,0,0,0|0,0,0]=2 19062 B18R2.8976 Fc1ccc(cc1I)COCc2ccccn2 34a_100000049585_100000721315 [0,2,0,0,0,0|1,0,0]=3 19063 B18R2.8976 Fc1ccc(cc1I)COCc2ccccn2 7a_100000049585_100000721315 [0,2,0,0,0,0|1,0,0]=3 19064 B18R2.8976 Fc1ccc(cc1I)COCc2cccnc2 34a_100000049585_100000733263 [0,2,0,0,0,0|1,0,0]=3 19065 B18R2.8976 Fc1ccc(cc1I)COCc2cccnc2 7a_100000049585_100000741622 [0,2,0,0,0,0|1,0,0]=3 19066 B18R2.8976 Fc1ccc(cc1I)COCc2cccnn2 34a_100000049585_100016990269 [0,2,0,0,0,0|2,0,0]=4 19067 B18R2.8976 Fc1ccc(cc1I)COCc2cccnn2 7a_100000049585_100016990269 [0,2,0,0,0,0|2,0,0]=4 19068 B18R2.8976 Fc1ccc(cc1I)COCc2ccncc2 7a_100000049585_100015193705 [0,2,0,0,0,0|1,0,0]=3 19069 B18R2.8976 Fc1ccc(cc1I)COCc2cnccn2 34a_100000049585_100016995436 [0,2,0,0,0,0|2,0,0]=4 19070 B18R2.8976 Fc1ccc(cc1I)COCc2cnccn2 7a_100000049585_100016995436 [0,2,0,0,0,0|2,0,0]=4 19071 B18R2.8976 Fc1ccc(cc1I)COCc2cncnc2 34a_100000049585_100015196519 [0,2,0,0,0,0|2,0,0]=4 19072 B18R2.8976 Fc1ccc(cc1I)COCc2cncnc2 7a_100000049585_100015196519 [0,2,0,0,0,0|2,0,0]=4 19073 B18R2.8976 Fc1ccc(cc1I)COCc2ncccn2 34a_100000049585_100000703007 [0,2,0,0,0,0|2,0,0]=4 19074 B18R2.8976 Fc1ccc(cc1I)COCc2ncccn2 7a_100000049585_100000703007 [0,2,0,0,0,0|2,0,0]=4 19075 B18R2.8976 Fc1ccc(cc1I)CSCc2ccccc2 62a_100000211182_100010188208 [0,2,0,0,0,0|0,1,0]=3 19076 B18R2.8976 Fc1ccc(cc1I)CSCc2ccccc2 62a_100010188208_100015291786 [0,2,0,0,0,0|0,1,0]=3 19077 B18R2.8976 Fc1ccc(cc1I)CSCc2ccccn2 62a_100000721315_100010188208 [0,2,0,0,0,0|1,1,0]=4 19078 B18R2.8976 Fc1ccc(cc1I)CSCc2ccccn2 62a_100010188208_100000721315 [0,2,0,0,0,0|1,1,0]=4 19079 B18R2.8976 Fc1ccc(cc1I)CSCc2cccnc2 62a_100000741622_100010188208 [0,2,0,0,0,0|1,1,0]=4 19080 B18R2.8976 Fc1ccc(cc1I)CSCc2cccnc2 62a_100010188208_100000741622 [0,2,0,0,0,0|1,1,0]=4 19081 B18R2.8976 Fc1ccc(cc1I)CSCc2ccncc2 62a_100010188208_100015193705 [0,2,0,0,0,0|1,1,0]=4 19082 B18R2.8976 Fc1ccc(cc1I)CSCc2ccncc2 62a_100015193705_100010188208 [0,2,0,0,0,0|1,1,0]=4 19083 B18R2.8976 Fc1ccc(cc1I)NCCc2ccccc2 34a_114828291077_100000765856 [0,2,0,0,0,0|2,0,0]=4 19084 B18R2.8976 Fc1ccc(cc1I)NCCc2ccccc2 7a_114828291077_100000765856 [0,2,0,0,0,0|2,0,0]=4 19085 B18R2.8976 Fc1ncc(cc1Br)CNCc2ccccc2 2230a_100015324214_200010066439 [0,2,0,0,0,0|2,0,0]=4 19086 B18R2.8976 Fc1ncc(cc1Br)CNCc2ccccc2 34a_100015324214_200010066439 [0,2,0,0,0,0|2,0,0]=4 19087 B18R2.8976 Fc1ncc(cc1Br)COCc2ccccc2 34a_100000210790_200010066439 [0,2,0,0,0,0|1,0,0]=3 19088 B18R2.8976 Fc1ncc(cc1Br)COCc2ccccc2 7a_100000210790_200010066439 [0,2,0,0,0,0|1,0,0]=3 19089 B18R2.8976 Fc1ncc(cc1Br)CSCc2ccccc2 62a_100000211182_200010066439 [0,2,0,0,0,0|1,1,0]=4 19090 B18R2.8976 Fc1ncc(cc1Br)CSCc2ccccc2 62a_200010066439_100015291786 [0,2,0,0,0,0|1,1,0]=4 19091 B18R2.8976 Nc1cc(ccc1Br)C=CCc2ccccc2 271570a_200016263579_100000750456 [0,2,0,0,0,0|1,0,1]=4 19092 B18R2.8976 Nc1cc(ccc1Br)COCc2ccccc2 34a_100012347568_100015291786 [0,2,0,0,0,0|0,0,0]=2 19093 B18R2.8976 Nc1cc(ccc1Br)COCc2ccccn2 34a_100012347568_100000721315 [0,2,0,0,0,0|1,0,0]=3 19094 B18R2.8976 Nc1cc(ccc1Br)COCc2cccnc2 34a_100012347568_100000733263 [0,2,0,0,0,0|1,0,0]=3 19095 B18R2.8976 Nc1cc(ccc1Br)COCc2cccnn2 34a_100012347568_100016990269 [0,2,0,0,0,0|2,0,0]=4 19096 B18R2.8976 Nc1cc(ccc1Br)COCc2cnccn2 34a_100012347568_100016995436 [0,2,0,0,0,0|2,0,0]=4 19097 B18R2.8976 Nc1cc(ccc1Br)COCc2cncnc2 34a_100012347568_100015196519 [0,2,0,0,0,0|2,0,0]=4 19098 B18R2.8976 Nc1cc(ccc1Br)COCc2ncccn2 34a_100012347568_100000703007 [0,2,0,0,0,0|2,0,0]=4 19099 B18R2.8976 Nc1cc(ccc1Br)OCCc2ccccc2 34a_100011999798_100000765856 [0,2,0,0,0,0|2,0,0]=4 19100 B18R2.8976 Nc1cc(ccc1Br)OCCc2ccccc2 7a_100011999798_100000765856 [0,2,0,0,0,0|2,0,0]=4 19101 B18R2.8976 Nc1cc(ccc1Br)SCCc2ccccc2 62a_100000750456_100011218657 [0,2,0,0,0,0|2,0,0]=4 19102 B18R2.8976 Nc1cc(ccc1Br)SCCc2ccccc2 62a_100000765856_100000750456 [0,2,0,0,0,0|2,0,0]=4 19103 B18R2.8976 Nc1cc(ccc1Cl)C=CCc2ccccc2 271570a_200016263579_200000761891 [0,2,0,0,0,0|1,0,1]=4 19104 B18R2.8976 Nc1cc(ccc1Cl)COCc2ccccc2 34a_106256033963_100015291786 [0,2,0,0,0,0|0,0,0]=2 19105 B18R2.8976 Nc1cc(ccc1Cl)COCc2ccccn2 34a_106256033963_100000721315 [0,2,0,0,0,0|1,0,0]=3 19106 B18R2.8976 Nc1cc(ccc1Cl)COCc2cccnc2 34a_106256033963_100000733263 [0,2,0,0,0,0|1,0,0]=3 19107 B18R2.8976 Nc1cc(ccc1Cl)COCc2cccnn2 34a_106256033963_100016990269 [0,2,0,0,0,0|2,0,0]=4 19108 B18R2.8976 Nc1cc(ccc1Cl)COCc2cnccn2 34a_106256033963_100016995436 [0,2,0,0,0,0|2,0,0]=4 19109 B18R2.8976 Nc1cc(ccc1Cl)COCc2cncnc2 34a_106256033963_100015196519 [0,2,0,0,0,0|2,0,0]=4 19110 B18R2.8976 Nc1cc(ccc1Cl)COCc2ncccn2 34a_106256033963_100000703007 [0,2,0,0,0,0|2,0,0]=4 19111 B18R2.8976 Nc1cc(ccc1Cl)OCCc2ccccc2 34a_100011934297_100000765856 [0,2,0,0,0,0|2,0,0]=4 19112 B18R2.8976 Nc1cc(ccc1Cl)SCCc2ccccc2 62a_100000765856_200000761891 [0,2,0,0,0,0|2,0,0]=4 19113 B18R2.8976 Nc1cc(ccc1Cl)SCCc2ccccc2 62a_200000761891_100011218657 [0,2,0,0,0,0|2,0,0]=4 19114 B18R2.8976 Nc1cc(ccc1F)C=CCc2ccccc2 271570a_200016263579_100000740924 [0,2,0,0,0,0|1,0,1]=4 19115 B18R2.8976 Nc1cc(ccc1F)COCc2ccccc2 34a_102125399562_100015291786 [0,2,0,0,0,0|0,0,0]=2 19116 B18R2.8976 Nc1cc(ccc1F)COCc2ccccn2 34a_102125399562_100000721315 [0,2,0,0,0,0|1,0,0]=3 19117 B18R2.8976 Nc1cc(ccc1F)COCc2cccnc2 34a_102125399562_100000733263 [0,2,0,0,0,0|1,0,0]=3 19118 B18R2.8976 Nc1cc(ccc1F)COCc2cccnn2 34a_102125399562_100016990269 [0,2,0,0,0,0|2,0,0]=4 19119 B18R2.8976 Nc1cc(ccc1F)COCc2cnccn2 34a_102125399562_100016995436 [0,2,0,0,0,0|2,0,0]=4 19120 B18R2.8976 Nc1cc(ccc1F)COCc2cncnc2 34a_102125399562_100015196519 [0,2,0,0,0,0|2,0,0]=4 19121 B18R2.8976 Nc1cc(ccc1F)COCc2ncccn2 34a_102125399562_100000703007 [0,2,0,0,0,0|2,0,0]=4 19122 B18R2.8976 Nc1cc(ccc1F)OCCc2ccccc2 34a_100012017239_100000765856 [0,2,0,0,0,0|2,0,0]=4 19123 B18R2.8976 Nc1cc(ccc1F)OCCc2ccccc2 7a_100012017239_100000765856 [0,2,0,0,0,0|2,0,0]=4 19124 B18R2.8976 Nc1cc(ccc1F)SCCc2ccccc2 62a_100000740924_100011218657 [0,2,0,0,0,0|2,0,0]=4 19125 B18R2.8976 Nc1cc(ccc1F)SCCc2ccccc2 62a_100000765856_100000740924 [0,2,0,0,0,0|2,0,0]=4 19126 B18R2.8976 Nc1cc(ccc1O)C=CCc2ccccc2 271570a_200016263579_100000752626 [0,2,0,0,0,0|1,0,1]=4 19127 B18R2.8976 Nc1cc(ccc1O)SCCc2ccccc2 62a_100000752626_100011218657 [0,2,0,0,0,0|2,0,0]=4 19128 B18R2.8976 Nc1cc(ccc1O)SCCc2ccccc2 62a_100000765856_100000752626 [0,2,0,0,0,0|2,0,0]=4 19129 B18R2.8976 Nc1ccc(cc1Br)C=CCc2ccccc2 271570a_200016263579_100000750455 [0,2,0,0,0,0|1,0,1]=4 19130 B18R2.8976 Nc1ccc(cc1Br)OCCc2ccccc2 34a_100012001276_100000765856 [0,2,0,0,0,0|2,0,0]=4 19131 B18R2.8976 Nc1ccc(cc1Br)OCCc2ccccc2 7a_100012001276_100000765856 [0,2,0,0,0,0|2,0,0]=4 19132 B18R2.8976 Nc1ccc(cc1Br)SCCc2ccccc2 62a_100000750455_100011218657 [0,2,0,0,0,0|2,0,0]=4 19133 B18R2.8976 Nc1ccc(cc1Br)SCCc2ccccc2 62a_100000765856_100000750455 [0,2,0,0,0,0|2,0,0]=4 19134 B18R2.8976 Nc1ccc(cc1Cl)C=CCc2ccccc2 271570a_200016263579_100011218065 [0,2,0,0,0,0|1,0,1]=4 19135 B18R2.8976 Nc1ccc(cc1Cl)OCCc2ccccc2 34a_100011215599_100000765856 [0,2,0,0,0,0|2,0,0]=4 19136 B18R2.8976 Nc1ccc(cc1Cl)OCCc2ccccc2 7a_100011215599_100000765856 [0,2,0,0,0,0|2,0,0]=4 19137 B18R2.8976 Nc1ccc(cc1Cl)SCCc2ccccc2 62a_100000765856_100011218065 [0,2,0,0,0,0|2,0,0]=4 19138 B18R2.8976 Nc1ccc(cc1Cl)SCCc2ccccc2 62a_100011218065_100011218657 [0,2,0,0,0,0|2,0,0]=4 19139 B18R2.8976 Nc1ccc(cc1F)C=CCc2ccccc2 271570a_200016263579_100011215594 [0,2,0,0,0,0|1,0,1]=4 19140 B18R2.8976 Nc1ccc(cc1F)COCc2ccccc2 34a_100011217239_100015291786 [0,2,0,0,0,0|0,0,0]=2 19141 B18R2.8976 Nc1ccc(cc1F)COCc2ccccn2 34a_100011217239_100000721315 [0,2,0,0,0,0|1,0,0]=3 19142 B18R2.8976 Nc1ccc(cc1F)COCc2cccnc2 34a_100011217239_100000733263 [0,2,0,0,0,0|1,0,0]=3 19143 B18R2.8976 Nc1ccc(cc1F)COCc2cccnn2 34a_100011217239_100016990269 [0,2,0,0,0,0|2,0,0]=4 19144 B18R2.8976 Nc1ccc(cc1F)COCc2cnccn2 34a_100011217239_100016995436 [0,2,0,0,0,0|2,0,0]=4 19145 B18R2.8976 Nc1ccc(cc1F)COCc2cncnc2 34a_100011217239_100015196519 [0,2,0,0,0,0|2,0,0]=4 19146 B18R2.8976 Nc1ccc(cc1F)COCc2ncccn2 34a_100011217239_100000703007 [0,2,0,0,0,0|2,0,0]=4 19147 B18R2.8976 Nc1ccc(cc1F)OCCc2ccccc2 34a_100000759473_100000765856 [0,2,0,0,0,0|2,0,0]=4 19148 B18R2.8976 Nc1ccc(cc1F)OCCc2ccccc2 7a_100000759473_100000765856 [0,2,0,0,0,0|2,0,0]=4 19149 B18R2.8976 Nc1ccc(cc1F)SCCc2ccccc2 62a_100000765856_100011215594 [0,2,0,0,0,0|2,0,0]=4 19150 B18R2.8976 Nc1ccc(cc1F)SCCc2ccccc2 62a_100011215594_100011218657 [0,2,0,0,0,0|2,0,0]=4 19151 B18R2.8976 Nc1ccc(cc1I)OCCc2ccccc2 34a_100010084370_100000765856 [0,2,0,0,0,0|2,0,0]=4 19152 B18R2.8976 Nc1ccc(cc1I)OCCc2ccccc2 7a_100010084370_100000765856 [0,2,0,0,0,0|2,0,0]=4 19153 B18R2.8976 Nc1ccc(cc1N)C=CCc2ccccc2 271570a_200016263579_100000741789 [0,2,0,0,0,0|1,0,1]=4 19154 B18R2.8976 Nc1ccc(cc1N)OCCc2ccccc2 34a_100025771000_100000765856 [0,2,0,0,0,0|2,0,0]=4 19155 B18R2.8976 Nc1ccc(cc1N)SCCc2ccccc2 62a_100000741789_100011218657 [0,2,0,0,0,0|2,0,0]=4 19156 B18R2.8976 Nc1ccc(cc1N)SCCc2ccccc2 62a_100000765856_100011534411 [0,2,0,0,0,0|2,0,0]=4 19157 B18R2.8976 Nc1ccc(cc1O)C=CCc2ccccc2 271570a_200016263579_100000739049 [0,2,0,0,0,0|1,0,1]=4 19158 B18R2.8976 Nc1ccc(cc1O)SCCc2ccccc2 62a_100000739049_100011218657 [0,2,0,0,0,0|2,0,0]=4 19159 B18R2.8976 Nc1ccc(cc1O)SCCc2ccccc2 62a_100000765856_100000739049 [0,2,0,0,0,0|2,0,0]=4 19160 B18R2.8976 Nc1ncc(cc1Br)COCc2ccccc2 34a_100012343677_100015291786 [0,2,0,0,0,0|1,0,0]=3 19161 B18R2.8976 Nc1ncc(cc1Br)COCc2ccccc2 7a_100012343677_100000211182 [0,2,0,0,0,0|1,0,0]=3 19162 B18R2.8976 Nc1ncc(cc1Br)COCc2ccccn2 34a_100012343677_100000721315 [0,2,0,0,0,0|2,0,0]=4 19163 B18R2.8976 Nc1ncc(cc1Br)COCc2ccccn2 7a_100012343677_100000721315 [0,2,0,0,0,0|2,0,0]=4 19164 B18R2.8976 Nc1ncc(cc1Br)COCc2cccnc2 34a_100012343677_100000733263 [0,2,0,0,0,0|2,0,0]=4 19165 B18R2.8976 Nc1ncc(cc1Br)COCc2cccnc2 7a_100012343677_100000741622 [0,2,0,0,0,0|2,0,0]=4 19166 B18R2.8976 Nc1ncc(cc1Br)COCc2ccncc2 7a_100012343677_100015193705 [0,2,0,0,0,0|2,0,0]=4 19167 B18R2.8976 O=c1[nH]cc(cc1Cl)CNCc2ccccc2 207a_100015324214_100000051075 [0,2,0,0,0,0|2,0,0]=4 19168 B18R2.8976 O=c1[nH]cc(cc1Cl)CNCc2ccccc2 270004a_100015324214_100000051075 [0,2,0,0,0,0|2,0,0]=4 19169 B18R2.8976 O=c1cc(occ1O)CNCc2ccccc2 2230a_100015324214_100000010605 [0,2,0,0,0,0|2,0,0]=4 19170 B18R2.8976 O=c1cc(occ1O)COCc2ccccc2 7a_100000210790_100000010605 [0,2,0,0,0,0|1,0,0]=3 19171 B18R2.8976 O=c1cc(occ1O)CSCc2ccccc2 62a_100000211182_100000010605 [0,2,0,0,0,0|1,1,0]=4 19172 B18R2.8976 Oc1cc(ccc1Br)C=CCc2ccccc2 271570a_200016263579_100012356990 [0,2,0,0,0,0|1,0,1]=4 19173 B18R2.8976 Oc1cc(ccc1Br)SCCc2ccccc2 62a_100000765856_100012356990 [0,2,0,0,0,0|2,0,0]=4 19174 B18R2.8976 Oc1cc(ccc1Br)SCCc2ccccc2 62a_100012356990_100011218657 [0,2,0,0,0,0|2,0,0]=4 19175 B18R2.8976 Oc1cc(ccc1Cl)C=CCc2ccccc2 271570a_200016263579_100011356854 [0,2,0,0,0,0|1,0,1]=4 19176 B18R2.8976 Oc1cc(ccc1Cl)CNCc2ccccc2 34a_100020636435_100015291786 [0,2,0,0,0,0|1,0,0]=3 19177 B18R2.8976 Oc1cc(ccc1Cl)CNCc2ccccn2 34a_100020636435_100000721315 [0,2,0,0,0,0|2,0,0]=4 19178 B18R2.8976 Oc1cc(ccc1Cl)CNCc2cccnc2 34a_100020636435_100000733263 [0,2,0,0,0,0|2,0,0]=4 19179 B18R2.8976 Oc1cc(ccc1Cl)NCCc2ccccc2 34a_100011934209_100000765856 [0,2,0,0,0,0|2,0,0]=4 19180 B18R2.8976 Oc1cc(ccc1Cl)SCCc2ccccc2 62a_100000765856_100011356854 [0,2,0,0,0,0|2,0,0]=4 19181 B18R2.8976 Oc1cc(ccc1Cl)SCCc2ccccc2 62a_100011356854_100011218657 [0,2,0,0,0,0|2,0,0]=4 19182 B18R2.8976 Oc1cc(ccc1F)C=CCc2ccccc2 271570a_200016263579_100000686035 [0,2,0,0,0,0|1,0,1]=4 19183 B18R2.8976 Oc1cc(ccc1F)CNCc2ccccc2 207a_100160469508_100015611070 [0,2,0,0,0,0|1,0,0]=3 19184 B18R2.8976 Oc1cc(ccc1F)CNCc2ccccc2 270004a_100160469508_100015611070 [0,2,0,0,0,0|1,0,0]=3 19185 B18R2.8976 Oc1cc(ccc1F)CNCc2ccccc2 34a_100160469508_100015291786 [0,2,0,0,0,0|1,0,0]=3 19186 B18R2.8976 Oc1cc(ccc1F)CNCc2ccccn2 207a_100160469508_100000209966 [0,2,0,0,0,0|2,0,0]=4 19187 B18R2.8976 Oc1cc(ccc1F)CNCc2ccccn2 270004a_100160469508_100000209966 [0,2,0,0,0,0|2,0,0]=4 19188 B18R2.8976 Oc1cc(ccc1F)CNCc2ccccn2 34a_100160469508_100000721315 [0,2,0,0,0,0|2,0,0]=4 19189 B18R2.8976 Oc1cc(ccc1F)CNCc2cccnc2 207a_100160469508_100000209961 [0,2,0,0,0,0|2,0,0]=4 19190 B18R2.8976 Oc1cc(ccc1F)CNCc2cccnc2 270004a_100160469508_100000209961 [0,2,0,0,0,0|2,0,0]=4 19191 B18R2.8976 Oc1cc(ccc1F)CNCc2cccnc2 34a_100160469508_100000733263 [0,2,0,0,0,0|2,0,0]=4 19192 B18R2.8976 Oc1cc(ccc1F)CNCc2ccncc2 207a_100160469508_100000186114 [0,2,0,0,0,0|2,0,0]=4 19193 B18R2.8976 Oc1cc(ccc1F)NCCc2ccccc2 34a_100012017398_100000765856 [0,2,0,0,0,0|2,0,0]=4 19194 B18R2.8976 Oc1cc(ccc1F)NCCc2ccccc2 7a_100012017398_100000765856 [0,2,0,0,0,0|2,0,0]=4 19195 B18R2.8976 Oc1cc(ccc1F)SCCc2ccccc2 62a_100000686035_100011218657 [0,2,0,0,0,0|2,0,0]=4 19196 B18R2.8976 Oc1cc(ccc1F)SCCc2ccccc2 62a_100000765856_100000686035 [0,2,0,0,0,0|2,0,0]=4 19197 B18R2.8976 Oc1ccc(cc1Br)C=CCc2ccccc2 271570a_200016263579_100012361655 [0,2,0,0,0,0|1,0,1]=4 19198 B18R2.8976 Oc1ccc(cc1Br)NCCc2ccccc2 34a_100011534360_100000765856 [0,2,0,0,0,0|2,0,0]=4 19199 B18R2.8976 Oc1ccc(cc1Br)SCCc2ccccc2 62a_100000765856_100012361655 [0,2,0,0,0,0|2,0,0]=4 19200 B18R2.8976 Oc1ccc(cc1Br)SCCc2ccccc2 62a_100012361655_100011218657 [0,2,0,0,0,0|2,0,0]=4 19201 B18R2.8976 Oc1ccc(cc1Cl)C=CCc2ccccc2 271570a_200016263579_100012360047 [0,2,0,0,0,0|1,0,1]=4 19202 B18R2.8976 Oc1ccc(cc1Cl)NCCc2ccccc2 34a_100000744943_100000765856 [0,2,0,0,0,0|2,0,0]=4 19203 B18R2.8976 Oc1ccc(cc1Cl)SCCc2ccccc2 62a_100000765856_100012360047 [0,2,0,0,0,0|2,0,0]=4 19204 B18R2.8976 Oc1ccc(cc1Cl)SCCc2ccccc2 62a_100012360047_100011218657 [0,2,0,0,0,0|2,0,0]=4 19205 B18R2.8976 Oc1ccc(cc1F)C=CCc2ccccc2 271570a_200016263579_100000185481 [0,2,0,0,0,0|1,0,1]=4 19206 B18R2.8976 Oc1ccc(cc1F)CNCc2ccccc2 270004a_100000758358_100015611070 [0,2,0,0,0,0|1,0,0]=3 19207 B18R2.8976 Oc1ccc(cc1F)CNCc2ccccc2 34a_100000758358_100015291786 [0,2,0,0,0,0|1,0,0]=3 19208 B18R2.8976 Oc1ccc(cc1F)CNCc2ccccn2 270004a_100000758358_100000209966 [0,2,0,0,0,0|2,0,0]=4 19209 B18R2.8976 Oc1ccc(cc1F)CNCc2ccccn2 34a_100000758358_100000721315 [0,2,0,0,0,0|2,0,0]=4 19210 B18R2.8976 Oc1ccc(cc1F)CNCc2cccnc2 270004a_100000758358_100000209961 [0,2,0,0,0,0|2,0,0]=4 19211 B18R2.8976 Oc1ccc(cc1F)CNCc2cccnc2 34a_100000758358_100000733263 [0,2,0,0,0,0|2,0,0]=4 19212 B18R2.8976 Oc1ccc(cc1F)NCCc2ccccc2 34a_100011220035_100000765856 [0,2,0,0,0,0|2,0,0]=4 19213 B18R2.8976 Oc1ccc(cc1F)NCCc2ccccc2 7a_100011220035_100000765856 [0,2,0,0,0,0|2,0,0]=4 19214 B18R2.8976 Oc1ccc(cc1F)SCCc2ccccc2 62a_100000185481_100011218657 [0,2,0,0,0,0|2,0,0]=4 19215 B18R2.8976 Oc1ccc(cc1F)SCCc2ccccc2 62a_100000765856_100000185481 [0,2,0,0,0,0|2,0,0]=4 19216 B18R2.8976 Oc1ccc(cc1O)C=CCc2ccccc2 271570a_200016263579_100009813601 [0,2,0,0,0,0|1,0,1]=4 19217 B18R2.8976 Oc1ccc(cc1O)CCOc2ccccc2 7a_100000210340_200010393615 [0,2,0,0,0,0|2,0,0]=4 19218 B18R2.8976 Oc1ccc(cc1O)CCSc2ccccc2 62a_100000719477_200010393615 [0,2,0,0,0,0|2,0,0]=4 19219 B18R2.8976 Oc1ccc(cc1O)CNCc2ccccc2 34a_100000010075_100015291786 [0,2,0,0,0,0|1,0,0]=3 19220 B18R2.8976 Oc1ccc(cc1O)CNCc2ccccn2 34a_100000010075_100000721315 [0,2,0,0,0,0|2,0,0]=4 19221 B18R2.8976 Oc1ccc(cc1O)CNCc2cccnc2 34a_100000010075_100000733263 [0,2,0,0,0,0|2,0,0]=4 19222 B18R2.8976 Oc1ccc(cc1O)NCCc2ccccc2 34a_100102946323_100000765856 [0,2,0,0,0,0|2,0,0]=4 19223 B18R2.8976 Oc1ccc(cc1O)SCCc2ccccc2 62a_100000765856_100009813601 [0,2,0,0,0,0|2,0,0]=4 19224 B18R2.8976 Oc1ncc(cc1Br)CNCc2ccccc2 207a_100015324214_100010064886 [0,2,0,0,0,0|2,0,0]=4 19225 B18R2.8976 Oc1ncc(cc1Br)CNCc2ccccc2 270004a_100015324214_100010064886 [0,2,0,0,0,0|2,0,0]=4 19226 B18R2.9237 Brc1ccc(cc1)CCNc2ccccc2Br 34a_100000210017_100011740612 [0,2,0,0,0,0|2,0,0]=4 19227 B18R2.9237 Brc1ccc(cc1)CCNc2ccccc2I 34a_100000210053_100011740612 [0,2,0,0,0,0|2,0,0]=4 19228 B18R2.9237 Brc1ccc(cc1)CCOc2ccccc2Br 34a_100000181306_100011740612 [0,2,0,0,0,0|2,0,0]=4 19229 B18R2.9237 Brc1ccc(cc1)CCOc2ccccc2Br 7a_100000181306_100011740612 [0,2,0,0,0,0|2,0,0]=4 19230 B18R2.9237 Brc1ccc(cc1)CCOc2ccccc2I 34a_100000739446_100011740612 [0,2,0,0,0,0|2,0,0]=4 19231 B18R2.9237 Brc1ccc(cc1)CCOc2ccccc2I 7a_100000739446_100011740612 [0,2,0,0,0,0|2,0,0]=4 19232 B18R2.9237 Brc1ccc(cc1)CCSc2ccccc2Br 62a_100000695589_100011740612 [0,2,0,0,0,0|2,0,0]=4 19233 B18R2.9237 Brc1ccc(cc1)CCSc2ccccc2Br 62a_100011740612_100000695589 [0,2,0,0,0,0|2,0,0]=4 19234 B18R2.9237 Brc1ccc(cc1)CNCc2ccccc2Br 207a_100000174875_100000211189 [0,2,0,0,0,0|1,0,0]=3 19235 B18R2.9237 Brc1ccc(cc1)CNCc2ccccc2Br 207a_100000689332_100000186029 [0,2,0,0,0,0|1,0,0]=3 19236 B18R2.9237 Brc1ccc(cc1)CNCc2ccccc2Br 2230a_100000174875_100000184730 [0,2,0,0,0,0|1,0,0]=3 19237 B18R2.9237 Brc1ccc(cc1)CNCc2ccccc2Br 2230a_100000689332_100011217064 [0,2,0,0,0,0|1,0,0]=3 19238 B18R2.9237 Brc1ccc(cc1)CNCc2ccccc2Br 26a_100000174875_100000181306 [0,2,0,0,0,0|1,0,0]=3 19239 B18R2.9237 Brc1ccc(cc1)CNCc2ccccc2Br 26a_100000689332_100000185759 [0,2,0,0,0,0|1,0,0]=3 19240 B18R2.9237 Brc1ccc(cc1)CNCc2ccccc2Br 270004a_100000174875_100000211189 [0,2,0,0,0,0|1,0,0]=3 19241 B18R2.9237 Brc1ccc(cc1)CNCc2ccccc2Br 270004a_100000689332_100000186029 [0,2,0,0,0,0|1,0,0]=3 19242 B18R2.9237 Brc1ccc(cc1)CNCc2ccccc2Br 34a_100000174875_100000184730 [0,2,0,0,0,0|1,0,0]=3 19243 B18R2.9237 Brc1ccc(cc1)CNCc2ccccc2Br 34a_100000689332_100000189115 [0,2,0,0,0,0|1,0,0]=3 19244 B18R2.9237 Brc1ccc(cc1)CNCc2ccccc2I 207a_100000174875_100000010305 [0,2,0,0,0,0|1,0,0]=3 19245 B18R2.9237 Brc1ccc(cc1)CNCc2ccccc2I 207a_100015347259_100000186029 [0,2,0,0,0,0|1,0,0]=3 19246 B18R2.9237 Brc1ccc(cc1)CNCc2ccccc2I 2230a_100000174875_100011215278 [0,2,0,0,0,0|1,0,0]=3 19247 B18R2.9237 Brc1ccc(cc1)CNCc2ccccc2I 270004a_100000174875_100000010305 [0,2,0,0,0,0|1,0,0]=3 19248 B18R2.9237 Brc1ccc(cc1)CNCc2ccccc2I 270004a_100015347259_100000186029 [0,2,0,0,0,0|1,0,0]=3 19249 B18R2.9237 Brc1ccc(cc1)CNCc2ccccc2I 34a_100000174875_100011215278 [0,2,0,0,0,0|1,0,0]=3 19250 B18R2.9237 Brc1ccc(cc1)CNCc2cccnc2Br 2230a_100000174875_100010140945 [0,2,0,0,0,0|2,0,0]=4 19251 B18R2.9237 Brc1ccc(cc1)CNCc2cccnc2Br 2230a_100009818023_100011217064 [0,2,0,0,0,0|2,0,0]=4 19252 B18R2.9237 Brc1ccc(cc1)CNCc2cccnc2Br 270004a_100009818023_100000186029 [0,2,0,0,0,0|2,0,0]=4 19253 B18R2.9237 Brc1ccc(cc1)CNCc2cccnc2Br 34a_100000174875_100010140945 [0,2,0,0,0,0|2,0,0]=4 19254 B18R2.9237 Brc1ccc(cc1)CNCc2cccnc2Br 34a_100009818023_100000189115 [0,2,0,0,0,0|2,0,0]=4 19255 B18R2.9237 Brc1ccc(cc1)CNCc2ccncc2Br 207a_100020640021_100000186029 [0,2,0,0,0,0|2,0,0]=4 19256 B18R2.9237 Brc1ccc(cc1)CNCc2ccncc2Br 270004a_100000174875_100000755692 [0,2,0,0,0,0|2,0,0]=4 19257 B18R2.9237 Brc1ccc(cc1)CNCc2ccncc2Br 270004a_100020640021_100000186029 [0,2,0,0,0,0|2,0,0]=4 19258 B18R2.9237 Brc1ccc(cc1)CNCc2cnccc2Br 270004a_100000174875_100009816821 [0,2,0,0,0,0|2,0,0]=4 19259 B18R2.9237 Brc1ccc(cc1)CNCc2ncccc2Br 207a_100000174875_100011934733 [0,2,0,0,0,0|2,0,0]=4 19260 B18R2.9237 Brc1ccc(cc1)CNCc2ncccc2Br 2230a_100000174875_100025702911 [0,2,0,0,0,0|2,0,0]=4 19261 B18R2.9237 Brc1ccc(cc1)CNCc2ncccc2Br 270004a_100000174875_100011934733 [0,2,0,0,0,0|2,0,0]=4 19262 B18R2.9237 Brc1ccc(cc1)CNCc2ncccc2Br 270004a_100020591323_100000186029 [0,2,0,0,0,0|2,0,0]=4 19263 B18R2.9237 Brc1ccc(cc1)CNCc2ncccc2Br 34a_100000174875_100025702911 [0,2,0,0,0,0|2,0,0]=4 19264 B18R2.9237 Brc1ccc(cc1)COCc2ccccc2Br 34a_100000695286_100000184730 [0,2,0,0,0,0|0,0,0]=2 19265 B18R2.9237 Brc1ccc(cc1)COCc2ccccc2Br 34a_100000756307_100000189115 [0,2,0,0,0,0|0,0,0]=2 19266 B18R2.9237 Brc1ccc(cc1)COCc2ccccc2Br 7a_100000756307_100011217064 [0,2,0,0,0,0|0,0,0]=2 19267 B18R2.9237 Brc1ccc(cc1)COCc2ccccc2I 34a_100000187465_100000189115 [0,2,0,0,0,0|0,0,0]=2 19268 B18R2.9237 Brc1ccc(cc1)COCc2ccccc2I 34a_100000695286_100011215278 [0,2,0,0,0,0|0,0,0]=2 19269 B18R2.9237 Brc1ccc(cc1)COCc2ccccc2I 7a_100000187465_100011217064 [0,2,0,0,0,0|0,0,0]=2 19270 B18R2.9237 Brc1ccc(cc1)COCc2cccnc2Br 34a_100000695286_100010140945 [0,2,0,0,0,0|1,0,0]=3 19271 B18R2.9237 Brc1ccc(cc1)COCc2cccnc2Br 34a_100000719692_100000189115 [0,2,0,0,0,0|1,0,0]=3 19272 B18R2.9237 Brc1ccc(cc1)COCc2cccnc2Br 7a_100000719692_100011217064 [0,2,0,0,0,0|1,0,0]=3 19273 B18R2.9237 Brc1ccc(cc1)COCc2ncccc2Br 34a_100000695286_100025702911 [0,2,0,0,0,0|1,0,0]=3 19274 B18R2.9237 Brc1ccc(cc1)COCc2ncccc2Br 34a_100011996772_100000189115 [0,2,0,0,0,0|1,0,0]=3 19275 B18R2.9237 Brc1ccc(cc1)CSCc2ccccc2Br 62a_100000184730_100000189115 [0,2,0,0,0,0|0,1,0]=3 19276 B18R2.9237 Brc1ccc(cc1)CSCc2ccccc2Br 62a_100000189115_100000184730 [0,2,0,0,0,0|0,1,0]=3 19277 B18R2.9237 Brc1ccc(cc1)CSCc2ccccc2I 62a_100000189115_100011216222 [0,2,0,0,0,0|0,1,0]=3 19278 B18R2.9237 Brc1ccc(cc1)CSCc2ccccc2I 62a_100011216222_100000189115 [0,2,0,0,0,0|0,1,0]=3 19279 B18R2.9237 Brc1ccc(cc1)CSCc2cccnc2Br 62a_100000189115_100010140945 [0,2,0,0,0,0|1,1,0]=4 19280 B18R2.9237 Brc1ccc(cc1)CSCc2cccnc2Br 62a_100010140945_100000189115 [0,2,0,0,0,0|1,1,0]=4 19281 B18R2.9237 Brc1ccc(cc1)CSCc2ncccc2Br 62a_100000189115_100025702911 [0,2,0,0,0,0|1,1,0]=4 19282 B18R2.9237 Brc1ccc(cc1)CSCc2ncccc2Br 62a_100025702911_100000189115 [0,2,0,0,0,0|1,1,0]=4 19283 B18R2.9237 Brc1ccc(cc1)NCCc2ccccc2Br 2230a_100000210018_100012161201 [0,2,0,0,0,0|2,0,0]=4 19284 B18R2.9237 Brc1ccc(cc1)NCCc2ccccc2Br 34a_100000210018_100012161201 [0,2,0,0,0,0|2,0,0]=4 19285 B18R2.9237 Brc1ccc(cc1)OCCc2ccccc2Br 34a_100000185759_100012161201 [0,2,0,0,0,0|2,0,0]=4 19286 B18R2.9237 Brc1ccc(cc1)OCCc2ccccc2Br 7a_100000185759_100012161201 [0,2,0,0,0,0|2,0,0]=4 19287 B18R2.9237 Brc1ccc(cc1)SCCc2ccccc2Br 62a_100000752885_100012161201 [0,2,0,0,0,0|2,0,0]=4 19288 B18R2.9237 Brc1ccc(cc1)SCCc2ccccc2Br 62a_100012161201_100000752885 [0,2,0,0,0,0|2,0,0]=4 19289 B18R2.9237 Brc1ccc(cn1)CNCc2ccccc2Br 207a_100009817727_100000211189 [0,2,0,0,0,0|2,0,0]=4 19290 B18R2.9237 Brc1ccc(cn1)CNCc2ccccc2Br 2230a_100000689332_100009831999 [0,2,0,0,0,0|2,0,0]=4 19291 B18R2.9237 Brc1ccc(cn1)CNCc2ccccc2Br 2230a_100009817727_100000184730 [0,2,0,0,0,0|2,0,0]=4 19292 B18R2.9237 Brc1ccc(cn1)CNCc2ccccc2Br 270004a_100009817727_100000211189 [0,2,0,0,0,0|2,0,0]=4 19293 B18R2.9237 Brc1ccc(cn1)CNCc2ccccc2Br 34a_100000689332_100009831999 [0,2,0,0,0,0|2,0,0]=4 19294 B18R2.9237 Brc1ccc(cn1)CNCc2ccccc2Br 34a_100009817727_100000184730 [0,2,0,0,0,0|2,0,0]=4 19295 B18R2.9237 Brc1ccc(cn1)CNCc2ccccc2I 207a_100009817727_100000010305 [0,2,0,0,0,0|2,0,0]=4 19296 B18R2.9237 Brc1ccc(cn1)CNCc2ccccc2I 2230a_100009817727_100011215278 [0,2,0,0,0,0|2,0,0]=4 19297 B18R2.9237 Brc1ccc(cn1)CNCc2ccccc2I 270004a_100009817727_100000010305 [0,2,0,0,0,0|2,0,0]=4 19298 B18R2.9237 Brc1ccc(cn1)CNCc2ccccc2I 34a_100009817727_100011215278 [0,2,0,0,0,0|2,0,0]=4 19299 B18R2.9237 Brc1ccc(cn1)COCc2ccccc2Br 34a_100000756307_100009831999 [0,2,0,0,0,0|1,0,0]=3 19300 B18R2.9237 Brc1ccc(cn1)COCc2ccccc2Br 34a_100009816760_100000184730 [0,2,0,0,0,0|1,0,0]=3 19301 B18R2.9237 Brc1ccc(cn1)COCc2ccccc2Br 7a_100000756307_100009831999 [0,2,0,0,0,0|1,0,0]=3 19302 B18R2.9237 Brc1ccc(cn1)COCc2ccccc2Br 7a_100009816760_100000184730 [0,2,0,0,0,0|1,0,0]=3 19303 B18R2.9237 Brc1ccc(cn1)COCc2ccccc2I 34a_100000187465_100009831999 [0,2,0,0,0,0|1,0,0]=3 19304 B18R2.9237 Brc1ccc(cn1)COCc2ccccc2I 34a_100009816760_100011215278 [0,2,0,0,0,0|1,0,0]=3 19305 B18R2.9237 Brc1ccc(cn1)COCc2ccccc2I 7a_100000187465_100009831999 [0,2,0,0,0,0|1,0,0]=3 19306 B18R2.9237 Brc1ccc(cn1)COCc2ccccc2I 7a_100009816760_100011215278 [0,2,0,0,0,0|1,0,0]=3 19307 B18R2.9237 Brc1ccc(cn1)COCc2cccnc2Br 34a_100000719692_100009831999 [0,2,0,0,0,0|2,0,0]=4 19308 B18R2.9237 Brc1ccc(cn1)COCc2cccnc2Br 34a_100009816760_100010140945 [0,2,0,0,0,0|2,0,0]=4 19309 B18R2.9237 Brc1ccc(cn1)COCc2cccnc2Br 7a_100000719692_100009831999 [0,2,0,0,0,0|2,0,0]=4 19310 B18R2.9237 Brc1ccc(cn1)COCc2cccnc2Br 7a_100009816760_100010140945 [0,2,0,0,0,0|2,0,0]=4 19311 B18R2.9237 Brc1ccc(cn1)COCc2ncccc2Br 34a_100009816760_100025702911 [0,2,0,0,0,0|2,0,0]=4 19312 B18R2.9237 Brc1ccc(cn1)COCc2ncccc2Br 34a_100011996772_100009831999 [0,2,0,0,0,0|2,0,0]=4 19313 B18R2.9237 Brc1ccc(cn1)COCc2ncccc2Br 7a_100009816760_100025702911 [0,2,0,0,0,0|2,0,0]=4 19314 B18R2.9237 Brc1ccc(cn1)CSCc2ccccc2Br 62a_100000184730_100009831999 [0,2,0,0,0,0|1,1,0]=4 19315 B18R2.9237 Brc1ccc(cn1)CSCc2ccccc2Br 62a_100009831999_100000184730 [0,2,0,0,0,0|1,1,0]=4 19316 B18R2.9237 Brc1ccc(cn1)CSCc2ccccc2I 62a_100009831999_100011216222 [0,2,0,0,0,0|1,1,0]=4 19317 B18R2.9237 Brc1ccc(cn1)CSCc2ccccc2I 62a_100011216222_100009831999 [0,2,0,0,0,0|1,1,0]=4 19318 B18R2.9237 Brc1ccc(nc1)CNCc2ccccc2Br 207a_100000689332_100000754260 [0,2,0,0,0,0|2,0,0]=4 19319 B18R2.9237 Brc1ccc(nc1)CNCc2ccccc2Br 2230a_100000689332_100000702658 [0,2,0,0,0,0|2,0,0]=4 19320 B18R2.9237 Brc1ccc(nc1)CNCc2ccccc2Br 270004a_100000689332_100000754260 [0,2,0,0,0,0|2,0,0]=4 19321 B18R2.9237 Brc1ccc(nc1)CNCc2ccccc2Br 34a_100000689332_100000702658 [0,2,0,0,0,0|2,0,0]=4 19322 B18R2.9237 Brc1ccc(nc1)CNCc2ccccc2Br 34a_100015188789_100000184730 [0,2,0,0,0,0|2,0,0]=4 19323 B18R2.9237 Brc1ccc(nc1)CNCc2ccccc2I 207a_100015347259_100000754260 [0,2,0,0,0,0|2,0,0]=4 19324 B18R2.9237 Brc1ccc(nc1)CNCc2ccccc2I 270004a_100015347259_100000754260 [0,2,0,0,0,0|2,0,0]=4 19325 B18R2.9237 Brc1ccc(nc1)CNCc2ccccc2I 34a_100015188789_100011215278 [0,2,0,0,0,0|2,0,0]=4 19326 B18R2.9237 Brc1ccc(nc1)COCc2ccccc2Br 34a_100000754261_100000184730 [0,2,0,0,0,0|1,0,0]=3 19327 B18R2.9237 Brc1ccc(nc1)COCc2ccccc2Br 34a_100000756307_100000702658 [0,2,0,0,0,0|1,0,0]=3 19328 B18R2.9237 Brc1ccc(nc1)COCc2ccccc2Br 7a_100000756307_100000702658 [0,2,0,0,0,0|1,0,0]=3 19329 B18R2.9237 Brc1ccc(nc1)COCc2ccccc2I 34a_100000187465_100000702658 [0,2,0,0,0,0|1,0,0]=3 19330 B18R2.9237 Brc1ccc(nc1)COCc2ccccc2I 34a_100000754261_100011215278 [0,2,0,0,0,0|1,0,0]=3 19331 B18R2.9237 Brc1ccc(nc1)COCc2ccccc2I 7a_100000187465_100000702658 [0,2,0,0,0,0|1,0,0]=3 19332 B18R2.9237 Brc1ccc(nc1)COCc2cccnc2Br 34a_100000719692_100000702658 [0,2,0,0,0,0|2,0,0]=4 19333 B18R2.9237 Brc1ccc(nc1)COCc2cccnc2Br 34a_100000754261_100010140945 [0,2,0,0,0,0|2,0,0]=4 19334 B18R2.9237 Brc1ccc(nc1)COCc2cccnc2Br 7a_100000719692_100000702658 [0,2,0,0,0,0|2,0,0]=4 19335 B18R2.9237 Brc1ccc(nc1)COCc2ncccc2Br 34a_100000754261_100025702911 [0,2,0,0,0,0|2,0,0]=4 19336 B18R2.9237 Brc1ccc(nc1)COCc2ncccc2Br 34a_100011996772_100000702658 [0,2,0,0,0,0|2,0,0]=4 19337 B18R2.9237 Brc1ccc(nc1)CSCc2ccccc2Br 62a_100000184730_100000702658 [0,2,0,0,0,0|1,1,0]=4 19338 B18R2.9237 Brc1ccc(nc1)CSCc2ccccc2Br 62a_100000702658_100000184730 [0,2,0,0,0,0|1,1,0]=4 19339 B18R2.9237 Brc1ccc(nc1)CSCc2ccccc2I 62a_100000702658_100011216222 [0,2,0,0,0,0|1,1,0]=4 19340 B18R2.9237 Brc1ccc(nc1)CSCc2ccccc2I 62a_100011216222_100000702658 [0,2,0,0,0,0|1,1,0]=4 19341 B18R2.9237 Brc1ccccc1CCNc2ccc(cc2)I 34a_100000185761_100012161201 [0,2,0,0,0,0|2,0,0]=4 19342 B18R2.9237 Brc1ccccc1CCOc2ccc(cc2)I 34a_100000212066_100012161201 [0,2,0,0,0,0|2,0,0]=4 19343 B18R2.9237 Brc1ccccc1CCOc2ccc(cc2)I 7a_100000212066_100012161201 [0,2,0,0,0,0|2,0,0]=4 19344 B18R2.9237 Brc1ccccc1CNCc2ccc(cc2)I 207a_100000689332_100000188517 [0,2,0,0,0,0|1,0,0]=3 19345 B18R2.9237 Brc1ccccc1CNCc2ccc(cc2)I 207a_100016989417_100000211189 [0,2,0,0,0,0|1,0,0]=3 19346 B18R2.9237 Brc1ccccc1CNCc2ccc(cc2)I 2230a_100000689332_100000189116 [0,2,0,0,0,0|1,0,0]=3 19347 B18R2.9237 Brc1ccccc1CNCc2ccc(cc2)I 2230a_100016989417_100000184730 [0,2,0,0,0,0|1,0,0]=3 19348 B18R2.9237 Brc1ccccc1CNCc2ccc(cc2)I 270004a_100016989417_100000211189 [0,2,0,0,0,0|1,0,0]=3 19349 B18R2.9237 Brc1ccccc1CNCc2ccc(cc2)I 34a_100000689332_100000189116 [0,2,0,0,0,0|1,0,0]=3 19350 B18R2.9237 Brc1ccccc1CNCc2ccc(cc2)I 34a_100016989417_100000184730 [0,2,0,0,0,0|1,0,0]=3 19351 B18R2.9237 Brc1ccccc1COCc2ccc(cc2)I 34a_100000690907_100000184730 [0,2,0,0,0,0|0,0,0]=2 19352 B18R2.9237 Brc1ccccc1COCc2ccc(cc2)I 34a_100000756307_100000189116 [0,2,0,0,0,0|0,0,0]=2 19353 B18R2.9237 Brc1ccccc1COCc2ccc(cc2)I 7a_100000690907_100000184730 [0,2,0,0,0,0|0,0,0]=2 19354 B18R2.9237 Brc1ccccc1COCc2ccc(cc2)I 7a_100000756307_100000189116 [0,2,0,0,0,0|0,0,0]=2 19355 B18R2.9237 Brc1ccccc1CSCc2ccc(cc2)I 62a_100000184730_100000189116 [0,2,0,0,0,0|0,1,0]=3 19356 B18R2.9237 Brc1ccccc1CSCc2ccc(cc2)I 62a_100000189116_100000184730 [0,2,0,0,0,0|0,1,0]=3 19357 B18R2.9237 Brc1cccnc1CNCc2ccc(cc2)I 207a_100016989417_100011934733 [0,2,0,0,0,0|2,0,0]=4 19358 B18R2.9237 Brc1cccnc1CNCc2ccc(cc2)I 2230a_100016989417_100025702911 [0,2,0,0,0,0|2,0,0]=4 19359 B18R2.9237 Brc1cccnc1CNCc2ccc(cc2)I 270004a_100016989417_100011934733 [0,2,0,0,0,0|2,0,0]=4 19360 B18R2.9237 Brc1cccnc1CNCc2ccc(cc2)I 34a_100016989417_100025702911 [0,2,0,0,0,0|2,0,0]=4 19361 B18R2.9237 Brc1cccnc1COCc2ccc(cc2)I 34a_100000690907_100025702911 [0,2,0,0,0,0|1,0,0]=3 19362 B18R2.9237 Brc1cccnc1COCc2ccc(cc2)I 34a_100011996772_100000189116 [0,2,0,0,0,0|1,0,0]=3 19363 B18R2.9237 Brc1cccnc1COCc2ccc(cc2)I 7a_100000690907_100025702911 [0,2,0,0,0,0|1,0,0]=3 19364 B18R2.9237 Brc1cccnc1CSCc2ccc(cc2)I 62a_100000189116_100025702911 [0,2,0,0,0,0|1,1,0]=4 19365 B18R2.9237 Brc1cccnc1CSCc2ccc(cc2)I 62a_100025702911_100000189116 [0,2,0,0,0,0|1,1,0]=4 19366 B18R2.9237 Brc1ccncc1CNCc2ccc(cc2)I 270004a_100016989417_100009816821 [0,2,0,0,0,0|2,0,0]=4 19367 B18R2.9237 Brc1cnc(nc1)COCc2ccccc2Br 34a_100000756307_100010064664 [0,2,0,0,0,0|2,0,0]=4 19368 B18R2.9237 Brc1cnc(nc1)COCc2ccccc2Br 7a_100000756307_100010064664 [0,2,0,0,0,0|2,0,0]=4 19369 B18R2.9237 Brc1cnc(nc1)COCc2ccccc2I 34a_100000187465_100010064664 [0,2,0,0,0,0|2,0,0]=4 19370 B18R2.9237 Brc1cnc(nc1)COCc2ccccc2I 7a_100000187465_100010064664 [0,2,0,0,0,0|2,0,0]=4 19371 B18R2.9237 Brc1cnccc1CNCc2ccc(cc2)I 207a_100020640021_100000188517 [0,2,0,0,0,0|2,0,0]=4 19372 B18R2.9237 Brc1cnccc1CNCc2ccc(cc2)I 270004a_100016989417_100000755692 [0,2,0,0,0,0|2,0,0]=4 19373 B18R2.9237 Brc1ncccc1CNCc2ccc(cc2)I 2230a_100009818023_100000189116 [0,2,0,0,0,0|2,0,0]=4 19374 B18R2.9237 Brc1ncccc1CNCc2ccc(cc2)I 2230a_100016989417_100010140945 [0,2,0,0,0,0|2,0,0]=4 19375 B18R2.9237 Brc1ncccc1CNCc2ccc(cc2)I 34a_100009818023_100000189116 [0,2,0,0,0,0|2,0,0]=4 19376 B18R2.9237 Brc1ncccc1CNCc2ccc(cc2)I 34a_100016989417_100010140945 [0,2,0,0,0,0|2,0,0]=4 19377 B18R2.9237 Brc1ncccc1COCc2ccc(cc2)I 34a_100000690907_100010140945 [0,2,0,0,0,0|1,0,0]=3 19378 B18R2.9237 Brc1ncccc1COCc2ccc(cc2)I 34a_100000719692_100000189116 [0,2,0,0,0,0|1,0,0]=3 19379 B18R2.9237 Brc1ncccc1COCc2ccc(cc2)I 7a_100000690907_100010140945 [0,2,0,0,0,0|1,0,0]=3 19380 B18R2.9237 Brc1ncccc1COCc2ccc(cc2)I 7a_100000719692_100000189116 [0,2,0,0,0,0|1,0,0]=3 19381 B18R2.9237 Brc1ncccc1CSCc2ccc(cc2)I 62a_100000189116_100010140945 [0,2,0,0,0,0|1,1,0]=4 19382 B18R2.9237 Brc1ncccc1CSCc2ccc(cc2)I 62a_100010140945_100000189116 [0,2,0,0,0,0|1,1,0]=4 19383 B18R2.9237 C[n+]1ccc(cc1)COCc2ccccc2Br 34a_100009831711_100000184730 [0,2,0,0,0,0|1,0,0]=3 19384 B18R2.9237 C[n+]1ccc(cc1)COCc2ccccc2Cl 34a_100009831711_100000187162 [0,2,0,0,0,0|1,0,0]=3 19385 B18R2.9237 C[n+]1ccc(cc1)COCc2ccccc2F 34a_100009831711_100000211605 [0,2,0,0,0,0|1,0,0]=3 19386 B18R2.9237 C[n+]1ccc(cc1)COCc2ccccc2I 34a_100009831711_100011215278 [0,2,0,0,0,0|1,0,0]=3 19387 B18R2.9237 C[n+]1ccc(cc1)COCc2cccnc2Br 34a_100009831711_100010140945 [0,2,0,0,0,0|2,0,0]=4 19388 B18R2.9237 C[n+]1ccc(cc1)COCc2cccnc2Cl 34a_100009831711_100000045678 [0,2,0,0,0,0|2,0,0]=4 19389 B18R2.9237 C[n+]1ccc(cc1)COCc2cccnc2F 34a_100009831711_100000099810 [0,2,0,0,0,0|2,0,0]=4 19390 B18R2.9237 C[n+]1ccc(cc1)COCc2ncccc2Br 34a_100009831711_100025702911 [0,2,0,0,0,0|2,0,0]=4 19391 B18R2.9237 C[n+]1ccc(cc1)COCc2ncccc2F 34a_100009831711_100000104219 [0,2,0,0,0,0|2,0,0]=4 19392 B18R2.9237 C[n+]1ccc(cc1)COCc2ncccc2O 34a_100009831711_200020655725 [0,2,0,0,0,0|2,0,0]=4 19393 B18R2.9237 Cc1ccc(cc1)CCNc2ccccc2Br 34a_100000210017_100011713686 [0,2,0,0,0,0|2,0,0]=4 19394 B18R2.9237 Cc1ccc(cc1)CCNc2ccccc2C 34a_100015192222_100011713686 [0,2,0,0,0,0|2,0,0]=4 19395 B18R2.9237 Cc1ccc(cc1)CCNc2ccccc2Cl 34a_100000185783_100011713686 [0,2,0,0,0,0|2,0,0]=4 19396 B18R2.9237 Cc1ccc(cc1)CCNc2ccccc2F 34a_100000210422_100011713686 [0,2,0,0,0,0|2,0,0]=4 19397 B18R2.9237 Cc1ccc(cc1)CCNc2ccccc2I 34a_100000210053_100011713686 [0,2,0,0,0,0|2,0,0]=4 19398 B18R2.9237 Cc1ccc(cc1)CCNc2ccccc2O 34a_100000185747_100011713686 [0,2,0,0,0,0|2,0,0]=4 19399 B18R2.9237 Cc1ccc(cc1)CCOc2ccccc2Br 34a_100000181306_100011713686 [0,2,0,0,0,0|2,0,0]=4 19400 B18R2.9237 Cc1ccc(cc1)CCOc2ccccc2Br 7a_100000181306_100011713686 [0,2,0,0,0,0|2,0,0]=4 19401 B18R2.9237 Cc1ccc(cc1)CCOc2ccccc2C 34a_100000210338_100011713686 [0,2,0,0,0,0|2,0,0]=4 19402 B18R2.9237 Cc1ccc(cc1)CCOc2ccccc2C 7a_100000210338_100011713686 [0,2,0,0,0,0|2,0,0]=4 19403 B18R2.9237 Cc1ccc(cc1)CCOc2ccccc2Cl 34a_100000210172_100011713686 [0,2,0,0,0,0|2,0,0]=4 19404 B18R2.9237 Cc1ccc(cc1)CCOc2ccccc2Cl 7a_100000210172_100011713686 [0,2,0,0,0,0|2,0,0]=4 19405 B18R2.9237 Cc1ccc(cc1)CCOc2ccccc2F 34a_100000210171_100011713686 [0,2,0,0,0,0|2,0,0]=4 19406 B18R2.9237 Cc1ccc(cc1)CCOc2ccccc2F 7a_100000210171_100011713686 [0,2,0,0,0,0|2,0,0]=4 19407 B18R2.9237 Cc1ccc(cc1)CCOc2ccccc2I 34a_100000739446_100011713686 [0,2,0,0,0,0|2,0,0]=4 19408 B18R2.9237 Cc1ccc(cc1)CCOc2ccccc2I 7a_100000739446_100011713686 [0,2,0,0,0,0|2,0,0]=4 19409 B18R2.9237 Cc1ccc(cc1)CCOc2ccccc2N 34a_100000185747_100011713686 [0,2,0,0,0,0|2,0,0]=4 19410 B18R2.9237 Cc1ccc(cc1)CCOc2ccccc2N 7a_100000185747_100011713686 [0,2,0,0,0,0|2,0,0]=4 19411 B18R2.9237 Cc1ccc(cc1)CCSc2ccccc2Br 62a_100000695589_100011713686 [0,2,0,0,0,0|2,0,0]=4 19412 B18R2.9237 Cc1ccc(cc1)CCSc2ccccc2Br 62a_100011713686_100000695589 [0,2,0,0,0,0|2,0,0]=4 19413 B18R2.9237 Cc1ccc(cc1)CCSc2ccccc2C 62a_100000210755_100011713686 [0,2,0,0,0,0|2,0,0]=4 19414 B18R2.9237 Cc1ccc(cc1)CCSc2ccccc2C 62a_100011713686_100000210755 [0,2,0,0,0,0|2,0,0]=4 19415 B18R2.9237 Cc1ccc(cc1)CCSc2ccccc2Cl 62a_100000764095_100011713686 [0,2,0,0,0,0|2,0,0]=4 19416 B18R2.9237 Cc1ccc(cc1)CCSc2ccccc2Cl 62a_100011713686_100000764095 [0,2,0,0,0,0|2,0,0]=4 19417 B18R2.9237 Cc1ccc(cc1)CCSc2ccccc2F 62a_100011215700_100011713686 [0,2,0,0,0,0|2,0,0]=4 19418 B18R2.9237 Cc1ccc(cc1)CCSc2ccccc2F 62a_100011713686_100011215700 [0,2,0,0,0,0|2,0,0]=4 19419 B18R2.9237 Cc1ccc(cc1)CCSc2ccccc2N 62a_100000210017_100011713686 [0,2,0,0,0,0|2,0,0]=4 19420 B18R2.9237 Cc1ccc(cc1)CCSc2ccccc2N 62a_100011713686_100000210017 [0,2,0,0,0,0|2,0,0]=4 19421 B18R2.9237 Cc1ccc(cc1)CCSc2ccccc2O 62a_100000739446_100011713686 [0,2,0,0,0,0|2,0,0]=4 19422 B18R2.9237 Cc1ccc(cc1)CCSc2ccccc2O 62a_100011713686_100000739446 [0,2,0,0,0,0|2,0,0]=4 19423 B18R2.9237 Cc1ccc(cc1)CNCc2ccccc2Br 207a_100000174908_100000211189 [0,2,0,0,0,0|1,0,0]=3 19424 B18R2.9237 Cc1ccc(cc1)CNCc2ccccc2Br 207a_100000689332_100000211033 [0,2,0,0,0,0|1,0,0]=3 19425 B18R2.9237 Cc1ccc(cc1)CNCc2ccccc2Br 2230a_100000174908_100000184730 [0,2,0,0,0,0|1,0,0]=3 19426 B18R2.9237 Cc1ccc(cc1)CNCc2ccccc2Br 2230a_100000689332_100000210814 [0,2,0,0,0,0|1,0,0]=3 19427 B18R2.9237 Cc1ccc(cc1)CNCc2ccccc2Br 26a_100000689332_200020625495 [0,2,0,0,0,0|1,0,0]=3 19428 B18R2.9237 Cc1ccc(cc1)CNCc2ccccc2Br 270004a_100000174908_100000211189 [0,2,0,0,0,0|1,0,0]=3 19429 B18R2.9237 Cc1ccc(cc1)CNCc2ccccc2Br 270004a_100000689332_100000211033 [0,2,0,0,0,0|1,0,0]=3 19430 B18R2.9237 Cc1ccc(cc1)CNCc2ccccc2Br 34a_100000174908_100000184730 [0,2,0,0,0,0|1,0,0]=3 19431 B18R2.9237 Cc1ccc(cc1)CNCc2ccccc2Br 34a_100000689332_100000210814 [0,2,0,0,0,0|1,0,0]=3 19432 B18R2.9237 Cc1ccc(cc1)CNCc2ccccc2C 207a_100000174908_100000211143 [0,2,0,0,0,0|1,0,0]=3 19433 B18R2.9237 Cc1ccc(cc1)CNCc2ccccc2C 207a_100000174972_100000211033 [0,2,0,0,0,0|1,0,0]=3 19434 B18R2.9237 Cc1ccc(cc1)CNCc2ccccc2C 2230a_100000174908_100000211839 [0,2,0,0,0,0|1,0,0]=3 19435 B18R2.9237 Cc1ccc(cc1)CNCc2ccccc2C 270004a_100000174908_100000211143 [0,2,0,0,0,0|1,0,0]=3 19436 B18R2.9237 Cc1ccc(cc1)CNCc2ccccc2C 270004a_100000174972_100000211033 [0,2,0,0,0,0|1,0,0]=3 19437 B18R2.9237 Cc1ccc(cc1)CNCc2ccccc2C 34a_100000174908_100000211839 [0,2,0,0,0,0|1,0,0]=3 19438 B18R2.9237 Cc1ccc(cc1)CNCc2ccccc2C 34a_100000174972_100000210814 [0,2,0,0,0,0|1,0,0]=3 19439 B18R2.9237 Cc1ccc(cc1)CNCc2ccccc2Cl 207a_100000174879_100000211033 [0,2,0,0,0,0|1,0,0]=3 19440 B18R2.9237 Cc1ccc(cc1)CNCc2ccccc2Cl 207a_100000174908_100000210073 [0,2,0,0,0,0|1,0,0]=3 19441 B18R2.9237 Cc1ccc(cc1)CNCc2ccccc2Cl 2230a_100000174879_100000210814 [0,2,0,0,0,0|1,0,0]=3 19442 B18R2.9237 Cc1ccc(cc1)CNCc2ccccc2Cl 2230a_100000174908_100000187162 [0,2,0,0,0,0|1,0,0]=3 19443 B18R2.9237 Cc1ccc(cc1)CNCc2ccccc2Cl 26a_100000174879_200020625495 [0,2,0,0,0,0|1,0,0]=3 19444 B18R2.9237 Cc1ccc(cc1)CNCc2ccccc2Cl 270004a_100000174879_100000211033 [0,2,0,0,0,0|1,0,0]=3 19445 B18R2.9237 Cc1ccc(cc1)CNCc2ccccc2Cl 270004a_100000174908_100000210073 [0,2,0,0,0,0|1,0,0]=3 19446 B18R2.9237 Cc1ccc(cc1)CNCc2ccccc2Cl 34a_100000174879_100000210814 [0,2,0,0,0,0|1,0,0]=3 19447 B18R2.9237 Cc1ccc(cc1)CNCc2ccccc2Cl 34a_100000174908_100000187162 [0,2,0,0,0,0|1,0,0]=3 19448 B18R2.9237 Cc1ccc(cc1)CNCc2ccccc2F 207a_100000174869_100000211033 [0,2,0,0,0,0|1,0,0]=3 19449 B18R2.9237 Cc1ccc(cc1)CNCc2ccccc2F 207a_100000174908_100000210811 [0,2,0,0,0,0|1,0,0]=3 19450 B18R2.9237 Cc1ccc(cc1)CNCc2ccccc2F 2230a_100000174908_100000211605 [0,2,0,0,0,0|1,0,0]=3 19451 B18R2.9237 Cc1ccc(cc1)CNCc2ccccc2F 270004a_100000174869_100000211033 [0,2,0,0,0,0|1,0,0]=3 19452 B18R2.9237 Cc1ccc(cc1)CNCc2ccccc2F 270004a_100000174908_100000210811 [0,2,0,0,0,0|1,0,0]=3 19453 B18R2.9237 Cc1ccc(cc1)CNCc2ccccc2F 34a_100000174869_100000210814 [0,2,0,0,0,0|1,0,0]=3 19454 B18R2.9237 Cc1ccc(cc1)CNCc2ccccc2F 34a_100000174908_100000211605 [0,2,0,0,0,0|1,0,0]=3 19455 B18R2.9237 Cc1ccc(cc1)CNCc2ccccc2I 207a_100000174908_100000010305 [0,2,0,0,0,0|1,0,0]=3 19456 B18R2.9237 Cc1ccc(cc1)CNCc2ccccc2I 207a_100015347259_100000211033 [0,2,0,0,0,0|1,0,0]=3 19457 B18R2.9237 Cc1ccc(cc1)CNCc2ccccc2I 2230a_100000174908_100011215278 [0,2,0,0,0,0|1,0,0]=3 19458 B18R2.9237 Cc1ccc(cc1)CNCc2ccccc2I 270004a_100000174908_100000010305 [0,2,0,0,0,0|1,0,0]=3 19459 B18R2.9237 Cc1ccc(cc1)CNCc2ccccc2I 270004a_100015347259_100000211033 [0,2,0,0,0,0|1,0,0]=3 19460 B18R2.9237 Cc1ccc(cc1)CNCc2ccccc2I 34a_100000174908_100011215278 [0,2,0,0,0,0|1,0,0]=3 19461 B18R2.9237 Cc1ccc(cc1)CNCc2ccccc2O 207a_100000185550_100000211033 [0,2,0,0,0,0|1,0,0]=3 19462 B18R2.9237 Cc1ccc(cc1)CNCc2ccccc2O 270004a_100000185550_100000211033 [0,2,0,0,0,0|1,0,0]=3 19463 B18R2.9237 Cc1ccc(cc1)CNCc2ccccc2O 34a_100000185550_100000210814 [0,2,0,0,0,0|1,0,0]=3 19464 B18R2.9237 Cc1ccc(cc1)CNCc2cccnc2Br 2230a_100000174908_100010140945 [0,2,0,0,0,0|2,0,0]=4 19465 B18R2.9237 Cc1ccc(cc1)CNCc2cccnc2Br 2230a_100009818023_100000210814 [0,2,0,0,0,0|2,0,0]=4 19466 B18R2.9237 Cc1ccc(cc1)CNCc2cccnc2Br 270004a_100009818023_100000211033 [0,2,0,0,0,0|2,0,0]=4 19467 B18R2.9237 Cc1ccc(cc1)CNCc2cccnc2Br 34a_100000174908_100010140945 [0,2,0,0,0,0|2,0,0]=4 19468 B18R2.9237 Cc1ccc(cc1)CNCc2cccnc2Br 34a_100009818023_100000210814 [0,2,0,0,0,0|2,0,0]=4 19469 B18R2.9237 Cc1ccc(cc1)CNCc2cccnc2C 207a_100000174908_100000751968 [0,2,0,0,0,0|2,0,0]=4 19470 B18R2.9237 Cc1ccc(cc1)CNCc2cccnc2C 2230a_100000174908_100000732876 [0,2,0,0,0,0|2,0,0]=4 19471 B18R2.9237 Cc1ccc(cc1)CNCc2cccnc2C 270004a_100000174908_100000751968 [0,2,0,0,0,0|2,0,0]=4 19472 B18R2.9237 Cc1ccc(cc1)CNCc2cccnc2C 34a_100000174908_100000732876 [0,2,0,0,0,0|2,0,0]=4 19473 B18R2.9237 Cc1ccc(cc1)CNCc2cccnc2Cl 207a_100015189234_100000211033 [0,2,0,0,0,0|2,0,0]=4 19474 B18R2.9237 Cc1ccc(cc1)CNCc2cccnc2Cl 2230a_100000174908_100000045678 [0,2,0,0,0,0|2,0,0]=4 19475 B18R2.9237 Cc1ccc(cc1)CNCc2cccnc2Cl 2230a_100015189234_100000210814 [0,2,0,0,0,0|2,0,0]=4 19476 B18R2.9237 Cc1ccc(cc1)CNCc2cccnc2Cl 34a_100000174908_100000045678 [0,2,0,0,0,0|2,0,0]=4 19477 B18R2.9237 Cc1ccc(cc1)CNCc2cccnc2Cl 34a_100015189234_100000210814 [0,2,0,0,0,0|2,0,0]=4 19478 B18R2.9237 Cc1ccc(cc1)CNCc2cccnc2F 2230a_100000174908_100000099810 [0,2,0,0,0,0|2,0,0]=4 19479 B18R2.9237 Cc1ccc(cc1)CNCc2cccnc2F 270004a_100000724633_100000211033 [0,2,0,0,0,0|2,0,0]=4 19480 B18R2.9237 Cc1ccc(cc1)CNCc2cccnc2F 34a_100000174908_100000099810 [0,2,0,0,0,0|2,0,0]=4 19481 B18R2.9237 Cc1ccc(cc1)CNCc2cccnc2F 34a_100000724633_100000210814 [0,2,0,0,0,0|2,0,0]=4 19482 B18R2.9237 Cc1ccc(cc1)CNCc2cccnc2O 207a_100000174908_100011998315 [0,2,0,0,0,0|2,0,0]=4 19483 B18R2.9237 Cc1ccc(cc1)CNCc2cccnc2O 270004a_100000174908_100011998315 [0,2,0,0,0,0|2,0,0]=4 19484 B18R2.9237 Cc1ccc(cc1)CNCc2ccncc2Br 207a_100020640021_100000211033 [0,2,0,0,0,0|2,0,0]=4 19485 B18R2.9237 Cc1ccc(cc1)CNCc2ccncc2Br 270004a_100000174908_100000755692 [0,2,0,0,0,0|2,0,0]=4 19486 B18R2.9237 Cc1ccc(cc1)CNCc2ccncc2Br 270004a_100020640021_100000211033 [0,2,0,0,0,0|2,0,0]=4 19487 B18R2.9237 Cc1ccc(cc1)CNCc2ccncc2C 207a_100000708811_100000211033 [0,2,0,0,0,0|2,0,0]=4 19488 B18R2.9237 Cc1ccc(cc1)CNCc2ccncc2C 2230a_100000174908_100020672808 [0,2,0,0,0,0|2,0,0]=4 19489 B18R2.9237 Cc1ccc(cc1)CNCc2ccncc2C 270004a_100000708811_100000211033 [0,2,0,0,0,0|2,0,0]=4 19490 B18R2.9237 Cc1ccc(cc1)CNCc2ccncc2C 34a_100000174908_100020672809 [0,2,0,0,0,0|2,0,0]=4 19491 B18R2.9237 Cc1ccc(cc1)CNCc2ccncc2Cl 207a_100000174908_100011934409 [0,2,0,0,0,0|2,0,0]=4 19492 B18R2.9237 Cc1ccc(cc1)CNCc2ccncc2Cl 2230a_100000174908_100000763264 [0,2,0,0,0,0|2,0,0]=4 19493 B18R2.9237 Cc1ccc(cc1)CNCc2ccncc2Cl 270004a_100000174908_100011934409 [0,2,0,0,0,0|2,0,0]=4 19494 B18R2.9237 Cc1ccc(cc1)CNCc2ccncc2F 207a_100011935246_100000211033 [0,2,0,0,0,0|2,0,0]=4 19495 B18R2.9237 Cc1ccc(cc1)CNCc2ccncc2F 270004a_100011935246_100000211033 [0,2,0,0,0,0|2,0,0]=4 19496 B18R2.9237 Cc1ccc(cc1)CNCc2ccncc2F 34a_100011935246_100000210814 [0,2,0,0,0,0|2,0,0]=4 19497 B18R2.9237 Cc1ccc(cc1)CNCc2cnccc2Br 270004a_100000174908_100009816821 [0,2,0,0,0,0|2,0,0]=4 19498 B18R2.9237 Cc1ccc(cc1)CNCc2cnccc2C 207a_100000174908_100000685662 [0,2,0,0,0,0|2,0,0]=4 19499 B18R2.9237 Cc1ccc(cc1)CNCc2cnccc2C 207a_100011997553_100000211033 [0,2,0,0,0,0|2,0,0]=4 19500 B18R2.9237 Cc1ccc(cc1)CNCc2cnccc2C 2230a_100000174908_100000690890 [0,2,0,0,0,0|2,0,0]=4 19501 B18R2.9237 Cc1ccc(cc1)CNCc2cnccc2C 270004a_100000174908_100000685662 [0,2,0,0,0,0|2,0,0]=4 19502 B18R2.9237 Cc1ccc(cc1)CNCc2cnccc2C 270004a_100011997553_100000211033 [0,2,0,0,0,0|2,0,0]=4 19503 B18R2.9237 Cc1ccc(cc1)CNCc2cnccc2C 34a_100000174908_100000690890 [0,2,0,0,0,0|2,0,0]=4 19504 B18R2.9237 Cc1ccc(cc1)CNCc2cnccc2Cl 270004a_100000174908_100000050567 [0,2,0,0,0,0|2,0,0]=4 19505 B18R2.9237 Cc1ccc(cc1)CNCc2ncccc2Br 207a_100000174908_100011934733 [0,2,0,0,0,0|2,0,0]=4 19506 B18R2.9237 Cc1ccc(cc1)CNCc2ncccc2Br 2230a_100000174908_100025702911 [0,2,0,0,0,0|2,0,0]=4 19507 B18R2.9237 Cc1ccc(cc1)CNCc2ncccc2Br 270004a_100000174908_100011934733 [0,2,0,0,0,0|2,0,0]=4 19508 B18R2.9237 Cc1ccc(cc1)CNCc2ncccc2Br 270004a_100020591323_100000211033 [0,2,0,0,0,0|2,0,0]=4 19509 B18R2.9237 Cc1ccc(cc1)CNCc2ncccc2Br 34a_100000174908_100025702911 [0,2,0,0,0,0|2,0,0]=4 19510 B18R2.9237 Cc1ccc(cc1)CNCc2ncccc2C 207a_100000174908_100000698913 [0,2,0,0,0,0|2,0,0]=4 19511 B18R2.9237 Cc1ccc(cc1)CNCc2ncccc2C 2230a_100000174908_100000696600 [0,2,0,0,0,0|2,0,0]=4 19512 B18R2.9237 Cc1ccc(cc1)CNCc2ncccc2C 270004a_100000174908_100000698913 [0,2,0,0,0,0|2,0,0]=4 19513 B18R2.9237 Cc1ccc(cc1)CNCc2ncccc2C 34a_100000174908_100000696600 [0,2,0,0,0,0|2,0,0]=4 19514 B18R2.9237 Cc1ccc(cc1)CNCc2ncccc2C 34a_100011223789_100000210814 [0,2,0,0,0,0|2,0,0]=4 19515 B18R2.9237 Cc1ccc(cc1)CNCc2ncccc2Cl 207a_100000174908_100012001307 [0,2,0,0,0,0|2,0,0]=4 19516 B18R2.9237 Cc1ccc(cc1)CNCc2ncccc2Cl 2230a_100000174908_100000099807 [0,2,0,0,0,0|2,0,0]=4 19517 B18R2.9237 Cc1ccc(cc1)CNCc2ncccc2Cl 2230a_100015189233_100000210814 [0,2,0,0,0,0|2,0,0]=4 19518 B18R2.9237 Cc1ccc(cc1)CNCc2ncccc2Cl 270004a_100000174908_100012001307 [0,2,0,0,0,0|2,0,0]=4 19519 B18R2.9237 Cc1ccc(cc1)CNCc2ncccc2Cl 270004a_100015189233_100000211033 [0,2,0,0,0,0|2,0,0]=4 19520 B18R2.9237 Cc1ccc(cc1)CNCc2ncccc2F 207a_100000174908_100011934734 [0,2,0,0,0,0|2,0,0]=4 19521 B18R2.9237 Cc1ccc(cc1)CNCc2ncccc2F 2230a_100000174908_100000104219 [0,2,0,0,0,0|2,0,0]=4 19522 B18R2.9237 Cc1ccc(cc1)CNCc2ncccc2F 270004a_100000174908_100011934734 [0,2,0,0,0,0|2,0,0]=4 19523 B18R2.9237 Cc1ccc(cc1)CNCc2ncccc2F 270004a_100000690088_100000211033 [0,2,0,0,0,0|2,0,0]=4 19524 B18R2.9237 Cc1ccc(cc1)CNCc2ncccc2F 34a_100000174908_100000104219 [0,2,0,0,0,0|2,0,0]=4 19525 B18R2.9237 Cc1ccc(cc1)CNCc2ncccc2F 34a_100000690088_100000210814 [0,2,0,0,0,0|2,0,0]=4 19526 B18R2.9237 Cc1ccc(cc1)CNCc2ncccc2O 34a_100000174908_200020655725 [0,2,0,0,0,0|2,0,0]=4 19527 B18R2.9237 Cc1ccc(cc1)COCc2ccccc2Br 34a_100000756307_100000210814 [0,2,0,0,0,0|0,0,0]=2 19528 B18R2.9237 Cc1ccc(cc1)COCc2ccccc2Br 34a_100011215236_100000184730 [0,2,0,0,0,0|0,0,0]=2 19529 B18R2.9237 Cc1ccc(cc1)COCc2ccccc2Br 7a_100000756307_100000210814 [0,2,0,0,0,0|0,0,0]=2 19530 B18R2.9237 Cc1ccc(cc1)COCc2ccccc2Br 7a_100011215236_100000184730 [0,2,0,0,0,0|0,0,0]=2 19531 B18R2.9237 Cc1ccc(cc1)COCc2ccccc2C 34a_100000698903_100000210814 [0,2,0,0,0,0|0,0,0]=2 19532 B18R2.9237 Cc1ccc(cc1)COCc2ccccc2C 34a_100011215236_100000211839 [0,2,0,0,0,0|0,0,0]=2 19533 B18R2.9237 Cc1ccc(cc1)COCc2ccccc2C 7a_100000698903_100000210814 [0,2,0,0,0,0|0,0,0]=2 19534 B18R2.9237 Cc1ccc(cc1)COCc2ccccc2C 7a_100011215236_100000211839 [0,2,0,0,0,0|0,0,0]=2 19535 B18R2.9237 Cc1ccc(cc1)COCc2ccccc2Cl 34a_100000210847_100000210814 [0,2,0,0,0,0|0,0,0]=2 19536 B18R2.9237 Cc1ccc(cc1)COCc2ccccc2Cl 34a_100011215236_100000187162 [0,2,0,0,0,0|0,0,0]=2 19537 B18R2.9237 Cc1ccc(cc1)COCc2ccccc2Cl 7a_100000210847_100000210814 [0,2,0,0,0,0|0,0,0]=2 19538 B18R2.9237 Cc1ccc(cc1)COCc2ccccc2Cl 7a_100011215236_100000187162 [0,2,0,0,0,0|0,0,0]=2 19539 B18R2.9237 Cc1ccc(cc1)COCc2ccccc2F 34a_100000211962_100000210814 [0,2,0,0,0,0|0,0,0]=2 19540 B18R2.9237 Cc1ccc(cc1)COCc2ccccc2F 34a_100011215236_100000211605 [0,2,0,0,0,0|0,0,0]=2 19541 B18R2.9237 Cc1ccc(cc1)COCc2ccccc2F 7a_100000211962_100000210814 [0,2,0,0,0,0|0,0,0]=2 19542 B18R2.9237 Cc1ccc(cc1)COCc2ccccc2F 7a_100011215236_100000211605 [0,2,0,0,0,0|0,0,0]=2 19543 B18R2.9237 Cc1ccc(cc1)COCc2ccccc2I 34a_100000187465_100000210814 [0,2,0,0,0,0|0,0,0]=2 19544 B18R2.9237 Cc1ccc(cc1)COCc2ccccc2I 34a_100011215236_100011215278 [0,2,0,0,0,0|0,0,0]=2 19545 B18R2.9237 Cc1ccc(cc1)COCc2ccccc2I 7a_100000187465_100000210814 [0,2,0,0,0,0|0,0,0]=2 19546 B18R2.9237 Cc1ccc(cc1)COCc2ccccc2I 7a_100011215236_100011215278 [0,2,0,0,0,0|0,0,0]=2 19547 B18R2.9237 Cc1ccc(cc1)COCc2ccccc2N 34a_100000212039_100000210814 [0,2,0,0,0,0|0,0,0]=2 19548 B18R2.9237 Cc1ccc(cc1)COCc2cccnc2Br 34a_100000719692_100000210814 [0,2,0,0,0,0|1,0,0]=3 19549 B18R2.9237 Cc1ccc(cc1)COCc2cccnc2Br 34a_100011215236_100010140945 [0,2,0,0,0,0|1,0,0]=3 19550 B18R2.9237 Cc1ccc(cc1)COCc2cccnc2Br 7a_100000719692_100000210814 [0,2,0,0,0,0|1,0,0]=3 19551 B18R2.9237 Cc1ccc(cc1)COCc2cccnc2Br 7a_100011215236_100010140945 [0,2,0,0,0,0|1,0,0]=3 19552 B18R2.9237 Cc1ccc(cc1)COCc2cccnc2C 34a_100000729262_100000210814 [0,2,0,0,0,0|1,0,0]=3 19553 B18R2.9237 Cc1ccc(cc1)COCc2cccnc2C 34a_100011215236_100000732876 [0,2,0,0,0,0|1,0,0]=3 19554 B18R2.9237 Cc1ccc(cc1)COCc2cccnc2C 7a_100000729262_100000210814 [0,2,0,0,0,0|1,0,0]=3 19555 B18R2.9237 Cc1ccc(cc1)COCc2cccnc2C 7a_100011215236_100000732876 [0,2,0,0,0,0|1,0,0]=3 19556 B18R2.9237 Cc1ccc(cc1)COCc2cccnc2Cl 34a_100000748726_100000210814 [0,2,0,0,0,0|1,0,0]=3 19557 B18R2.9237 Cc1ccc(cc1)COCc2cccnc2Cl 34a_100011215236_100000045678 [0,2,0,0,0,0|1,0,0]=3 19558 B18R2.9237 Cc1ccc(cc1)COCc2cccnc2Cl 7a_100000748726_100000210814 [0,2,0,0,0,0|1,0,0]=3 19559 B18R2.9237 Cc1ccc(cc1)COCc2cccnc2Cl 7a_100011215236_100000045678 [0,2,0,0,0,0|1,0,0]=3 19560 B18R2.9237 Cc1ccc(cc1)COCc2cccnc2F 34a_100000079888_100000210814 [0,2,0,0,0,0|1,0,0]=3 19561 B18R2.9237 Cc1ccc(cc1)COCc2cccnc2F 34a_100011215236_100000099810 [0,2,0,0,0,0|1,0,0]=3 19562 B18R2.9237 Cc1ccc(cc1)COCc2cccnc2F 7a_100000079888_100000210814 [0,2,0,0,0,0|1,0,0]=3 19563 B18R2.9237 Cc1ccc(cc1)COCc2cccnc2F 7a_100011215236_100000099810 [0,2,0,0,0,0|1,0,0]=3 19564 B18R2.9237 Cc1ccc(cc1)COCc2ccncc2C 34a_100011215236_100020672809 [0,2,0,0,0,0|1,0,0]=3 19565 B18R2.9237 Cc1ccc(cc1)COCc2ccncc2C 34a_100011997032_100000210814 [0,2,0,0,0,0|1,0,0]=3 19566 B18R2.9237 Cc1ccc(cc1)COCc2ccncc2C 7a_100011215236_100020672808 [0,2,0,0,0,0|1,0,0]=3 19567 B18R2.9237 Cc1ccc(cc1)COCc2ccncc2Cl 7a_100011215236_100000763264 [0,2,0,0,0,0|1,0,0]=3 19568 B18R2.9237 Cc1ccc(cc1)COCc2ccncc2F 34a_100012172863_100000210814 [0,2,0,0,0,0|1,0,0]=3 19569 B18R2.9237 Cc1ccc(cc1)COCc2cnccc2C 34a_100011215236_100000690890 [0,2,0,0,0,0|1,0,0]=3 19570 B18R2.9237 Cc1ccc(cc1)COCc2cnccc2C 34a_100011996381_100000210814 [0,2,0,0,0,0|1,0,0]=3 19571 B18R2.9237 Cc1ccc(cc1)COCc2cnccc2C 7a_100011215236_100000690890 [0,2,0,0,0,0|1,0,0]=3 19572 B18R2.9237 Cc1ccc(cc1)COCc2cnccc2Cl 34a_100000117392_100000210814 [0,2,0,0,0,0|1,0,0]=3 19573 B18R2.9237 Cc1ccc(cc1)COCc2ncccc2Br 34a_100011215236_100025702911 [0,2,0,0,0,0|1,0,0]=3 19574 B18R2.9237 Cc1ccc(cc1)COCc2ncccc2Br 34a_100011996772_100000210814 [0,2,0,0,0,0|1,0,0]=3 19575 B18R2.9237 Cc1ccc(cc1)COCc2ncccc2Br 7a_100011215236_100025702911 [0,2,0,0,0,0|1,0,0]=3 19576 B18R2.9237 Cc1ccc(cc1)COCc2ncccc2C 34a_100000698912_100000210814 [0,2,0,0,0,0|1,0,0]=3 19577 B18R2.9237 Cc1ccc(cc1)COCc2ncccc2C 34a_100011215236_100000696600 [0,2,0,0,0,0|1,0,0]=3 19578 B18R2.9237 Cc1ccc(cc1)COCc2ncccc2C 7a_100011215236_100000696600 [0,2,0,0,0,0|1,0,0]=3 19579 B18R2.9237 Cc1ccc(cc1)COCc2ncccc2Cl 34a_100012002383_100000210814 [0,2,0,0,0,0|1,0,0]=3 19580 B18R2.9237 Cc1ccc(cc1)COCc2ncccc2Cl 7a_100011215236_100000099807 [0,2,0,0,0,0|1,0,0]=3 19581 B18R2.9237 Cc1ccc(cc1)COCc2ncccc2F 34a_100011215236_100000104219 [0,2,0,0,0,0|1,0,0]=3 19582 B18R2.9237 Cc1ccc(cc1)COCc2ncccc2F 34a_100011934865_100000210814 [0,2,0,0,0,0|1,0,0]=3 19583 B18R2.9237 Cc1ccc(cc1)COCc2ncccc2F 7a_100011215236_100000104219 [0,2,0,0,0,0|1,0,0]=3 19584 B18R2.9237 Cc1ccc(cc1)COCc2ncccc2N 34a_114873767017_100000210814 [0,2,0,0,0,0|1,0,0]=3 19585 B18R2.9237 Cc1ccc(cc1)COCc2ncccc2O 34a_100011215236_200020655725 [0,2,0,0,0,0|1,0,0]=3 19586 B18R2.9237 Cc1ccc(cc1)COCc2ncccc2O 7a_100011215236_200020655725 [0,2,0,0,0,0|1,0,0]=3 19587 B18R2.9237 Cc1ccc(cc1)COCc2nccnc2Cl 34a_100000057004_100000210814 [0,2,0,0,0,0|2,0,0]=4 19588 B18R2.9237 Cc1ccc(cc1)CSCc2ccccc2Br 62a_100000184730_100000210814 [0,2,0,0,0,0|0,1,0]=3 19589 B18R2.9237 Cc1ccc(cc1)CSCc2ccccc2Br 62a_100000210814_100000184730 [0,2,0,0,0,0|0,1,0]=3 19590 B18R2.9237 Cc1ccc(cc1)CSCc2ccccc2C 62a_100000210814_100000211839 [0,2,0,0,0,0|0,1,0]=3 19591 B18R2.9237 Cc1ccc(cc1)CSCc2ccccc2C 62a_100000211839_100000210814 [0,2,0,0,0,0|0,1,0]=3 19592 B18R2.9237 Cc1ccc(cc1)CSCc2ccccc2Cl 62a_100000187162_100000210814 [0,2,0,0,0,0|0,1,0]=3 19593 B18R2.9237 Cc1ccc(cc1)CSCc2ccccc2Cl 62a_100000210814_100000187162 [0,2,0,0,0,0|0,1,0]=3 19594 B18R2.9237 Cc1ccc(cc1)CSCc2ccccc2F 62a_100000210814_100000211605 [0,2,0,0,0,0|0,1,0]=3 19595 B18R2.9237 Cc1ccc(cc1)CSCc2ccccc2F 62a_100000211605_100000210814 [0,2,0,0,0,0|0,1,0]=3 19596 B18R2.9237 Cc1ccc(cc1)CSCc2ccccc2I 62a_100000210814_100011216222 [0,2,0,0,0,0|0,1,0]=3 19597 B18R2.9237 Cc1ccc(cc1)CSCc2ccccc2I 62a_100011216222_100000210814 [0,2,0,0,0,0|0,1,0]=3 19598 B18R2.9237 Cc1ccc(cc1)CSCc2cccnc2Br 62a_100000210814_100010140945 [0,2,0,0,0,0|1,1,0]=4 19599 B18R2.9237 Cc1ccc(cc1)CSCc2cccnc2Br 62a_100010140945_100000210814 [0,2,0,0,0,0|1,1,0]=4 19600 B18R2.9237 Cc1ccc(cc1)CSCc2cccnc2C 62a_100000210814_100000732876 [0,2,0,0,0,0|1,1,0]=4 19601 B18R2.9237 Cc1ccc(cc1)CSCc2cccnc2C 62a_100000732876_100000210814 [0,2,0,0,0,0|1,1,0]=4 19602 B18R2.9237 Cc1ccc(cc1)CSCc2cccnc2Cl 62a_100000045678_100000210814 [0,2,0,0,0,0|1,1,0]=4 19603 B18R2.9237 Cc1ccc(cc1)CSCc2cccnc2Cl 62a_100000210814_100000045678 [0,2,0,0,0,0|1,1,0]=4 19604 B18R2.9237 Cc1ccc(cc1)CSCc2cccnc2F 62a_100000099810_100000210814 [0,2,0,0,0,0|1,1,0]=4 19605 B18R2.9237 Cc1ccc(cc1)CSCc2cccnc2F 62a_100000210814_100000099810 [0,2,0,0,0,0|1,1,0]=4 19606 B18R2.9237 Cc1ccc(cc1)CSCc2ccncc2C 62a_100000210814_100020672808 [0,2,0,0,0,0|1,1,0]=4 19607 B18R2.9237 Cc1ccc(cc1)CSCc2ccncc2C 62a_100020672808_100000210814 [0,2,0,0,0,0|1,1,0]=4 19608 B18R2.9237 Cc1ccc(cc1)CSCc2ccncc2Cl 62a_100000210814_100000763264 [0,2,0,0,0,0|1,1,0]=4 19609 B18R2.9237 Cc1ccc(cc1)CSCc2ccncc2Cl 62a_100000763264_100000210814 [0,2,0,0,0,0|1,1,0]=4 19610 B18R2.9237 Cc1ccc(cc1)CSCc2cnccc2C 62a_100000210814_100000690890 [0,2,0,0,0,0|1,1,0]=4 19611 B18R2.9237 Cc1ccc(cc1)CSCc2cnccc2C 62a_100000690890_100000210814 [0,2,0,0,0,0|1,1,0]=4 19612 B18R2.9237 Cc1ccc(cc1)CSCc2ncccc2Br 62a_100000210814_100025702911 [0,2,0,0,0,0|1,1,0]=4 19613 B18R2.9237 Cc1ccc(cc1)CSCc2ncccc2Br 62a_100025702911_100000210814 [0,2,0,0,0,0|1,1,0]=4 19614 B18R2.9237 Cc1ccc(cc1)CSCc2ncccc2C 62a_100000210814_100000696600 [0,2,0,0,0,0|1,1,0]=4 19615 B18R2.9237 Cc1ccc(cc1)CSCc2ncccc2C 62a_100000696600_100000210814 [0,2,0,0,0,0|1,1,0]=4 19616 B18R2.9237 Cc1ccc(cc1)CSCc2ncccc2Cl 62a_100000099807_100000210814 [0,2,0,0,0,0|1,1,0]=4 19617 B18R2.9237 Cc1ccc(cc1)CSCc2ncccc2Cl 62a_100000210814_100000099807 [0,2,0,0,0,0|1,1,0]=4 19618 B18R2.9237 Cc1ccc(cc1)CSCc2ncccc2F 62a_100000104219_100000210814 [0,2,0,0,0,0|1,1,0]=4 19619 B18R2.9237 Cc1ccc(cc1)CSCc2ncccc2F 62a_100000210814_100000104219 [0,2,0,0,0,0|1,1,0]=4 19620 B18R2.9237 Cc1ccc(cc1)CSCc2ncccc2O 62a_100000210814_200020655725 [0,2,0,0,0,0|1,1,0]=4 19621 B18R2.9237 Cc1ccc(cc1)CSCc2ncccc2O 62a_200020655725_100000210814 [0,2,0,0,0,0|1,1,0]=4 19622 B18R2.9237 Cc1ccc(cc1)NCCc2ccccc2Br 34a_100000124888_100012161201 [0,2,0,0,0,0|2,0,0]=4 19623 B18R2.9237 Cc1ccc(cc1)NCCc2ccccc2C 34a_100000124888_100011713688 [0,2,0,0,0,0|2,0,0]=4 19624 B18R2.9237 Cc1ccc(cc1)NCCc2ccccc2Cl 34a_100000124888_100011713703 [0,2,0,0,0,0|2,0,0]=4 19625 B18R2.9237 Cc1ccc(cc1)NCCc2ccccc2F 34a_100000124888_100000720011 [0,2,0,0,0,0|2,0,0]=4 19626 B18R2.9237 Cc1ccc(cc1)NCCc2ccccc2O 34a_100000124888_100000722297 [0,2,0,0,0,0|2,0,0]=4 19627 B18R2.9237 Cc1ccc(cc1)OCCc2ccccc2Br 34a_100000210336_100012161201 [0,2,0,0,0,0|2,0,0]=4 19628 B18R2.9237 Cc1ccc(cc1)OCCc2ccccc2Br 7a_100000210336_100012161201 [0,2,0,0,0,0|2,0,0]=4 19629 B18R2.9237 Cc1ccc(cc1)OCCc2ccccc2C 34a_100000210336_100011713688 [0,2,0,0,0,0|2,0,0]=4 19630 B18R2.9237 Cc1ccc(cc1)OCCc2ccccc2C 7a_100000210336_100011713688 [0,2,0,0,0,0|2,0,0]=4 19631 B18R2.9237 Cc1ccc(cc1)OCCc2ccccc2Cl 34a_100000210336_100011713703 [0,2,0,0,0,0|2,0,0]=4 19632 B18R2.9237 Cc1ccc(cc1)OCCc2ccccc2Cl 7a_100000210336_100011713703 [0,2,0,0,0,0|2,0,0]=4 19633 B18R2.9237 Cc1ccc(cc1)OCCc2ccccc2F 34a_100000210336_100000720011 [0,2,0,0,0,0|2,0,0]=4 19634 B18R2.9237 Cc1ccc(cc1)OCCc2ccccc2F 7a_100000210336_100000720011 [0,2,0,0,0,0|2,0,0]=4 19635 B18R2.9237 Cc1ccc(cc1)OCCc2ccccc2O 34a_100000210336_100000722297 [0,2,0,0,0,0|2,0,0]=4 19636 B18R2.9237 Cc1ccc(cc1)OCCc2ccccc2O 7a_100000210336_100000722297 [0,2,0,0,0,0|2,0,0]=4 19637 B18R2.9237 Cc1ccc(cc1)SCCc2ccccc2Br 62a_100000186775_100012161201 [0,2,0,0,0,0|2,0,0]=4 19638 B18R2.9237 Cc1ccc(cc1)SCCc2ccccc2Br 62a_100012161201_100000186775 [0,2,0,0,0,0|2,0,0]=4 19639 B18R2.9237 Cc1ccc(cc1)SCCc2ccccc2C 62a_100000186775_100011713688 [0,2,0,0,0,0|2,0,0]=4 19640 B18R2.9237 Cc1ccc(cc1)SCCc2ccccc2C 62a_100011713688_100000186775 [0,2,0,0,0,0|2,0,0]=4 19641 B18R2.9237 Cc1ccc(cc1)SCCc2ccccc2Cl 62a_100000186775_100011713703 [0,2,0,0,0,0|2,0,0]=4 19642 B18R2.9237 Cc1ccc(cc1)SCCc2ccccc2Cl 62a_100011713703_100000186775 [0,2,0,0,0,0|2,0,0]=4 19643 B18R2.9237 Cc1ccc(cc1)SCCc2ccccc2F 62a_100000186775_100011713696 [0,2,0,0,0,0|2,0,0]=4 19644 B18R2.9237 Cc1ccc(cc1)SCCc2ccccc2F 62a_100011713696_100000186775 [0,2,0,0,0,0|2,0,0]=4 19645 B18R2.9237 Cc1ccc(cc1)SCCc2ccccc2O 62a_100000186775_100000722297 [0,2,0,0,0,0|2,0,0]=4 19646 B18R2.9237 Cc1ccc(cc1)SCCc2ccccc2O 62a_100000722297_100000186775 [0,2,0,0,0,0|2,0,0]=4 19647 B18R2.9237 Cc1ccc(cn1)CNCc2ccccc2Br 207a_100000740942_100000211189 [0,2,0,0,0,0|2,0,0]=4 19648 B18R2.9237 Cc1ccc(cn1)CNCc2ccccc2Br 2230a_100000689332_100016987292 [0,2,0,0,0,0|2,0,0]=4 19649 B18R2.9237 Cc1ccc(cn1)CNCc2ccccc2Br 270004a_100000689332_100000743784 [0,2,0,0,0,0|2,0,0]=4 19650 B18R2.9237 Cc1ccc(cn1)CNCc2ccccc2Br 270004a_100000740942_100000211189 [0,2,0,0,0,0|2,0,0]=4 19651 B18R2.9237 Cc1ccc(cn1)CNCc2ccccc2Br 34a_100000689332_100016987292 [0,2,0,0,0,0|2,0,0]=4 19652 B18R2.9237 Cc1ccc(cn1)CNCc2ccccc2Br 34a_100000740942_100000184730 [0,2,0,0,0,0|2,0,0]=4 19653 B18R2.9237 Cc1ccc(cn1)CNCc2ccccc2C 207a_100000740942_100000211143 [0,2,0,0,0,0|2,0,0]=4 19654 B18R2.9237 Cc1ccc(cn1)CNCc2ccccc2C 270004a_100000174972_100000743784 [0,2,0,0,0,0|2,0,0]=4 19655 B18R2.9237 Cc1ccc(cn1)CNCc2ccccc2C 270004a_100000740942_100000211143 [0,2,0,0,0,0|2,0,0]=4 19656 B18R2.9237 Cc1ccc(cn1)CNCc2ccccc2C 34a_100000174972_100016987292 [0,2,0,0,0,0|2,0,0]=4 19657 B18R2.9237 Cc1ccc(cn1)CNCc2ccccc2C 34a_100000740942_100000211839 [0,2,0,0,0,0|2,0,0]=4 19658 B18R2.9237 Cc1ccc(cn1)CNCc2ccccc2Cl 207a_100000740942_100000210073 [0,2,0,0,0,0|2,0,0]=4 19659 B18R2.9237 Cc1ccc(cn1)CNCc2ccccc2Cl 2230a_100000174879_100016987292 [0,2,0,0,0,0|2,0,0]=4 19660 B18R2.9237 Cc1ccc(cn1)CNCc2ccccc2Cl 270004a_100000174879_100000743784 [0,2,0,0,0,0|2,0,0]=4 19661 B18R2.9237 Cc1ccc(cn1)CNCc2ccccc2Cl 270004a_100000740942_100000210073 [0,2,0,0,0,0|2,0,0]=4 19662 B18R2.9237 Cc1ccc(cn1)CNCc2ccccc2Cl 34a_100000174879_100016987292 [0,2,0,0,0,0|2,0,0]=4 19663 B18R2.9237 Cc1ccc(cn1)CNCc2ccccc2Cl 34a_100000740942_100000187162 [0,2,0,0,0,0|2,0,0]=4 19664 B18R2.9237 Cc1ccc(cn1)CNCc2ccccc2F 207a_100000740942_100000210811 [0,2,0,0,0,0|2,0,0]=4 19665 B18R2.9237 Cc1ccc(cn1)CNCc2ccccc2F 270004a_100000174869_100000743784 [0,2,0,0,0,0|2,0,0]=4 19666 B18R2.9237 Cc1ccc(cn1)CNCc2ccccc2F 270004a_100000740942_100000210811 [0,2,0,0,0,0|2,0,0]=4 19667 B18R2.9237 Cc1ccc(cn1)CNCc2ccccc2F 34a_100000174869_100016987292 [0,2,0,0,0,0|2,0,0]=4 19668 B18R2.9237 Cc1ccc(cn1)CNCc2ccccc2F 34a_100000740942_100000211605 [0,2,0,0,0,0|2,0,0]=4 19669 B18R2.9237 Cc1ccc(cn1)CNCc2ccccc2I 207a_100000740942_100000010305 [0,2,0,0,0,0|2,0,0]=4 19670 B18R2.9237 Cc1ccc(cn1)CNCc2ccccc2I 270004a_100000740942_100000010305 [0,2,0,0,0,0|2,0,0]=4 19671 B18R2.9237 Cc1ccc(cn1)CNCc2ccccc2I 270004a_100015347259_100000743784 [0,2,0,0,0,0|2,0,0]=4 19672 B18R2.9237 Cc1ccc(cn1)CNCc2ccccc2I 34a_100000740942_100011215278 [0,2,0,0,0,0|2,0,0]=4 19673 B18R2.9237 Cc1ccc(cn1)CNCc2ccccc2O 270004a_100000185550_100000743784 [0,2,0,0,0,0|2,0,0]=4 19674 B18R2.9237 Cc1ccc(cn1)CNCc2ccccc2O 34a_100000185550_100016987292 [0,2,0,0,0,0|2,0,0]=4 19675 B18R2.9237 Cc1ccc(cn1)COCc2ccccc2Br 34a_100000756307_100016987292 [0,2,0,0,0,0|1,0,0]=3 19676 B18R2.9237 Cc1ccc(cn1)COCc2ccccc2Br 34a_100011248133_100000184730 [0,2,0,0,0,0|1,0,0]=3 19677 B18R2.9237 Cc1ccc(cn1)COCc2ccccc2Br 7a_100000756307_100016987292 [0,2,0,0,0,0|1,0,0]=3 19678 B18R2.9237 Cc1ccc(cn1)COCc2ccccc2C 34a_100000698903_100016987292 [0,2,0,0,0,0|1,0,0]=3 19679 B18R2.9237 Cc1ccc(cn1)COCc2ccccc2C 34a_100011248133_100000211839 [0,2,0,0,0,0|1,0,0]=3 19680 B18R2.9237 Cc1ccc(cn1)COCc2ccccc2C 7a_100000698903_100016987292 [0,2,0,0,0,0|1,0,0]=3 19681 B18R2.9237 Cc1ccc(cn1)COCc2ccccc2Cl 34a_100000210847_100016987292 [0,2,0,0,0,0|1,0,0]=3 19682 B18R2.9237 Cc1ccc(cn1)COCc2ccccc2Cl 34a_100011248133_100000187162 [0,2,0,0,0,0|1,0,0]=3 19683 B18R2.9237 Cc1ccc(cn1)COCc2ccccc2Cl 7a_100000210847_100016987292 [0,2,0,0,0,0|1,0,0]=3 19684 B18R2.9237 Cc1ccc(cn1)COCc2ccccc2F 34a_100000211962_100016987292 [0,2,0,0,0,0|1,0,0]=3 19685 B18R2.9237 Cc1ccc(cn1)COCc2ccccc2F 34a_100011248133_100000211605 [0,2,0,0,0,0|1,0,0]=3 19686 B18R2.9237 Cc1ccc(cn1)COCc2ccccc2F 7a_100000211962_100016987292 [0,2,0,0,0,0|1,0,0]=3 19687 B18R2.9237 Cc1ccc(cn1)COCc2ccccc2I 34a_100000187465_100016987292 [0,2,0,0,0,0|1,0,0]=3 19688 B18R2.9237 Cc1ccc(cn1)COCc2ccccc2I 34a_100011248133_100011215278 [0,2,0,0,0,0|1,0,0]=3 19689 B18R2.9237 Cc1ccc(cn1)COCc2ccccc2I 7a_100000187465_100016987292 [0,2,0,0,0,0|1,0,0]=3 19690 B18R2.9237 Cc1ccc(cn1)COCc2ccccc2N 34a_100000212039_100016987292 [0,2,0,0,0,0|1,0,0]=3 19691 B18R2.9237 Cc1ccc(cn1)COCc2cccnc2Br 34a_100000719692_100016987292 [0,2,0,0,0,0|2,0,0]=4 19692 B18R2.9237 Cc1ccc(cn1)COCc2cccnc2Br 34a_100011248133_100010140945 [0,2,0,0,0,0|2,0,0]=4 19693 B18R2.9237 Cc1ccc(cn1)COCc2cccnc2Br 7a_100000719692_100016987292 [0,2,0,0,0,0|2,0,0]=4 19694 B18R2.9237 Cc1ccc(cn1)COCc2cccnc2C 34a_100000729262_100016987292 [0,2,0,0,0,0|2,0,0]=4 19695 B18R2.9237 Cc1ccc(cn1)COCc2cccnc2C 34a_100011248133_100000732876 [0,2,0,0,0,0|2,0,0]=4 19696 B18R2.9237 Cc1ccc(cn1)COCc2cccnc2C 7a_100000729262_100016987292 [0,2,0,0,0,0|2,0,0]=4 19697 B18R2.9237 Cc1ccc(cn1)COCc2cccnc2Cl 34a_100000748726_100016987292 [0,2,0,0,0,0|2,0,0]=4 19698 B18R2.9237 Cc1ccc(cn1)COCc2cccnc2Cl 34a_100011248133_100000045678 [0,2,0,0,0,0|2,0,0]=4 19699 B18R2.9237 Cc1ccc(cn1)COCc2cccnc2Cl 7a_100000748726_100016987292 [0,2,0,0,0,0|2,0,0]=4 19700 B18R2.9237 Cc1ccc(cn1)COCc2cccnc2F 34a_100000079888_100016987292 [0,2,0,0,0,0|2,0,0]=4 19701 B18R2.9237 Cc1ccc(cn1)COCc2cccnc2F 34a_100011248133_100000099810 [0,2,0,0,0,0|2,0,0]=4 19702 B18R2.9237 Cc1ccc(cn1)COCc2cccnc2F 7a_100000079888_100016987292 [0,2,0,0,0,0|2,0,0]=4 19703 B18R2.9237 Cc1ccc(cn1)COCc2ccncc2C 34a_100011248133_100020672809 [0,2,0,0,0,0|2,0,0]=4 19704 B18R2.9237 Cc1ccc(cn1)COCc2ccncc2C 34a_100011997032_100016987292 [0,2,0,0,0,0|2,0,0]=4 19705 B18R2.9237 Cc1ccc(cn1)COCc2ccncc2F 34a_100012172863_100016987292 [0,2,0,0,0,0|2,0,0]=4 19706 B18R2.9237 Cc1ccc(cn1)COCc2cnccc2C 34a_100011248133_100000690890 [0,2,0,0,0,0|2,0,0]=4 19707 B18R2.9237 Cc1ccc(cn1)COCc2cnccc2C 34a_100011996381_100016987292 [0,2,0,0,0,0|2,0,0]=4 19708 B18R2.9237 Cc1ccc(cn1)COCc2cnccc2Cl 34a_100000117392_100016987292 [0,2,0,0,0,0|2,0,0]=4 19709 B18R2.9237 Cc1ccc(cn1)COCc2ncccc2Br 34a_100011248133_100025702911 [0,2,0,0,0,0|2,0,0]=4 19710 B18R2.9237 Cc1ccc(cn1)COCc2ncccc2Br 34a_100011996772_100016987292 [0,2,0,0,0,0|2,0,0]=4 19711 B18R2.9237 Cc1ccc(cn1)COCc2ncccc2C 34a_100000698912_100016987292 [0,2,0,0,0,0|2,0,0]=4 19712 B18R2.9237 Cc1ccc(cn1)COCc2ncccc2C 34a_100011248133_100000696600 [0,2,0,0,0,0|2,0,0]=4 19713 B18R2.9237 Cc1ccc(cn1)COCc2ncccc2Cl 34a_100012002383_100016987292 [0,2,0,0,0,0|2,0,0]=4 19714 B18R2.9237 Cc1ccc(cn1)COCc2ncccc2F 34a_100011248133_100000104219 [0,2,0,0,0,0|2,0,0]=4 19715 B18R2.9237 Cc1ccc(cn1)COCc2ncccc2F 34a_100011934865_100016987292 [0,2,0,0,0,0|2,0,0]=4 19716 B18R2.9237 Cc1ccc(cn1)COCc2ncccc2N 34a_114873767017_100016987292 [0,2,0,0,0,0|2,0,0]=4 19717 B18R2.9237 Cc1ccc(cn1)COCc2ncccc2O 34a_100011248133_200020655725 [0,2,0,0,0,0|2,0,0]=4 19718 B18R2.9237 Cc1ccc(cn1)CSCc2ccccc2Br 62a_100000184730_100016987292 [0,2,0,0,0,0|1,1,0]=4 19719 B18R2.9237 Cc1ccc(cn1)CSCc2ccccc2Br 62a_100016987292_100000184730 [0,2,0,0,0,0|1,1,0]=4 19720 B18R2.9237 Cc1ccc(cn1)CSCc2ccccc2C 62a_100000211839_100016987292 [0,2,0,0,0,0|1,1,0]=4 19721 B18R2.9237 Cc1ccc(cn1)CSCc2ccccc2C 62a_100016987292_100000211839 [0,2,0,0,0,0|1,1,0]=4 19722 B18R2.9237 Cc1ccc(cn1)CSCc2ccccc2Cl 62a_100000187162_100016987292 [0,2,0,0,0,0|1,1,0]=4 19723 B18R2.9237 Cc1ccc(cn1)CSCc2ccccc2Cl 62a_100016987292_100000187162 [0,2,0,0,0,0|1,1,0]=4 19724 B18R2.9237 Cc1ccc(cn1)CSCc2ccccc2F 62a_100000211605_100016987292 [0,2,0,0,0,0|1,1,0]=4 19725 B18R2.9237 Cc1ccc(cn1)CSCc2ccccc2F 62a_100016987292_100000211605 [0,2,0,0,0,0|1,1,0]=4 19726 B18R2.9237 Cc1ccc(cn1)CSCc2ccccc2I 62a_100011216222_100016987292 [0,2,0,0,0,0|1,1,0]=4 19727 B18R2.9237 Cc1ccc(cn1)CSCc2ccccc2I 62a_100016987292_100011216222 [0,2,0,0,0,0|1,1,0]=4 19728 B18R2.9237 Cc1ccc(nc1)CNCc2ccccc2Br 207a_100000689332_100000050478 [0,2,0,0,0,0|2,0,0]=4 19729 B18R2.9237 Cc1ccc(nc1)CNCc2ccccc2Br 2230a_100000689332_100000691093 [0,2,0,0,0,0|2,0,0]=4 19730 B18R2.9237 Cc1ccc(nc1)CNCc2ccccc2Br 270004a_100000689332_100000050478 [0,2,0,0,0,0|2,0,0]=4 19731 B18R2.9237 Cc1ccc(nc1)CNCc2ccccc2Br 34a_100000689332_100000691093 [0,2,0,0,0,0|2,0,0]=4 19732 B18R2.9237 Cc1ccc(nc1)CNCc2ccccc2Br 34a_100015187455_100000184730 [0,2,0,0,0,0|2,0,0]=4 19733 B18R2.9237 Cc1ccc(nc1)CNCc2ccccc2C 207a_100000174972_100000050478 [0,2,0,0,0,0|2,0,0]=4 19734 B18R2.9237 Cc1ccc(nc1)CNCc2ccccc2C 270004a_100000174972_100000050478 [0,2,0,0,0,0|2,0,0]=4 19735 B18R2.9237 Cc1ccc(nc1)CNCc2ccccc2C 34a_100000174972_100000691093 [0,2,0,0,0,0|2,0,0]=4 19736 B18R2.9237 Cc1ccc(nc1)CNCc2ccccc2C 34a_100015187455_100000211839 [0,2,0,0,0,0|2,0,0]=4 19737 B18R2.9237 Cc1ccc(nc1)CNCc2ccccc2Cl 207a_100000174879_100000050478 [0,2,0,0,0,0|2,0,0]=4 19738 B18R2.9237 Cc1ccc(nc1)CNCc2ccccc2Cl 2230a_100000174879_100000691093 [0,2,0,0,0,0|2,0,0]=4 19739 B18R2.9237 Cc1ccc(nc1)CNCc2ccccc2Cl 270004a_100000174879_100000050478 [0,2,0,0,0,0|2,0,0]=4 19740 B18R2.9237 Cc1ccc(nc1)CNCc2ccccc2Cl 34a_100000174879_100000691093 [0,2,0,0,0,0|2,0,0]=4 19741 B18R2.9237 Cc1ccc(nc1)CNCc2ccccc2Cl 34a_100015187455_100000187162 [0,2,0,0,0,0|2,0,0]=4 19742 B18R2.9237 Cc1ccc(nc1)CNCc2ccccc2F 207a_100000174869_100000050478 [0,2,0,0,0,0|2,0,0]=4 19743 B18R2.9237 Cc1ccc(nc1)CNCc2ccccc2F 270004a_100000174869_100000050478 [0,2,0,0,0,0|2,0,0]=4 19744 B18R2.9237 Cc1ccc(nc1)CNCc2ccccc2F 34a_100000174869_100000691093 [0,2,0,0,0,0|2,0,0]=4 19745 B18R2.9237 Cc1ccc(nc1)CNCc2ccccc2F 34a_100015187455_100000211605 [0,2,0,0,0,0|2,0,0]=4 19746 B18R2.9237 Cc1ccc(nc1)CNCc2ccccc2I 207a_100015347259_100000050478 [0,2,0,0,0,0|2,0,0]=4 19747 B18R2.9237 Cc1ccc(nc1)CNCc2ccccc2I 270004a_100015347259_100000050478 [0,2,0,0,0,0|2,0,0]=4 19748 B18R2.9237 Cc1ccc(nc1)CNCc2ccccc2I 34a_100015187455_100011215278 [0,2,0,0,0,0|2,0,0]=4 19749 B18R2.9237 Cc1ccc(nc1)CNCc2ccccc2O 207a_100000185550_100000050478 [0,2,0,0,0,0|2,0,0]=4 19750 B18R2.9237 Cc1ccc(nc1)CNCc2ccccc2O 270004a_100000185550_100000050478 [0,2,0,0,0,0|2,0,0]=4 19751 B18R2.9237 Cc1ccc(nc1)CNCc2ccccc2O 34a_100000185550_100000691093 [0,2,0,0,0,0|2,0,0]=4 19752 B18R2.9237 Cc1ccc(nc1)COCc2ccccc2Br 34a_100000756307_100000691093 [0,2,0,0,0,0|1,0,0]=3 19753 B18R2.9237 Cc1ccc(nc1)COCc2ccccc2Br 34a_100012001401_100000184730 [0,2,0,0,0,0|1,0,0]=3 19754 B18R2.9237 Cc1ccc(nc1)COCc2ccccc2Br 7a_100000756307_100000691093 [0,2,0,0,0,0|1,0,0]=3 19755 B18R2.9237 Cc1ccc(nc1)COCc2ccccc2C 34a_100000698903_100000691093 [0,2,0,0,0,0|1,0,0]=3 19756 B18R2.9237 Cc1ccc(nc1)COCc2ccccc2C 34a_100012001401_100000211839 [0,2,0,0,0,0|1,0,0]=3 19757 B18R2.9237 Cc1ccc(nc1)COCc2ccccc2C 7a_100000698903_100000691093 [0,2,0,0,0,0|1,0,0]=3 19758 B18R2.9237 Cc1ccc(nc1)COCc2ccccc2Cl 34a_100000210847_100000691093 [0,2,0,0,0,0|1,0,0]=3 19759 B18R2.9237 Cc1ccc(nc1)COCc2ccccc2Cl 34a_100012001401_100000187162 [0,2,0,0,0,0|1,0,0]=3 19760 B18R2.9237 Cc1ccc(nc1)COCc2ccccc2Cl 7a_100000210847_100000691093 [0,2,0,0,0,0|1,0,0]=3 19761 B18R2.9237 Cc1ccc(nc1)COCc2ccccc2F 34a_100000211962_100000691093 [0,2,0,0,0,0|1,0,0]=3 19762 B18R2.9237 Cc1ccc(nc1)COCc2ccccc2F 34a_100012001401_100000211605 [0,2,0,0,0,0|1,0,0]=3 19763 B18R2.9237 Cc1ccc(nc1)COCc2ccccc2F 7a_100000211962_100000691093 [0,2,0,0,0,0|1,0,0]=3 19764 B18R2.9237 Cc1ccc(nc1)COCc2ccccc2I 34a_100000187465_100000691093 [0,2,0,0,0,0|1,0,0]=3 19765 B18R2.9237 Cc1ccc(nc1)COCc2ccccc2I 34a_100012001401_100011215278 [0,2,0,0,0,0|1,0,0]=3 19766 B18R2.9237 Cc1ccc(nc1)COCc2ccccc2I 7a_100000187465_100000691093 [0,2,0,0,0,0|1,0,0]=3 19767 B18R2.9237 Cc1ccc(nc1)COCc2ccccc2N 34a_100000212039_100000691093 [0,2,0,0,0,0|1,0,0]=3 19768 B18R2.9237 Cc1ccc(nc1)COCc2cccnc2Br 34a_100000719692_100000691093 [0,2,0,0,0,0|2,0,0]=4 19769 B18R2.9237 Cc1ccc(nc1)COCc2cccnc2Br 34a_100012001401_100010140945 [0,2,0,0,0,0|2,0,0]=4 19770 B18R2.9237 Cc1ccc(nc1)COCc2cccnc2Br 7a_100000719692_100000691093 [0,2,0,0,0,0|2,0,0]=4 19771 B18R2.9237 Cc1ccc(nc1)COCc2cccnc2C 34a_100000729262_100000691093 [0,2,0,0,0,0|2,0,0]=4 19772 B18R2.9237 Cc1ccc(nc1)COCc2cccnc2C 34a_100012001401_100000732876 [0,2,0,0,0,0|2,0,0]=4 19773 B18R2.9237 Cc1ccc(nc1)COCc2cccnc2C 7a_100000729262_100000691093 [0,2,0,0,0,0|2,0,0]=4 19774 B18R2.9237 Cc1ccc(nc1)COCc2cccnc2Cl 34a_100000748726_100000691093 [0,2,0,0,0,0|2,0,0]=4 19775 B18R2.9237 Cc1ccc(nc1)COCc2cccnc2Cl 34a_100012001401_100000045678 [0,2,0,0,0,0|2,0,0]=4 19776 B18R2.9237 Cc1ccc(nc1)COCc2cccnc2Cl 7a_100000748726_100000691093 [0,2,0,0,0,0|2,0,0]=4 19777 B18R2.9237 Cc1ccc(nc1)COCc2cccnc2F 34a_100000079888_100000691093 [0,2,0,0,0,0|2,0,0]=4 19778 B18R2.9237 Cc1ccc(nc1)COCc2cccnc2F 34a_100012001401_100000099810 [0,2,0,0,0,0|2,0,0]=4 19779 B18R2.9237 Cc1ccc(nc1)COCc2cccnc2F 7a_100000079888_100000691093 [0,2,0,0,0,0|2,0,0]=4 19780 B18R2.9237 Cc1ccc(nc1)COCc2ccncc2C 34a_100011997032_100000691093 [0,2,0,0,0,0|2,0,0]=4 19781 B18R2.9237 Cc1ccc(nc1)COCc2ccncc2C 34a_100012001401_100020672809 [0,2,0,0,0,0|2,0,0]=4 19782 B18R2.9237 Cc1ccc(nc1)COCc2ccncc2F 34a_100012172863_100000691093 [0,2,0,0,0,0|2,0,0]=4 19783 B18R2.9237 Cc1ccc(nc1)COCc2cnccc2C 34a_100011996381_100000691093 [0,2,0,0,0,0|2,0,0]=4 19784 B18R2.9237 Cc1ccc(nc1)COCc2cnccc2C 34a_100012001401_100000690890 [0,2,0,0,0,0|2,0,0]=4 19785 B18R2.9237 Cc1ccc(nc1)COCc2cnccc2Cl 34a_100000117392_100000691093 [0,2,0,0,0,0|2,0,0]=4 19786 B18R2.9237 Cc1ccc(nc1)COCc2ncccc2Br 34a_100011996772_100000691093 [0,2,0,0,0,0|2,0,0]=4 19787 B18R2.9237 Cc1ccc(nc1)COCc2ncccc2Br 34a_100012001401_100025702911 [0,2,0,0,0,0|2,0,0]=4 19788 B18R2.9237 Cc1ccc(nc1)COCc2ncccc2C 34a_100000698912_100000691093 [0,2,0,0,0,0|2,0,0]=4 19789 B18R2.9237 Cc1ccc(nc1)COCc2ncccc2C 34a_100012001401_100000696600 [0,2,0,0,0,0|2,0,0]=4 19790 B18R2.9237 Cc1ccc(nc1)COCc2ncccc2Cl 34a_100012002383_100000691093 [0,2,0,0,0,0|2,0,0]=4 19791 B18R2.9237 Cc1ccc(nc1)COCc2ncccc2F 34a_100011934865_100000691093 [0,2,0,0,0,0|2,0,0]=4 19792 B18R2.9237 Cc1ccc(nc1)COCc2ncccc2F 34a_100012001401_100000104219 [0,2,0,0,0,0|2,0,0]=4 19793 B18R2.9237 Cc1ccc(nc1)COCc2ncccc2N 34a_114873767017_100000691093 [0,2,0,0,0,0|2,0,0]=4 19794 B18R2.9237 Cc1ccc(nc1)COCc2ncccc2O 34a_100012001401_200020655725 [0,2,0,0,0,0|2,0,0]=4 19795 B18R2.9237 Cc1ccc(nc1)CSCc2ccccc2Br 62a_100000184730_100000691093 [0,2,0,0,0,0|1,1,0]=4 19796 B18R2.9237 Cc1ccc(nc1)CSCc2ccccc2Br 62a_100000691093_100000184730 [0,2,0,0,0,0|1,1,0]=4 19797 B18R2.9237 Cc1ccc(nc1)CSCc2ccccc2C 62a_100000211839_100000691093 [0,2,0,0,0,0|1,1,0]=4 19798 B18R2.9237 Cc1ccc(nc1)CSCc2ccccc2C 62a_100000691093_100000211839 [0,2,0,0,0,0|1,1,0]=4 19799 B18R2.9237 Cc1ccc(nc1)CSCc2ccccc2Cl 62a_100000187162_100000691093 [0,2,0,0,0,0|1,1,0]=4 19800 B18R2.9237 Cc1ccc(nc1)CSCc2ccccc2Cl 62a_100000691093_100000187162 [0,2,0,0,0,0|1,1,0]=4 19801 B18R2.9237 Cc1ccc(nc1)CSCc2ccccc2F 62a_100000211605_100000691093 [0,2,0,0,0,0|1,1,0]=4 19802 B18R2.9237 Cc1ccc(nc1)CSCc2ccccc2F 62a_100000691093_100000211605 [0,2,0,0,0,0|1,1,0]=4 19803 B18R2.9237 Cc1ccc(nc1)CSCc2ccccc2I 62a_100000691093_100011216222 [0,2,0,0,0,0|1,1,0]=4 19804 B18R2.9237 Cc1ccc(nc1)CSCc2ccccc2I 62a_100011216222_100000691093 [0,2,0,0,0,0|1,1,0]=4 19805 B18R2.9237 Cc1ccccc1CCNc2ccc(cc2)Br 2230a_100000210018_100011713688 [0,2,0,0,0,0|2,0,0]=4 19806 B18R2.9237 Cc1ccccc1CCNc2ccc(cc2)Br 34a_100000210018_100011713688 [0,2,0,0,0,0|2,0,0]=4 19807 B18R2.9237 Cc1ccccc1CCNc2ccc(cc2)Cl 2230a_100000210052_100011713688 [0,2,0,0,0,0|2,0,0]=4 19808 B18R2.9237 Cc1ccccc1CCNc2ccc(cc2)Cl 34a_100000210052_100011713688 [0,2,0,0,0,0|2,0,0]=4 19809 B18R2.9237 Cc1ccccc1CCNc2ccc(cc2)F 34a_100000185862_100011713688 [0,2,0,0,0,0|2,0,0]=4 19810 B18R2.9237 Cc1ccccc1CCNc2ccc(cc2)I 34a_100000185761_100011713688 [0,2,0,0,0,0|2,0,0]=4 19811 B18R2.9237 Cc1ccccc1CCNc2ccc(cc2)O 34a_100000185829_100011713688 [0,2,0,0,0,0|2,0,0]=4 19812 B18R2.9237 Cc1ccccc1CCOc2ccc(cc2)Br 34a_100000185759_100011713688 [0,2,0,0,0,0|2,0,0]=4 19813 B18R2.9237 Cc1ccccc1CCOc2ccc(cc2)Br 7a_100000185759_100011713688 [0,2,0,0,0,0|2,0,0]=4 19814 B18R2.9237 Cc1ccccc1CCOc2ccc(cc2)Cl 34a_100000210216_100011713688 [0,2,0,0,0,0|2,0,0]=4 19815 B18R2.9237 Cc1ccccc1CCOc2ccc(cc2)Cl 7a_100000210216_100011713688 [0,2,0,0,0,0|2,0,0]=4 19816 B18R2.9237 Cc1ccccc1CCOc2ccc(cc2)F 34a_100000210339_100011713688 [0,2,0,0,0,0|2,0,0]=4 19817 B18R2.9237 Cc1ccccc1CCOc2ccc(cc2)I 34a_100000212066_100011713688 [0,2,0,0,0,0|2,0,0]=4 19818 B18R2.9237 Cc1ccccc1CCOc2ccc(cc2)I 7a_100000212066_100011713688 [0,2,0,0,0,0|2,0,0]=4 19819 B18R2.9237 Cc1ccccc1CCOc2ccc(cc2)N 34a_100000185829_100011713688 [0,2,0,0,0,0|2,0,0]=4 19820 B18R2.9237 Cc1ccccc1CCSc2ccc(cc2)Br 62a_100000752885_100011713688 [0,2,0,0,0,0|2,0,0]=4 19821 B18R2.9237 Cc1ccccc1CCSc2ccc(cc2)Br 62a_100011713688_100000752885 [0,2,0,0,0,0|2,0,0]=4 19822 B18R2.9237 Cc1ccccc1CCSc2ccc(cc2)Cl 62a_100000755918_100011713688 [0,2,0,0,0,0|2,0,0]=4 19823 B18R2.9237 Cc1ccccc1CCSc2ccc(cc2)Cl 62a_100011713688_100000755918 [0,2,0,0,0,0|2,0,0]=4 19824 B18R2.9237 Cc1ccccc1CCSc2ccc(cc2)F 62a_100000211213_100011713688 [0,2,0,0,0,0|2,0,0]=4 19825 B18R2.9237 Cc1ccccc1CCSc2ccc(cc2)F 62a_100011713688_100000211213 [0,2,0,0,0,0|2,0,0]=4 19826 B18R2.9237 Cc1ccccc1CCSc2ccc(cc2)N 62a_100000185761_100011713688 [0,2,0,0,0,0|2,0,0]=4 19827 B18R2.9237 Cc1ccccc1CCSc2ccc(cc2)N 62a_100011713688_100000185761 [0,2,0,0,0,0|2,0,0]=4 19828 B18R2.9237 Cc1ccccc1CCSc2ccc(cc2)O 62a_100011713688_100000185759 [0,2,0,0,0,0|2,0,0]=4 19829 B18R2.9237 Cc1ccccc1CNCc2ccc(cc2)Br 207a_100000174875_100000211143 [0,2,0,0,0,0|1,0,0]=3 19830 B18R2.9237 Cc1ccccc1CNCc2ccc(cc2)Br 207a_100000174972_100000186029 [0,2,0,0,0,0|1,0,0]=3 19831 B18R2.9237 Cc1ccccc1CNCc2ccc(cc2)Br 2230a_100000174875_100000211839 [0,2,0,0,0,0|1,0,0]=3 19832 B18R2.9237 Cc1ccccc1CNCc2ccc(cc2)Br 270004a_100000174875_100000211143 [0,2,0,0,0,0|1,0,0]=3 19833 B18R2.9237 Cc1ccccc1CNCc2ccc(cc2)Br 270004a_100000174972_100000186029 [0,2,0,0,0,0|1,0,0]=3 19834 B18R2.9237 Cc1ccccc1CNCc2ccc(cc2)Br 34a_100000174875_100000211839 [0,2,0,0,0,0|1,0,0]=3 19835 B18R2.9237 Cc1ccccc1CNCc2ccc(cc2)Br 34a_100000174972_100000189115 [0,2,0,0,0,0|1,0,0]=3 19836 B18R2.9237 Cc1ccccc1CNCc2ccc(cc2)Cl 207a_100000174871_100000211143 [0,2,0,0,0,0|1,0,0]=3 19837 B18R2.9237 Cc1ccccc1CNCc2ccc(cc2)Cl 207a_100000174972_100000189385 [0,2,0,0,0,0|1,0,0]=3 19838 B18R2.9237 Cc1ccccc1CNCc2ccc(cc2)Cl 2230a_100000174871_100000211839 [0,2,0,0,0,0|1,0,0]=3 19839 B18R2.9237 Cc1ccccc1CNCc2ccc(cc2)Cl 270004a_100000174871_100000211143 [0,2,0,0,0,0|1,0,0]=3 19840 B18R2.9237 Cc1ccccc1CNCc2ccc(cc2)Cl 270004a_100000174972_100000189385 [0,2,0,0,0,0|1,0,0]=3 19841 B18R2.9237 Cc1ccccc1CNCc2ccc(cc2)Cl 34a_100000174871_100000211839 [0,2,0,0,0,0|1,0,0]=3 19842 B18R2.9237 Cc1ccccc1CNCc2ccc(cc2)Cl 34a_100000174972_100000694040 [0,2,0,0,0,0|1,0,0]=3 19843 B18R2.9237 Cc1ccccc1CNCc2ccc(cc2)F 207a_100000174882_100000211143 [0,2,0,0,0,0|1,0,0]=3 19844 B18R2.9237 Cc1ccccc1CNCc2ccc(cc2)F 207a_100000174972_100000210084 [0,2,0,0,0,0|1,0,0]=3 19845 B18R2.9237 Cc1ccccc1CNCc2ccc(cc2)F 2230a_100000174882_100000211839 [0,2,0,0,0,0|1,0,0]=3 19846 B18R2.9237 Cc1ccccc1CNCc2ccc(cc2)F 270004a_100000174882_100000211143 [0,2,0,0,0,0|1,0,0]=3 19847 B18R2.9237 Cc1ccccc1CNCc2ccc(cc2)F 270004a_100000174972_100000210084 [0,2,0,0,0,0|1,0,0]=3 19848 B18R2.9237 Cc1ccccc1CNCc2ccc(cc2)F 34a_100000174882_100000211839 [0,2,0,0,0,0|1,0,0]=3 19849 B18R2.9237 Cc1ccccc1CNCc2ccc(cc2)F 34a_100000174972_100000198546 [0,2,0,0,0,0|1,0,0]=3 19850 B18R2.9237 Cc1ccccc1CNCc2ccc(cc2)I 207a_100000174972_100000188517 [0,2,0,0,0,0|1,0,0]=3 19851 B18R2.9237 Cc1ccccc1CNCc2ccc(cc2)I 207a_100016989417_100000211143 [0,2,0,0,0,0|1,0,0]=3 19852 B18R2.9237 Cc1ccccc1CNCc2ccc(cc2)I 2230a_100016989417_100000211839 [0,2,0,0,0,0|1,0,0]=3 19853 B18R2.9237 Cc1ccccc1CNCc2ccc(cc2)I 270004a_100016989417_100000211143 [0,2,0,0,0,0|1,0,0]=3 19854 B18R2.9237 Cc1ccccc1CNCc2ccc(cc2)I 34a_100000174972_100000189116 [0,2,0,0,0,0|1,0,0]=3 19855 B18R2.9237 Cc1ccccc1CNCc2ccc(cc2)I 34a_100016989417_100000211839 [0,2,0,0,0,0|1,0,0]=3 19856 B18R2.9237 Cc1ccccc1CNCc2ccc(cc2)O 34a_100000185549_100000211839 [0,2,0,0,0,0|1,0,0]=3 19857 B18R2.9237 Cc1ccccc1CNCc2ccc(cn2)Br 207a_100000174972_100000754260 [0,2,0,0,0,0|2,0,0]=4 19858 B18R2.9237 Cc1ccccc1CNCc2ccc(cn2)Br 270004a_100000174972_100000754260 [0,2,0,0,0,0|2,0,0]=4 19859 B18R2.9237 Cc1ccccc1CNCc2ccc(cn2)Br 34a_100000174972_100000702658 [0,2,0,0,0,0|2,0,0]=4 19860 B18R2.9237 Cc1ccccc1CNCc2ccc(cn2)Br 34a_100015188789_100000211839 [0,2,0,0,0,0|2,0,0]=4 19861 B18R2.9237 Cc1ccccc1CNCc2ccc(cn2)Cl 207a_100000174972_100011361569 [0,2,0,0,0,0|2,0,0]=4 19862 B18R2.9237 Cc1ccccc1CNCc2ccc(cn2)Cl 270004a_100000174972_100011361569 [0,2,0,0,0,0|2,0,0]=4 19863 B18R2.9237 Cc1ccccc1CNCc2ccc(cn2)Cl 270004a_100000697193_100000211143 [0,2,0,0,0,0|2,0,0]=4 19864 B18R2.9237 Cc1ccccc1CNCc2ccc(cn2)Cl 34a_100000174972_100012066911 [0,2,0,0,0,0|2,0,0]=4 19865 B18R2.9237 Cc1ccccc1CNCc2ccc(cn2)Cl 34a_100000697193_100000211839 [0,2,0,0,0,0|2,0,0]=4 19866 B18R2.9237 Cc1ccccc1CNCc2ccc(cn2)F 207a_100000174972_100011934744 [0,2,0,0,0,0|2,0,0]=4 19867 B18R2.9237 Cc1ccccc1CNCc2ccc(cn2)F 270004a_100000174972_100011934744 [0,2,0,0,0,0|2,0,0]=4 19868 B18R2.9237 Cc1ccccc1CNCc2ccc(cn2)F 34a_100000174972_100000703193 [0,2,0,0,0,0|2,0,0]=4 19869 B18R2.9237 Cc1ccccc1CNCc2ccc(cn2)F 34a_100020620131_100000211839 [0,2,0,0,0,0|2,0,0]=4 19870 B18R2.9237 Cc1ccccc1CNCc2ccc(nc2)Br 207a_100009817727_100000211143 [0,2,0,0,0,0|2,0,0]=4 19871 B18R2.9237 Cc1ccccc1CNCc2ccc(nc2)Br 2230a_100009817727_100000211839 [0,2,0,0,0,0|2,0,0]=4 19872 B18R2.9237 Cc1ccccc1CNCc2ccc(nc2)Br 270004a_100009817727_100000211143 [0,2,0,0,0,0|2,0,0]=4 19873 B18R2.9237 Cc1ccccc1CNCc2ccc(nc2)Br 34a_100000174972_100009831999 [0,2,0,0,0,0|2,0,0]=4 19874 B18R2.9237 Cc1ccccc1CNCc2ccc(nc2)Br 34a_100009817727_100000211839 [0,2,0,0,0,0|2,0,0]=4 19875 B18R2.9237 Cc1ccccc1CNCc2ccc(nc2)Cl 207a_100000735879_100000211143 [0,2,0,0,0,0|2,0,0]=4 19876 B18R2.9237 Cc1ccccc1CNCc2ccc(nc2)Cl 2230a_100000735879_100000211839 [0,2,0,0,0,0|2,0,0]=4 19877 B18R2.9237 Cc1ccccc1CNCc2ccc(nc2)Cl 270004a_100000735879_100000211143 [0,2,0,0,0,0|2,0,0]=4 19878 B18R2.9237 Cc1ccccc1CNCc2ccc(nc2)Cl 34a_100000174972_100000735431 [0,2,0,0,0,0|2,0,0]=4 19879 B18R2.9237 Cc1ccccc1CNCc2ccc(nc2)Cl 34a_100000735879_100000211839 [0,2,0,0,0,0|2,0,0]=4 19880 B18R2.9237 Cc1ccccc1CNCc2ccc(nc2)F 2230a_100000101913_100000211839 [0,2,0,0,0,0|2,0,0]=4 19881 B18R2.9237 Cc1ccccc1CNCc2ccc(nc2)F 270004a_100000101913_100000211143 [0,2,0,0,0,0|2,0,0]=4 19882 B18R2.9237 Cc1ccccc1CNCc2ccc(nc2)F 34a_100000101913_100000211839 [0,2,0,0,0,0|2,0,0]=4 19883 B18R2.9237 Cc1ccccc1CNCc2ccc(nc2)F 34a_100000174972_100000099788 [0,2,0,0,0,0|2,0,0]=4 19884 B18R2.9237 Cc1ccccc1CNCc2ccc(nc2)O 207a_100000174972_100011361521 [0,2,0,0,0,0|2,0,0]=4 19885 B18R2.9237 Cc1ccccc1CNCc2ccc(nc2)O 2230a_100000757128_100000211839 [0,2,0,0,0,0|2,0,0]=4 19886 B18R2.9237 Cc1ccccc1COCc2cc[n+](cc2)C 34a_100009831711_100000211839 [0,2,0,0,0,0|1,0,0]=3 19887 B18R2.9237 Cc1ccccc1COCc2cc[n+](cc2)[O-] 34a_100000031831_100000211839 [0,2,0,0,0,0|1,0,0]=3 19888 B18R2.9237 Cc1ccccc1COCc2cc[n+](cc2)[O-] 7a_100000031831_100000211839 [0,2,0,0,0,0|1,0,0]=3 19889 B18R2.9237 Cc1ccccc1COCc2ccc(=O)[nH]c2 34a_100011999846_100000211839 [0,2,0,0,0,0|1,0,0]=3 19890 B18R2.9237 Cc1ccccc1COCc2ccc(cc2)Br 34a_100000695286_100000211839 [0,2,0,0,0,0|0,0,0]=2 19891 B18R2.9237 Cc1ccccc1COCc2ccc(cc2)Br 34a_100000698903_100000189115 [0,2,0,0,0,0|0,0,0]=2 19892 B18R2.9237 Cc1ccccc1COCc2ccc(cc2)Br 7a_100000698903_100011217064 [0,2,0,0,0,0|0,0,0]=2 19893 B18R2.9237 Cc1ccccc1COCc2ccc(cc2)Cl 34a_100000211118_100000211839 [0,2,0,0,0,0|0,0,0]=2 19894 B18R2.9237 Cc1ccccc1COCc2ccc(cc2)Cl 34a_100000698903_100000694040 [0,2,0,0,0,0|0,0,0]=2 19895 B18R2.9237 Cc1ccccc1COCc2ccc(cc2)Cl 7a_100000211118_100000211839 [0,2,0,0,0,0|0,0,0]=2 19896 B18R2.9237 Cc1ccccc1COCc2ccc(cc2)Cl 7a_100000698903_100000187161 [0,2,0,0,0,0|0,0,0]=2 19897 B18R2.9237 Cc1ccccc1COCc2ccc(cc2)F 34a_100000210977_100000211839 [0,2,0,0,0,0|0,0,0]=2 19898 B18R2.9237 Cc1ccccc1COCc2ccc(cc2)F 34a_100000698903_100000198546 [0,2,0,0,0,0|0,0,0]=2 19899 B18R2.9237 Cc1ccccc1COCc2ccc(cc2)F 7a_100000210977_100000211839 [0,2,0,0,0,0|0,0,0]=2 19900 B18R2.9237 Cc1ccccc1COCc2ccc(cc2)F 7a_100000698903_100000198546 [0,2,0,0,0,0|0,0,0]=2 19901 B18R2.9237 Cc1ccccc1COCc2ccc(cc2)I 34a_100000690907_100000211839 [0,2,0,0,0,0|0,0,0]=2 19902 B18R2.9237 Cc1ccccc1COCc2ccc(cc2)I 34a_100000698903_100000189116 [0,2,0,0,0,0|0,0,0]=2 19903 B18R2.9237 Cc1ccccc1COCc2ccc(cc2)I 7a_100000690907_100000211839 [0,2,0,0,0,0|0,0,0]=2 19904 B18R2.9237 Cc1ccccc1COCc2ccc(cc2)I 7a_100000698903_100000189116 [0,2,0,0,0,0|0,0,0]=2 19905 B18R2.9237 Cc1ccccc1COCc2ccc(cc2)N 34a_100011215238_100000211839 [0,2,0,0,0,0|0,0,0]=2 19906 B18R2.9237 Cc1ccccc1COCc2ccc(cn2)Br 34a_100000698903_100000702658 [0,2,0,0,0,0|1,0,0]=3 19907 B18R2.9237 Cc1ccccc1COCc2ccc(cn2)Br 34a_100000754261_100000211839 [0,2,0,0,0,0|1,0,0]=3 19908 B18R2.9237 Cc1ccccc1COCc2ccc(cn2)Br 7a_100000698903_100000702658 [0,2,0,0,0,0|1,0,0]=3 19909 B18R2.9237 Cc1ccccc1COCc2ccc(cn2)Cl 34a_100000698903_100012066911 [0,2,0,0,0,0|1,0,0]=3 19910 B18R2.9237 Cc1ccccc1COCc2ccc(cn2)Cl 34a_100000703999_100000211839 [0,2,0,0,0,0|1,0,0]=3 19911 B18R2.9237 Cc1ccccc1COCc2ccc(cn2)Cl 7a_100000698903_100012066911 [0,2,0,0,0,0|1,0,0]=3 19912 B18R2.9237 Cc1ccccc1COCc2ccc(cn2)F 34a_100000698903_100000703193 [0,2,0,0,0,0|1,0,0]=3 19913 B18R2.9237 Cc1ccccc1COCc2ccc(cn2)F 34a_100011999454_100000211839 [0,2,0,0,0,0|1,0,0]=3 19914 B18R2.9237 Cc1ccccc1COCc2ccc(cn2)F 7a_100000698903_100000703193 [0,2,0,0,0,0|1,0,0]=3 19915 B18R2.9237 Cc1ccccc1COCc2ccc(cn2)N 34a_100011998161_100000211839 [0,2,0,0,0,0|1,0,0]=3 19916 B18R2.9237 Cc1ccccc1COCc2ccc(nc2)Br 34a_100000698903_100009831999 [0,2,0,0,0,0|1,0,0]=3 19917 B18R2.9237 Cc1ccccc1COCc2ccc(nc2)Br 34a_100009816760_100000211839 [0,2,0,0,0,0|1,0,0]=3 19918 B18R2.9237 Cc1ccccc1COCc2ccc(nc2)Br 7a_100000698903_100009831999 [0,2,0,0,0,0|1,0,0]=3 19919 B18R2.9237 Cc1ccccc1COCc2ccc(nc2)Br 7a_100009816760_100000211839 [0,2,0,0,0,0|1,0,0]=3 19920 B18R2.9237 Cc1ccccc1COCc2ccc(nc2)Cl 34a_100000698903_100000735431 [0,2,0,0,0,0|1,0,0]=3 19921 B18R2.9237 Cc1ccccc1COCc2ccc(nc2)Cl 34a_100000755211_100000211839 [0,2,0,0,0,0|1,0,0]=3 19922 B18R2.9237 Cc1ccccc1COCc2ccc(nc2)Cl 7a_100000698903_100000735431 [0,2,0,0,0,0|1,0,0]=3 19923 B18R2.9237 Cc1ccccc1COCc2ccc(nc2)Cl 7a_100000755211_100000211839 [0,2,0,0,0,0|1,0,0]=3 19924 B18R2.9237 Cc1ccccc1COCc2ccc(nc2)F 34a_100000079959_100000211839 [0,2,0,0,0,0|1,0,0]=3 19925 B18R2.9237 Cc1ccccc1COCc2ccc(nc2)F 34a_100000698903_100000099788 [0,2,0,0,0,0|1,0,0]=3 19926 B18R2.9237 Cc1ccccc1COCc2ccc(nc2)F 7a_100000698903_100009820150 [0,2,0,0,0,0|1,0,0]=3 19927 B18R2.9237 Cc1ccccc1COCc2ccc(nc2)N 34a_100000704267_100000211839 [0,2,0,0,0,0|1,0,0]=3 19928 B18R2.9237 Cc1ccccc1COCc2ccc(nn2)Cl 34a_100000698903_100016992710 [0,2,0,0,0,0|2,0,0]=4 19929 B18R2.9237 Cc1ccccc1COCc2ccc(nn2)Cl 7a_100000698903_100016992710 [0,2,0,0,0,0|2,0,0]=4 19930 B18R2.9237 Cc1ccccc1COCc2cnc(cn2)Cl 34a_100012002382_100000211839 [0,2,0,0,0,0|2,0,0]=4 19931 B18R2.9237 Cc1ccccc1COCc2cnc(nc2)Cl 34a_100009855073_100000211839 [0,2,0,0,0,0|2,0,0]=4 19932 B18R2.9237 Cc1ccccc1COCc2cnc(nc2)Cl 7a_100009855073_100000211839 [0,2,0,0,0,0|2,0,0]=4 19933 B18R2.9237 Cc1ccccc1COCc2ncc(cn2)Br 34a_100000698903_100010064664 [0,2,0,0,0,0|2,0,0]=4 19934 B18R2.9237 Cc1ccccc1COCc2ncc(cn2)Br 7a_100000698903_100010064664 [0,2,0,0,0,0|2,0,0]=4 19935 B18R2.9237 Cc1ccccc1CSCc2ccc(cc2)Br 62a_100000189115_100000211839 [0,2,0,0,0,0|0,1,0]=3 19936 B18R2.9237 Cc1ccccc1CSCc2ccc(cc2)Br 62a_100000211839_100000189115 [0,2,0,0,0,0|0,1,0]=3 19937 B18R2.9237 Cc1ccccc1CSCc2ccc(cc2)Cl 62a_100000187161_100000211839 [0,2,0,0,0,0|0,1,0]=3 19938 B18R2.9237 Cc1ccccc1CSCc2ccc(cc2)Cl 62a_100000211839_100000187161 [0,2,0,0,0,0|0,1,0]=3 19939 B18R2.9237 Cc1ccccc1CSCc2ccc(cc2)F 62a_100000198546_100000211839 [0,2,0,0,0,0|0,1,0]=3 19940 B18R2.9237 Cc1ccccc1CSCc2ccc(cc2)F 62a_100000211839_100000187164 [0,2,0,0,0,0|0,1,0]=3 19941 B18R2.9237 Cc1ccccc1CSCc2ccc(cc2)I 62a_100000189116_100000211839 [0,2,0,0,0,0|0,1,0]=3 19942 B18R2.9237 Cc1ccccc1CSCc2ccc(cc2)I 62a_100000211839_100000189116 [0,2,0,0,0,0|0,1,0]=3 19943 B18R2.9237 Cc1ccccc1CSCc2ccc(cn2)Br 62a_100000211839_100000702658 [0,2,0,0,0,0|1,1,0]=4 19944 B18R2.9237 Cc1ccccc1CSCc2ccc(cn2)Br 62a_100000702658_100000211839 [0,2,0,0,0,0|1,1,0]=4 19945 B18R2.9237 Cc1ccccc1CSCc2ccc(cn2)Cl 62a_100000211839_100000697101 [0,2,0,0,0,0|1,1,0]=4 19946 B18R2.9237 Cc1ccccc1CSCc2ccc(cn2)Cl 62a_100012066911_100000211839 [0,2,0,0,0,0|1,1,0]=4 19947 B18R2.9237 Cc1ccccc1CSCc2ccc(cn2)F 62a_100000211839_100000703193 [0,2,0,0,0,0|1,1,0]=4 19948 B18R2.9237 Cc1ccccc1CSCc2ccc(cn2)F 62a_100000703193_100000211839 [0,2,0,0,0,0|1,1,0]=4 19949 B18R2.9237 Cc1ccccc1CSCc2ccc(nc2)Br 62a_100000211839_100009831999 [0,2,0,0,0,0|1,1,0]=4 19950 B18R2.9237 Cc1ccccc1CSCc2ccc(nc2)Br 62a_100009831999_100000211839 [0,2,0,0,0,0|1,1,0]=4 19951 B18R2.9237 Cc1ccccc1CSCc2ccc(nc2)Cl 62a_100000211839_100000735431 [0,2,0,0,0,0|1,1,0]=4 19952 B18R2.9237 Cc1ccccc1CSCc2ccc(nc2)Cl 62a_100000735431_100000211839 [0,2,0,0,0,0|1,1,0]=4 19953 B18R2.9237 Cc1ccccc1CSCc2ccc(nc2)F 62a_100000211839_100000099788 [0,2,0,0,0,0|1,1,0]=4 19954 B18R2.9237 Cc1ccccc1CSCc2ccc(nc2)F 62a_100009820150_100000211839 [0,2,0,0,0,0|1,1,0]=4 19955 B18R2.9237 Cc1ccccc1NCCc2ccc(cc2)Br 34a_100015192222_100011740612 [0,2,0,0,0,0|2,0,0]=4 19956 B18R2.9237 Cc1ccccc1NCCc2ccc(cc2)Cl 34a_100015192222_100011713675 [0,2,0,0,0,0|2,0,0]=4 19957 B18R2.9237 Cc1ccccc1NCCc2ccc(cc2)F 34a_100015192222_100011217392 [0,2,0,0,0,0|2,0,0]=4 19958 B18R2.9237 Cc1ccccc1OCCc2ccc(cc2)Br 34a_100000210338_100011740612 [0,2,0,0,0,0|2,0,0]=4 19959 B18R2.9237 Cc1ccccc1OCCc2ccc(cc2)Br 7a_100000210338_100011740612 [0,2,0,0,0,0|2,0,0]=4 19960 B18R2.9237 Cc1ccccc1OCCc2ccc(cc2)Cl 34a_100000210338_100011713675 [0,2,0,0,0,0|2,0,0]=4 19961 B18R2.9237 Cc1ccccc1OCCc2ccc(cc2)Cl 7a_100000210338_100011713675 [0,2,0,0,0,0|2,0,0]=4 19962 B18R2.9237 Cc1ccccc1OCCc2ccc(cc2)F 34a_100000210338_100011217392 [0,2,0,0,0,0|2,0,0]=4 19963 B18R2.9237 Cc1ccccc1OCCc2ccc(cc2)F 7a_100000210338_100011217392 [0,2,0,0,0,0|2,0,0]=4 19964 B18R2.9237 Cc1ccccc1OCCc2ccc(cc2)O 7a_100000210338_100009816426 [0,2,0,0,0,0|2,0,0]=4 19965 B18R2.9237 Cc1ccccc1SCCc2ccc(cc2)Br 62a_100000210755_100011740612 [0,2,0,0,0,0|2,0,0]=4 19966 B18R2.9237 Cc1ccccc1SCCc2ccc(cc2)Br 62a_100011740612_100000210755 [0,2,0,0,0,0|2,0,0]=4 19967 B18R2.9237 Cc1ccccc1SCCc2ccc(cc2)Cl 62a_100000210755_100011713675 [0,2,0,0,0,0|2,0,0]=4 19968 B18R2.9237 Cc1ccccc1SCCc2ccc(cc2)Cl 62a_100011713675_100000210755 [0,2,0,0,0,0|2,0,0]=4 19969 B18R2.9237 Cc1ccccc1SCCc2ccc(cc2)F 62a_100000210755_100011217392 [0,2,0,0,0,0|2,0,0]=4 19970 B18R2.9237 Cc1ccccc1SCCc2ccc(cc2)F 62a_100011217392_100000210755 [0,2,0,0,0,0|2,0,0]=4 19971 B18R2.9237 Cc1ccccc1SCCc2ccc(cc2)O 62a_100000210755_100009816426 [0,2,0,0,0,0|2,0,0]=4 19972 B18R2.9237 Cc1ccccc1SCCc2ccc(cc2)O 62a_100009816426_100000210755 [0,2,0,0,0,0|2,0,0]=4 19973 B18R2.9237 Cc1cccnc1CNCc2ccc(cc2)Br 207a_100000174875_100000698913 [0,2,0,0,0,0|2,0,0]=4 19974 B18R2.9237 Cc1cccnc1CNCc2ccc(cc2)Br 2230a_100000174875_100000696600 [0,2,0,0,0,0|2,0,0]=4 19975 B18R2.9237 Cc1cccnc1CNCc2ccc(cc2)Br 270004a_100000174875_100000698913 [0,2,0,0,0,0|2,0,0]=4 19976 B18R2.9237 Cc1cccnc1CNCc2ccc(cc2)Br 34a_100000174875_100000696600 [0,2,0,0,0,0|2,0,0]=4 19977 B18R2.9237 Cc1cccnc1CNCc2ccc(cc2)Br 34a_100011223789_100000189115 [0,2,0,0,0,0|2,0,0]=4 19978 B18R2.9237 Cc1cccnc1CNCc2ccc(cc2)Cl 207a_100000174871_100000698913 [0,2,0,0,0,0|2,0,0]=4 19979 B18R2.9237 Cc1cccnc1CNCc2ccc(cc2)Cl 2230a_100000174871_100000696600 [0,2,0,0,0,0|2,0,0]=4 19980 B18R2.9237 Cc1cccnc1CNCc2ccc(cc2)Cl 270004a_100000174871_100000698913 [0,2,0,0,0,0|2,0,0]=4 19981 B18R2.9237 Cc1cccnc1CNCc2ccc(cc2)Cl 34a_100000174871_100000696600 [0,2,0,0,0,0|2,0,0]=4 19982 B18R2.9237 Cc1cccnc1CNCc2ccc(cc2)Cl 34a_100011223789_100000694040 [0,2,0,0,0,0|2,0,0]=4 19983 B18R2.9237 Cc1cccnc1CNCc2ccc(cc2)F 207a_100000174882_100000698913 [0,2,0,0,0,0|2,0,0]=4 19984 B18R2.9237 Cc1cccnc1CNCc2ccc(cc2)F 2230a_100000174882_100000696600 [0,2,0,0,0,0|2,0,0]=4 19985 B18R2.9237 Cc1cccnc1CNCc2ccc(cc2)F 270004a_100000174882_100000698913 [0,2,0,0,0,0|2,0,0]=4 19986 B18R2.9237 Cc1cccnc1CNCc2ccc(cc2)F 34a_100000174882_100000696600 [0,2,0,0,0,0|2,0,0]=4 19987 B18R2.9237 Cc1cccnc1CNCc2ccc(cc2)F 34a_100011223789_100000198546 [0,2,0,0,0,0|2,0,0]=4 19988 B18R2.9237 Cc1cccnc1CNCc2ccc(cc2)I 207a_100016989417_100000698913 [0,2,0,0,0,0|2,0,0]=4 19989 B18R2.9237 Cc1cccnc1CNCc2ccc(cc2)I 2230a_100016989417_100000696600 [0,2,0,0,0,0|2,0,0]=4 19990 B18R2.9237 Cc1cccnc1CNCc2ccc(cc2)I 270004a_100016989417_100000698913 [0,2,0,0,0,0|2,0,0]=4 19991 B18R2.9237 Cc1cccnc1CNCc2ccc(cc2)I 34a_100011223789_100000189116 [0,2,0,0,0,0|2,0,0]=4 19992 B18R2.9237 Cc1cccnc1CNCc2ccc(cc2)I 34a_100016989417_100000696600 [0,2,0,0,0,0|2,0,0]=4 19993 B18R2.9237 Cc1cccnc1CNCc2ccc(cc2)O 34a_100000185549_100000696600 [0,2,0,0,0,0|2,0,0]=4 19994 B18R2.9237 Cc1cccnc1COCc2cc[n+](cc2)C 34a_100009831711_100000696600 [0,2,0,0,0,0|2,0,0]=4 19995 B18R2.9237 Cc1cccnc1COCc2cc[n+](cc2)[O-] 34a_100000031831_100000696600 [0,2,0,0,0,0|2,0,0]=4 19996 B18R2.9237 Cc1cccnc1COCc2cc[n+](cc2)[O-] 7a_100000031831_100000696600 [0,2,0,0,0,0|2,0,0]=4 19997 B18R2.9237 Cc1cccnc1COCc2ccc(=O)[nH]c2 34a_100011999846_100000696600 [0,2,0,0,0,0|2,0,0]=4 19998 B18R2.9237 Cc1cccnc1COCc2ccc(cc2)Br 34a_100000695286_100000696600 [0,2,0,0,0,0|1,0,0]=3 19999 B18R2.9237 Cc1cccnc1COCc2ccc(cc2)Br 34a_100000698912_100000189115 [0,2,0,0,0,0|1,0,0]=3 20000 B18R2.9237 Cc1cccnc1COCc2ccc(cc2)Cl 34a_100000211118_100000696600 [0,2,0,0,0,0|1,0,0]=3 20001 B18R2.9237 Cc1cccnc1COCc2ccc(cc2)Cl 34a_100000698912_100000694040 [0,2,0,0,0,0|1,0,0]=3 20002 B18R2.9237 Cc1cccnc1COCc2ccc(cc2)Cl 7a_100000211118_100000696600 [0,2,0,0,0,0|1,0,0]=3 20003 B18R2.9237 Cc1cccnc1COCc2ccc(cc2)F 34a_100000210977_100000696600 [0,2,0,0,0,0|1,0,0]=3 20004 B18R2.9237 Cc1cccnc1COCc2ccc(cc2)F 34a_100000698912_100000198546 [0,2,0,0,0,0|1,0,0]=3 20005 B18R2.9237 Cc1cccnc1COCc2ccc(cc2)F 7a_100000210977_100000696600 [0,2,0,0,0,0|1,0,0]=3 20006 B18R2.9237 Cc1cccnc1COCc2ccc(cc2)I 34a_100000690907_100000696600 [0,2,0,0,0,0|1,0,0]=3 20007 B18R2.9237 Cc1cccnc1COCc2ccc(cc2)I 34a_100000698912_100000189116 [0,2,0,0,0,0|1,0,0]=3 20008 B18R2.9237 Cc1cccnc1COCc2ccc(cc2)I 7a_100000690907_100000696600 [0,2,0,0,0,0|1,0,0]=3 20009 B18R2.9237 Cc1cccnc1COCc2ccc(cc2)N 34a_100011215238_100000696600 [0,2,0,0,0,0|1,0,0]=3 20010 B18R2.9237 Cc1cccnc1COCc2ccc(cn2)Br 34a_100000698912_100000702658 [0,2,0,0,0,0|2,0,0]=4 20011 B18R2.9237 Cc1cccnc1COCc2ccc(cn2)Br 34a_100000754261_100000696600 [0,2,0,0,0,0|2,0,0]=4 20012 B18R2.9237 Cc1cccnc1COCc2ccc(cn2)Cl 34a_100000698912_100012066911 [0,2,0,0,0,0|2,0,0]=4 20013 B18R2.9237 Cc1cccnc1COCc2ccc(cn2)Cl 34a_100000703999_100000696600 [0,2,0,0,0,0|2,0,0]=4 20014 B18R2.9237 Cc1cccnc1COCc2ccc(cn2)F 34a_100000698912_100000703193 [0,2,0,0,0,0|2,0,0]=4 20015 B18R2.9237 Cc1cccnc1COCc2ccc(cn2)F 34a_100011999454_100000696600 [0,2,0,0,0,0|2,0,0]=4 20016 B18R2.9237 Cc1cccnc1COCc2ccc(cn2)N 34a_100011998161_100000696600 [0,2,0,0,0,0|2,0,0]=4 20017 B18R2.9237 Cc1cccnc1COCc2ccc(nc2)Br 34a_100000698912_100009831999 [0,2,0,0,0,0|2,0,0]=4 20018 B18R2.9237 Cc1cccnc1COCc2ccc(nc2)Br 34a_100009816760_100000696600 [0,2,0,0,0,0|2,0,0]=4 20019 B18R2.9237 Cc1cccnc1COCc2ccc(nc2)Br 7a_100009816760_100000696600 [0,2,0,0,0,0|2,0,0]=4 20020 B18R2.9237 Cc1cccnc1COCc2ccc(nc2)Cl 34a_100000698912_100000735431 [0,2,0,0,0,0|2,0,0]=4 20021 B18R2.9237 Cc1cccnc1COCc2ccc(nc2)Cl 34a_100000755211_100000696600 [0,2,0,0,0,0|2,0,0]=4 20022 B18R2.9237 Cc1cccnc1COCc2ccc(nc2)Cl 7a_100000755211_100000696600 [0,2,0,0,0,0|2,0,0]=4 20023 B18R2.9237 Cc1cccnc1COCc2ccc(nc2)F 34a_100000079959_100000696600 [0,2,0,0,0,0|2,0,0]=4 20024 B18R2.9237 Cc1cccnc1COCc2ccc(nc2)F 34a_100000698912_100000099788 [0,2,0,0,0,0|2,0,0]=4 20025 B18R2.9237 Cc1cccnc1COCc2ccc(nc2)N 34a_100000704267_100000696600 [0,2,0,0,0,0|2,0,0]=4 20026 B18R2.9237 Cc1cccnc1CSCc2ccc(cc2)Br 62a_100000189115_100000696600 [0,2,0,0,0,0|1,1,0]=4 20027 B18R2.9237 Cc1cccnc1CSCc2ccc(cc2)Br 62a_100000696600_100000189115 [0,2,0,0,0,0|1,1,0]=4 20028 B18R2.9237 Cc1cccnc1CSCc2ccc(cc2)Cl 62a_100000187161_100000696600 [0,2,0,0,0,0|1,1,0]=4 20029 B18R2.9237 Cc1cccnc1CSCc2ccc(cc2)Cl 62a_100000696600_100000187161 [0,2,0,0,0,0|1,1,0]=4 20030 B18R2.9237 Cc1cccnc1CSCc2ccc(cc2)F 62a_100000198546_100000696600 [0,2,0,0,0,0|1,1,0]=4 20031 B18R2.9237 Cc1cccnc1CSCc2ccc(cc2)F 62a_100000696600_100000187164 [0,2,0,0,0,0|1,1,0]=4 20032 B18R2.9237 Cc1cccnc1CSCc2ccc(cc2)I 62a_100000189116_100000696600 [0,2,0,0,0,0|1,1,0]=4 20033 B18R2.9237 Cc1cccnc1CSCc2ccc(cc2)I 62a_100000696600_100000189116 [0,2,0,0,0,0|1,1,0]=4 20034 B18R2.9237 Cc1ccncc1CNCc2ccc(cc2)Br 207a_100000174875_100000685662 [0,2,0,0,0,0|2,0,0]=4 20035 B18R2.9237 Cc1ccncc1CNCc2ccc(cc2)Br 207a_100011997553_100000186029 [0,2,0,0,0,0|2,0,0]=4 20036 B18R2.9237 Cc1ccncc1CNCc2ccc(cc2)Br 2230a_100000174875_100000690890 [0,2,0,0,0,0|2,0,0]=4 20037 B18R2.9237 Cc1ccncc1CNCc2ccc(cc2)Br 270004a_100000174875_100000685662 [0,2,0,0,0,0|2,0,0]=4 20038 B18R2.9237 Cc1ccncc1CNCc2ccc(cc2)Br 270004a_100011997553_100000186029 [0,2,0,0,0,0|2,0,0]=4 20039 B18R2.9237 Cc1ccncc1CNCc2ccc(cc2)Br 34a_100000174875_100000690890 [0,2,0,0,0,0|2,0,0]=4 20040 B18R2.9237 Cc1ccncc1CNCc2ccc(cc2)Cl 207a_100000174871_100000685662 [0,2,0,0,0,0|2,0,0]=4 20041 B18R2.9237 Cc1ccncc1CNCc2ccc(cc2)Cl 207a_100011997553_100000189385 [0,2,0,0,0,0|2,0,0]=4 20042 B18R2.9237 Cc1ccncc1CNCc2ccc(cc2)Cl 2230a_100000174871_100000690890 [0,2,0,0,0,0|2,0,0]=4 20043 B18R2.9237 Cc1ccncc1CNCc2ccc(cc2)Cl 270004a_100000174871_100000685662 [0,2,0,0,0,0|2,0,0]=4 20044 B18R2.9237 Cc1ccncc1CNCc2ccc(cc2)Cl 270004a_100011997553_100000189385 [0,2,0,0,0,0|2,0,0]=4 20045 B18R2.9237 Cc1ccncc1CNCc2ccc(cc2)Cl 34a_100000174871_100000690890 [0,2,0,0,0,0|2,0,0]=4 20046 B18R2.9237 Cc1ccncc1CNCc2ccc(cc2)F 207a_100000174882_100000685662 [0,2,0,0,0,0|2,0,0]=4 20047 B18R2.9237 Cc1ccncc1CNCc2ccc(cc2)F 207a_100011997553_100000210084 [0,2,0,0,0,0|2,0,0]=4 20048 B18R2.9237 Cc1ccncc1CNCc2ccc(cc2)F 2230a_100000174882_100000690890 [0,2,0,0,0,0|2,0,0]=4 20049 B18R2.9237 Cc1ccncc1CNCc2ccc(cc2)F 270004a_100000174882_100000685662 [0,2,0,0,0,0|2,0,0]=4 20050 B18R2.9237 Cc1ccncc1CNCc2ccc(cc2)F 270004a_100011997553_100000210084 [0,2,0,0,0,0|2,0,0]=4 20051 B18R2.9237 Cc1ccncc1CNCc2ccc(cc2)F 34a_100000174882_100000690890 [0,2,0,0,0,0|2,0,0]=4 20052 B18R2.9237 Cc1ccncc1CNCc2ccc(cc2)I 207a_100011997553_100000188517 [0,2,0,0,0,0|2,0,0]=4 20053 B18R2.9237 Cc1ccncc1CNCc2ccc(cc2)I 207a_100016989417_100000685662 [0,2,0,0,0,0|2,0,0]=4 20054 B18R2.9237 Cc1ccncc1CNCc2ccc(cc2)I 2230a_100016989417_100000690890 [0,2,0,0,0,0|2,0,0]=4 20055 B18R2.9237 Cc1ccncc1CNCc2ccc(cc2)I 270004a_100016989417_100000685662 [0,2,0,0,0,0|2,0,0]=4 20056 B18R2.9237 Cc1ccncc1CNCc2ccc(cc2)I 34a_100016989417_100000690890 [0,2,0,0,0,0|2,0,0]=4 20057 B18R2.9237 Cc1ccncc1CNCc2ccc(cc2)O 34a_100000185549_100000690890 [0,2,0,0,0,0|2,0,0]=4 20058 B18R2.9237 Cc1ccncc1COCc2cc[n+](cc2)C 34a_100009831711_100000690890 [0,2,0,0,0,0|2,0,0]=4 20059 B18R2.9237 Cc1ccncc1COCc2cc[n+](cc2)[O-] 34a_100000031831_100000690890 [0,2,0,0,0,0|2,0,0]=4 20060 B18R2.9237 Cc1ccncc1COCc2cc[n+](cc2)[O-] 7a_100000031831_100000690890 [0,2,0,0,0,0|2,0,0]=4 20061 B18R2.9237 Cc1ccncc1COCc2ccc(=O)[nH]c2 34a_100011999846_100000690890 [0,2,0,0,0,0|2,0,0]=4 20062 B18R2.9237 Cc1ccncc1COCc2ccc(cc2)Br 34a_100000695286_100000690890 [0,2,0,0,0,0|1,0,0]=3 20063 B18R2.9237 Cc1ccncc1COCc2ccc(cc2)Br 34a_100011996381_100000189115 [0,2,0,0,0,0|1,0,0]=3 20064 B18R2.9237 Cc1ccncc1COCc2ccc(cc2)Cl 34a_100000211118_100000690890 [0,2,0,0,0,0|1,0,0]=3 20065 B18R2.9237 Cc1ccncc1COCc2ccc(cc2)Cl 34a_100011996381_100000694040 [0,2,0,0,0,0|1,0,0]=3 20066 B18R2.9237 Cc1ccncc1COCc2ccc(cc2)Cl 7a_100000211118_100000690890 [0,2,0,0,0,0|1,0,0]=3 20067 B18R2.9237 Cc1ccncc1COCc2ccc(cc2)F 34a_100000210977_100000690890 [0,2,0,0,0,0|1,0,0]=3 20068 B18R2.9237 Cc1ccncc1COCc2ccc(cc2)F 34a_100011996381_100000198546 [0,2,0,0,0,0|1,0,0]=3 20069 B18R2.9237 Cc1ccncc1COCc2ccc(cc2)F 7a_100000210977_100000690890 [0,2,0,0,0,0|1,0,0]=3 20070 B18R2.9237 Cc1ccncc1COCc2ccc(cc2)I 34a_100000690907_100000690890 [0,2,0,0,0,0|1,0,0]=3 20071 B18R2.9237 Cc1ccncc1COCc2ccc(cc2)I 34a_100011996381_100000189116 [0,2,0,0,0,0|1,0,0]=3 20072 B18R2.9237 Cc1ccncc1COCc2ccc(cc2)I 7a_100000690907_100000690890 [0,2,0,0,0,0|1,0,0]=3 20073 B18R2.9237 Cc1ccncc1COCc2ccc(cc2)N 34a_100011215238_100000690890 [0,2,0,0,0,0|1,0,0]=3 20074 B18R2.9237 Cc1ccncc1COCc2ccc(cn2)Br 34a_100000754261_100000690890 [0,2,0,0,0,0|2,0,0]=4 20075 B18R2.9237 Cc1ccncc1COCc2ccc(cn2)Br 34a_100011996381_100000702658 [0,2,0,0,0,0|2,0,0]=4 20076 B18R2.9237 Cc1ccncc1COCc2ccc(cn2)Cl 34a_100000703999_100000690890 [0,2,0,0,0,0|2,0,0]=4 20077 B18R2.9237 Cc1ccncc1COCc2ccc(cn2)Cl 34a_100011996381_100012066911 [0,2,0,0,0,0|2,0,0]=4 20078 B18R2.9237 Cc1ccncc1COCc2ccc(cn2)F 34a_100011996381_100000703193 [0,2,0,0,0,0|2,0,0]=4 20079 B18R2.9237 Cc1ccncc1COCc2ccc(cn2)F 34a_100011999454_100000690890 [0,2,0,0,0,0|2,0,0]=4 20080 B18R2.9237 Cc1ccncc1COCc2ccc(cn2)N 34a_100011998161_100000690890 [0,2,0,0,0,0|2,0,0]=4 20081 B18R2.9237 Cc1ccncc1COCc2ccc(nc2)Br 34a_100009816760_100000690890 [0,2,0,0,0,0|2,0,0]=4 20082 B18R2.9237 Cc1ccncc1COCc2ccc(nc2)Br 34a_100011996381_100009831999 [0,2,0,0,0,0|2,0,0]=4 20083 B18R2.9237 Cc1ccncc1COCc2ccc(nc2)Br 7a_100009816760_100000690890 [0,2,0,0,0,0|2,0,0]=4 20084 B18R2.9237 Cc1ccncc1COCc2ccc(nc2)Cl 34a_100000755211_100000690890 [0,2,0,0,0,0|2,0,0]=4 20085 B18R2.9237 Cc1ccncc1COCc2ccc(nc2)Cl 34a_100011996381_100000735431 [0,2,0,0,0,0|2,0,0]=4 20086 B18R2.9237 Cc1ccncc1COCc2ccc(nc2)Cl 7a_100000755211_100000690890 [0,2,0,0,0,0|2,0,0]=4 20087 B18R2.9237 Cc1ccncc1COCc2ccc(nc2)F 34a_100000079959_100000690890 [0,2,0,0,0,0|2,0,0]=4 20088 B18R2.9237 Cc1ccncc1COCc2ccc(nc2)F 34a_100011996381_100000099788 [0,2,0,0,0,0|2,0,0]=4 20089 B18R2.9237 Cc1ccncc1COCc2ccc(nc2)N 34a_100000704267_100000690890 [0,2,0,0,0,0|2,0,0]=4 20090 B18R2.9237 Cc1ccncc1CSCc2ccc(cc2)Br 62a_100000189115_100000690890 [0,2,0,0,0,0|1,1,0]=4 20091 B18R2.9237 Cc1ccncc1CSCc2ccc(cc2)Br 62a_100000690890_100000189115 [0,2,0,0,0,0|1,1,0]=4 20092 B18R2.9237 Cc1ccncc1CSCc2ccc(cc2)Cl 62a_100000187161_100000690890 [0,2,0,0,0,0|1,1,0]=4 20093 B18R2.9237 Cc1ccncc1CSCc2ccc(cc2)Cl 62a_100000690890_100000187161 [0,2,0,0,0,0|1,1,0]=4 20094 B18R2.9237 Cc1ccncc1CSCc2ccc(cc2)F 62a_100000198546_100000690890 [0,2,0,0,0,0|1,1,0]=4 20095 B18R2.9237 Cc1ccncc1CSCc2ccc(cc2)F 62a_100000690890_100000187164 [0,2,0,0,0,0|1,1,0]=4 20096 B18R2.9237 Cc1ccncc1CSCc2ccc(cc2)I 62a_100000189116_100000690890 [0,2,0,0,0,0|1,1,0]=4 20097 B18R2.9237 Cc1ccncc1CSCc2ccc(cc2)I 62a_100000690890_100000189116 [0,2,0,0,0,0|1,1,0]=4 20098 B18R2.9237 Cc1cnc(cn1)COCc2ccccc2Br 34a_100011273949_100000184730 [0,2,0,0,0,0|2,0,0]=4 20099 B18R2.9237 Cc1cnc(cn1)COCc2ccccc2Br 7a_100000756307_100000752025 [0,2,0,0,0,0|2,0,0]=4 20100 B18R2.9237 Cc1cnc(cn1)COCc2ccccc2C 34a_100011273949_100000211839 [0,2,0,0,0,0|2,0,0]=4 20101 B18R2.9237 Cc1cnc(cn1)COCc2ccccc2C 7a_100000698903_100000752025 [0,2,0,0,0,0|2,0,0]=4 20102 B18R2.9237 Cc1cnc(cn1)COCc2ccccc2Cl 34a_100011273949_100000187162 [0,2,0,0,0,0|2,0,0]=4 20103 B18R2.9237 Cc1cnc(cn1)COCc2ccccc2Cl 7a_100000210847_100000752025 [0,2,0,0,0,0|2,0,0]=4 20104 B18R2.9237 Cc1cnc(cn1)COCc2ccccc2F 34a_100011273949_100000211605 [0,2,0,0,0,0|2,0,0]=4 20105 B18R2.9237 Cc1cnc(cn1)COCc2ccccc2F 7a_100000211962_100000752025 [0,2,0,0,0,0|2,0,0]=4 20106 B18R2.9237 Cc1cnc(cn1)COCc2ccccc2I 34a_100011273949_100011215278 [0,2,0,0,0,0|2,0,0]=4 20107 B18R2.9237 Cc1cnc(cn1)COCc2ccccc2I 7a_100000187465_100000752025 [0,2,0,0,0,0|2,0,0]=4 20108 B18R2.9237 Cc1cnc(nc1)COCc2ccccc2Br 34a_100000756307_100000685645 [0,2,0,0,0,0|2,0,0]=4 20109 B18R2.9237 Cc1cnc(nc1)COCc2ccccc2Br 7a_100000756307_100000685645 [0,2,0,0,0,0|2,0,0]=4 20110 B18R2.9237 Cc1cnc(nc1)COCc2ccccc2C 34a_100000698903_100000685645 [0,2,0,0,0,0|2,0,0]=4 20111 B18R2.9237 Cc1cnc(nc1)COCc2ccccc2C 7a_100000698903_100000685645 [0,2,0,0,0,0|2,0,0]=4 20112 B18R2.9237 Cc1cnc(nc1)COCc2ccccc2Cl 34a_100000210847_100000685645 [0,2,0,0,0,0|2,0,0]=4 20113 B18R2.9237 Cc1cnc(nc1)COCc2ccccc2Cl 7a_100000210847_100000685645 [0,2,0,0,0,0|2,0,0]=4 20114 B18R2.9237 Cc1cnc(nc1)COCc2ccccc2F 34a_100000211962_100000685645 [0,2,0,0,0,0|2,0,0]=4 20115 B18R2.9237 Cc1cnc(nc1)COCc2ccccc2F 7a_100000211962_100000685645 [0,2,0,0,0,0|2,0,0]=4 20116 B18R2.9237 Cc1cnc(nc1)COCc2ccccc2I 34a_100000187465_100000685645 [0,2,0,0,0,0|2,0,0]=4 20117 B18R2.9237 Cc1cnc(nc1)COCc2ccccc2I 7a_100000187465_100000685645 [0,2,0,0,0,0|2,0,0]=4 20118 B18R2.9237 Cc1cnc(nc1)COCc2ccccc2N 34a_100000212039_100000685645 [0,2,0,0,0,0|2,0,0]=4 20119 B18R2.9237 Cc1cnccc1CNCc2ccc(cc2)Br 207a_100000708811_100000186029 [0,2,0,0,0,0|2,0,0]=4 20120 B18R2.9237 Cc1cnccc1CNCc2ccc(cc2)Br 2230a_100000174875_100020672808 [0,2,0,0,0,0|2,0,0]=4 20121 B18R2.9237 Cc1cnccc1CNCc2ccc(cc2)Br 270004a_100000708811_100000186029 [0,2,0,0,0,0|2,0,0]=4 20122 B18R2.9237 Cc1cnccc1CNCc2ccc(cc2)Br 34a_100000174875_100020672809 [0,2,0,0,0,0|2,0,0]=4 20123 B18R2.9237 Cc1cnccc1CNCc2ccc(cc2)Cl 207a_100000708811_100000189385 [0,2,0,0,0,0|2,0,0]=4 20124 B18R2.9237 Cc1cnccc1CNCc2ccc(cc2)Cl 2230a_100000174871_100020672808 [0,2,0,0,0,0|2,0,0]=4 20125 B18R2.9237 Cc1cnccc1CNCc2ccc(cc2)Cl 270004a_100000708811_100000189385 [0,2,0,0,0,0|2,0,0]=4 20126 B18R2.9237 Cc1cnccc1CNCc2ccc(cc2)Cl 34a_100000174871_100020672809 [0,2,0,0,0,0|2,0,0]=4 20127 B18R2.9237 Cc1cnccc1CNCc2ccc(cc2)F 207a_100000708811_100000210084 [0,2,0,0,0,0|2,0,0]=4 20128 B18R2.9237 Cc1cnccc1CNCc2ccc(cc2)F 2230a_100000174882_100020672808 [0,2,0,0,0,0|2,0,0]=4 20129 B18R2.9237 Cc1cnccc1CNCc2ccc(cc2)F 270004a_100000708811_100000210084 [0,2,0,0,0,0|2,0,0]=4 20130 B18R2.9237 Cc1cnccc1CNCc2ccc(cc2)F 34a_100000174882_100020672809 [0,2,0,0,0,0|2,0,0]=4 20131 B18R2.9237 Cc1cnccc1CNCc2ccc(cc2)I 207a_100000708811_100000188517 [0,2,0,0,0,0|2,0,0]=4 20132 B18R2.9237 Cc1cnccc1CNCc2ccc(cc2)I 2230a_100016989417_100020672808 [0,2,0,0,0,0|2,0,0]=4 20133 B18R2.9237 Cc1cnccc1CNCc2ccc(cc2)I 34a_100016989417_100020672809 [0,2,0,0,0,0|2,0,0]=4 20134 B18R2.9237 Cc1cnccc1CNCc2ccc(cc2)O 34a_100000185549_100020672809 [0,2,0,0,0,0|2,0,0]=4 20135 B18R2.9237 Cc1cnccc1COCc2cc[n+](cc2)C 34a_100009831711_100020672809 [0,2,0,0,0,0|2,0,0]=4 20136 B18R2.9237 Cc1cnccc1COCc2cc[n+](cc2)[O-] 34a_100000031831_100020672809 [0,2,0,0,0,0|2,0,0]=4 20137 B18R2.9237 Cc1cnccc1COCc2cc[n+](cc2)[O-] 7a_100000031831_100020672808 [0,2,0,0,0,0|2,0,0]=4 20138 B18R2.9237 Cc1cnccc1COCc2ccc(=O)[nH]c2 34a_100011999846_100020672809 [0,2,0,0,0,0|2,0,0]=4 20139 B18R2.9237 Cc1cnccc1COCc2ccc(cc2)Br 34a_100000695286_100020672809 [0,2,0,0,0,0|1,0,0]=3 20140 B18R2.9237 Cc1cnccc1COCc2ccc(cc2)Br 34a_100011997032_100000189115 [0,2,0,0,0,0|1,0,0]=3 20141 B18R2.9237 Cc1cnccc1COCc2ccc(cc2)Cl 34a_100000211118_100020672809 [0,2,0,0,0,0|1,0,0]=3 20142 B18R2.9237 Cc1cnccc1COCc2ccc(cc2)Cl 34a_100011997032_100000694040 [0,2,0,0,0,0|1,0,0]=3 20143 B18R2.9237 Cc1cnccc1COCc2ccc(cc2)Cl 7a_100000211118_100020672808 [0,2,0,0,0,0|1,0,0]=3 20144 B18R2.9237 Cc1cnccc1COCc2ccc(cc2)F 34a_100000210977_100020672809 [0,2,0,0,0,0|1,0,0]=3 20145 B18R2.9237 Cc1cnccc1COCc2ccc(cc2)F 34a_100011997032_100000198546 [0,2,0,0,0,0|1,0,0]=3 20146 B18R2.9237 Cc1cnccc1COCc2ccc(cc2)F 7a_100000210977_100020672808 [0,2,0,0,0,0|1,0,0]=3 20147 B18R2.9237 Cc1cnccc1COCc2ccc(cc2)I 34a_100000690907_100020672809 [0,2,0,0,0,0|1,0,0]=3 20148 B18R2.9237 Cc1cnccc1COCc2ccc(cc2)I 34a_100011997032_100000189116 [0,2,0,0,0,0|1,0,0]=3 20149 B18R2.9237 Cc1cnccc1COCc2ccc(cc2)I 7a_100000690907_100020672808 [0,2,0,0,0,0|1,0,0]=3 20150 B18R2.9237 Cc1cnccc1COCc2ccc(cc2)N 34a_100011215238_100020672809 [0,2,0,0,0,0|1,0,0]=3 20151 B18R2.9237 Cc1cnccc1COCc2ccc(cn2)Br 34a_100000754261_100020672809 [0,2,0,0,0,0|2,0,0]=4 20152 B18R2.9237 Cc1cnccc1COCc2ccc(cn2)Br 34a_100011997032_100000702658 [0,2,0,0,0,0|2,0,0]=4 20153 B18R2.9237 Cc1cnccc1COCc2ccc(cn2)Cl 34a_100000703999_100020672809 [0,2,0,0,0,0|2,0,0]=4 20154 B18R2.9237 Cc1cnccc1COCc2ccc(cn2)Cl 34a_100011997032_100012066911 [0,2,0,0,0,0|2,0,0]=4 20155 B18R2.9237 Cc1cnccc1COCc2ccc(cn2)F 34a_100011997032_100000703193 [0,2,0,0,0,0|2,0,0]=4 20156 B18R2.9237 Cc1cnccc1COCc2ccc(cn2)F 34a_100011999454_100020672809 [0,2,0,0,0,0|2,0,0]=4 20157 B18R2.9237 Cc1cnccc1COCc2ccc(cn2)N 34a_100011998161_100020672809 [0,2,0,0,0,0|2,0,0]=4 20158 B18R2.9237 Cc1cnccc1COCc2ccc(nc2)Br 34a_100009816760_100020672809 [0,2,0,0,0,0|2,0,0]=4 20159 B18R2.9237 Cc1cnccc1COCc2ccc(nc2)Br 34a_100011997032_100009831999 [0,2,0,0,0,0|2,0,0]=4 20160 B18R2.9237 Cc1cnccc1COCc2ccc(nc2)Br 7a_100009816760_100020672808 [0,2,0,0,0,0|2,0,0]=4 20161 B18R2.9237 Cc1cnccc1COCc2ccc(nc2)Cl 34a_100000755211_100020672809 [0,2,0,0,0,0|2,0,0]=4 20162 B18R2.9237 Cc1cnccc1COCc2ccc(nc2)Cl 34a_100011997032_100000735431 [0,2,0,0,0,0|2,0,0]=4 20163 B18R2.9237 Cc1cnccc1COCc2ccc(nc2)Cl 7a_100000755211_100020672808 [0,2,0,0,0,0|2,0,0]=4 20164 B18R2.9237 Cc1cnccc1COCc2ccc(nc2)F 34a_100000079959_100020672809 [0,2,0,0,0,0|2,0,0]=4 20165 B18R2.9237 Cc1cnccc1COCc2ccc(nc2)F 34a_100011997032_100000099788 [0,2,0,0,0,0|2,0,0]=4 20166 B18R2.9237 Cc1cnccc1COCc2ccc(nc2)N 34a_100000704267_100020672809 [0,2,0,0,0,0|2,0,0]=4 20167 B18R2.9237 Cc1cnccc1CSCc2ccc(cc2)Br 62a_100000189115_100020672808 [0,2,0,0,0,0|1,1,0]=4 20168 B18R2.9237 Cc1cnccc1CSCc2ccc(cc2)Br 62a_100020672808_100000189115 [0,2,0,0,0,0|1,1,0]=4 20169 B18R2.9237 Cc1cnccc1CSCc2ccc(cc2)Cl 62a_100000187161_100020672808 [0,2,0,0,0,0|1,1,0]=4 20170 B18R2.9237 Cc1cnccc1CSCc2ccc(cc2)Cl 62a_100020672808_100000187161 [0,2,0,0,0,0|1,1,0]=4 20171 B18R2.9237 Cc1cnccc1CSCc2ccc(cc2)F 62a_100000198546_100020672808 [0,2,0,0,0,0|1,1,0]=4 20172 B18R2.9237 Cc1cnccc1CSCc2ccc(cc2)F 62a_100020672808_100000187164 [0,2,0,0,0,0|1,1,0]=4 20173 B18R2.9237 Cc1cnccc1CSCc2ccc(cc2)I 62a_100000189116_100020672808 [0,2,0,0,0,0|1,1,0]=4 20174 B18R2.9237 Cc1cnccc1CSCc2ccc(cc2)I 62a_100020672808_100000189116 [0,2,0,0,0,0|1,1,0]=4 20175 B18R2.9237 Cc1ncc(cn1)COCc2ccccc2Br 34a_100011746891_100000184730 [0,2,0,0,0,0|2,0,0]=4 20176 B18R2.9237 Cc1ncc(cn1)COCc2ccccc2C 34a_100011746891_100000211839 [0,2,0,0,0,0|2,0,0]=4 20177 B18R2.9237 Cc1ncc(cn1)COCc2ccccc2Cl 34a_100011746891_100000187162 [0,2,0,0,0,0|2,0,0]=4 20178 B18R2.9237 Cc1ncc(cn1)COCc2ccccc2F 34a_100011746891_100000211605 [0,2,0,0,0,0|2,0,0]=4 20179 B18R2.9237 Cc1ncc(cn1)COCc2ccccc2I 34a_100011746891_100011215278 [0,2,0,0,0,0|2,0,0]=4 20180 B18R2.9237 Cc1ncccc1CNCc2ccc(cc2)Br 207a_100000174875_100000751968 [0,2,0,0,0,0|2,0,0]=4 20181 B18R2.9237 Cc1ncccc1CNCc2ccc(cc2)Br 2230a_100000174875_100000732876 [0,2,0,0,0,0|2,0,0]=4 20182 B18R2.9237 Cc1ncccc1CNCc2ccc(cc2)Br 270004a_100000174875_100000751968 [0,2,0,0,0,0|2,0,0]=4 20183 B18R2.9237 Cc1ncccc1CNCc2ccc(cc2)Br 34a_100000174875_100000732876 [0,2,0,0,0,0|2,0,0]=4 20184 B18R2.9237 Cc1ncccc1CNCc2ccc(cc2)Cl 207a_100000174871_100000751968 [0,2,0,0,0,0|2,0,0]=4 20185 B18R2.9237 Cc1ncccc1CNCc2ccc(cc2)Cl 2230a_100000174871_100000732876 [0,2,0,0,0,0|2,0,0]=4 20186 B18R2.9237 Cc1ncccc1CNCc2ccc(cc2)Cl 270004a_100000174871_100000751968 [0,2,0,0,0,0|2,0,0]=4 20187 B18R2.9237 Cc1ncccc1CNCc2ccc(cc2)Cl 34a_100000174871_100000732876 [0,2,0,0,0,0|2,0,0]=4 20188 B18R2.9237 Cc1ncccc1CNCc2ccc(cc2)F 207a_100000174882_100000751968 [0,2,0,0,0,0|2,0,0]=4 20189 B18R2.9237 Cc1ncccc1CNCc2ccc(cc2)F 2230a_100000174882_100000732876 [0,2,0,0,0,0|2,0,0]=4 20190 B18R2.9237 Cc1ncccc1CNCc2ccc(cc2)F 270004a_100000174882_100000751968 [0,2,0,0,0,0|2,0,0]=4 20191 B18R2.9237 Cc1ncccc1CNCc2ccc(cc2)F 34a_100000174882_100000732876 [0,2,0,0,0,0|2,0,0]=4 20192 B18R2.9237 Cc1ncccc1CNCc2ccc(cc2)I 207a_100016989417_100000751968 [0,2,0,0,0,0|2,0,0]=4 20193 B18R2.9237 Cc1ncccc1CNCc2ccc(cc2)I 2230a_100016989417_100000732876 [0,2,0,0,0,0|2,0,0]=4 20194 B18R2.9237 Cc1ncccc1CNCc2ccc(cc2)I 270004a_100016989417_100000751968 [0,2,0,0,0,0|2,0,0]=4 20195 B18R2.9237 Cc1ncccc1CNCc2ccc(cc2)I 34a_100016989417_100000732876 [0,2,0,0,0,0|2,0,0]=4 20196 B18R2.9237 Cc1ncccc1CNCc2ccc(cc2)O 34a_100000185549_100000732876 [0,2,0,0,0,0|2,0,0]=4 20197 B18R2.9237 Cc1ncccc1COCc2cc[n+](cc2)C 34a_100009831711_100000732876 [0,2,0,0,0,0|2,0,0]=4 20198 B18R2.9237 Cc1ncccc1COCc2cc[n+](cc2)[O-] 34a_100000031831_100000732876 [0,2,0,0,0,0|2,0,0]=4 20199 B18R2.9237 Cc1ncccc1COCc2cc[n+](cc2)[O-] 7a_100000031831_100000732876 [0,2,0,0,0,0|2,0,0]=4 20200 B18R2.9237 Cc1ncccc1COCc2ccc(=O)[nH]c2 34a_100011999846_100000732876 [0,2,0,0,0,0|2,0,0]=4 20201 B18R2.9237 Cc1ncccc1COCc2ccc(cc2)Br 34a_100000695286_100000732876 [0,2,0,0,0,0|1,0,0]=3 20202 B18R2.9237 Cc1ncccc1COCc2ccc(cc2)Br 34a_100000729262_100000189115 [0,2,0,0,0,0|1,0,0]=3 20203 B18R2.9237 Cc1ncccc1COCc2ccc(cc2)Br 7a_100000729262_100011217064 [0,2,0,0,0,0|1,0,0]=3 20204 B18R2.9237 Cc1ncccc1COCc2ccc(cc2)Cl 34a_100000211118_100000732876 [0,2,0,0,0,0|1,0,0]=3 20205 B18R2.9237 Cc1ncccc1COCc2ccc(cc2)Cl 34a_100000729262_100000694040 [0,2,0,0,0,0|1,0,0]=3 20206 B18R2.9237 Cc1ncccc1COCc2ccc(cc2)Cl 7a_100000211118_100000732876 [0,2,0,0,0,0|1,0,0]=3 20207 B18R2.9237 Cc1ncccc1COCc2ccc(cc2)Cl 7a_100000729262_100000187161 [0,2,0,0,0,0|1,0,0]=3 20208 B18R2.9237 Cc1ncccc1COCc2ccc(cc2)F 34a_100000210977_100000732876 [0,2,0,0,0,0|1,0,0]=3 20209 B18R2.9237 Cc1ncccc1COCc2ccc(cc2)F 34a_100000729262_100000198546 [0,2,0,0,0,0|1,0,0]=3 20210 B18R2.9237 Cc1ncccc1COCc2ccc(cc2)F 7a_100000210977_100000732876 [0,2,0,0,0,0|1,0,0]=3 20211 B18R2.9237 Cc1ncccc1COCc2ccc(cc2)F 7a_100000729262_100000198546 [0,2,0,0,0,0|1,0,0]=3 20212 B18R2.9237 Cc1ncccc1COCc2ccc(cc2)I 34a_100000690907_100000732876 [0,2,0,0,0,0|1,0,0]=3 20213 B18R2.9237 Cc1ncccc1COCc2ccc(cc2)I 34a_100000729262_100000189116 [0,2,0,0,0,0|1,0,0]=3 20214 B18R2.9237 Cc1ncccc1COCc2ccc(cc2)I 7a_100000690907_100000732876 [0,2,0,0,0,0|1,0,0]=3 20215 B18R2.9237 Cc1ncccc1COCc2ccc(cc2)I 7a_100000729262_100000189116 [0,2,0,0,0,0|1,0,0]=3 20216 B18R2.9237 Cc1ncccc1COCc2ccc(cc2)N 34a_100011215238_100000732876 [0,2,0,0,0,0|1,0,0]=3 20217 B18R2.9237 Cc1ncccc1COCc2ccc(cn2)Br 34a_100000729262_100000702658 [0,2,0,0,0,0|2,0,0]=4 20218 B18R2.9237 Cc1ncccc1COCc2ccc(cn2)Br 34a_100000754261_100000732876 [0,2,0,0,0,0|2,0,0]=4 20219 B18R2.9237 Cc1ncccc1COCc2ccc(cn2)Br 7a_100000729262_100000702658 [0,2,0,0,0,0|2,0,0]=4 20220 B18R2.9237 Cc1ncccc1COCc2ccc(cn2)Cl 34a_100000703999_100000732876 [0,2,0,0,0,0|2,0,0]=4 20221 B18R2.9237 Cc1ncccc1COCc2ccc(cn2)Cl 34a_100000729262_100012066911 [0,2,0,0,0,0|2,0,0]=4 20222 B18R2.9237 Cc1ncccc1COCc2ccc(cn2)Cl 7a_100000729262_100012066911 [0,2,0,0,0,0|2,0,0]=4 20223 B18R2.9237 Cc1ncccc1COCc2ccc(cn2)F 34a_100000729262_100000703193 [0,2,0,0,0,0|2,0,0]=4 20224 B18R2.9237 Cc1ncccc1COCc2ccc(cn2)F 34a_100011999454_100000732876 [0,2,0,0,0,0|2,0,0]=4 20225 B18R2.9237 Cc1ncccc1COCc2ccc(cn2)F 7a_100000729262_100000703193 [0,2,0,0,0,0|2,0,0]=4 20226 B18R2.9237 Cc1ncccc1COCc2ccc(cn2)N 34a_100011998161_100000732876 [0,2,0,0,0,0|2,0,0]=4 20227 B18R2.9237 Cc1ncccc1COCc2ccc(nc2)Br 34a_100000729262_100009831999 [0,2,0,0,0,0|2,0,0]=4 20228 B18R2.9237 Cc1ncccc1COCc2ccc(nc2)Br 34a_100009816760_100000732876 [0,2,0,0,0,0|2,0,0]=4 20229 B18R2.9237 Cc1ncccc1COCc2ccc(nc2)Br 7a_100000729262_100009831999 [0,2,0,0,0,0|2,0,0]=4 20230 B18R2.9237 Cc1ncccc1COCc2ccc(nc2)Br 7a_100009816760_100000732876 [0,2,0,0,0,0|2,0,0]=4 20231 B18R2.9237 Cc1ncccc1COCc2ccc(nc2)Cl 34a_100000729262_100000735431 [0,2,0,0,0,0|2,0,0]=4 20232 B18R2.9237 Cc1ncccc1COCc2ccc(nc2)Cl 34a_100000755211_100000732876 [0,2,0,0,0,0|2,0,0]=4 20233 B18R2.9237 Cc1ncccc1COCc2ccc(nc2)Cl 7a_100000729262_100000735431 [0,2,0,0,0,0|2,0,0]=4 20234 B18R2.9237 Cc1ncccc1COCc2ccc(nc2)Cl 7a_100000755211_100000732876 [0,2,0,0,0,0|2,0,0]=4 20235 B18R2.9237 Cc1ncccc1COCc2ccc(nc2)F 34a_100000079959_100000732876 [0,2,0,0,0,0|2,0,0]=4 20236 B18R2.9237 Cc1ncccc1COCc2ccc(nc2)F 34a_100000729262_100000099788 [0,2,0,0,0,0|2,0,0]=4 20237 B18R2.9237 Cc1ncccc1COCc2ccc(nc2)F 7a_100000729262_100009820150 [0,2,0,0,0,0|2,0,0]=4 20238 B18R2.9237 Cc1ncccc1COCc2ccc(nc2)N 34a_100000704267_100000732876 [0,2,0,0,0,0|2,0,0]=4 20239 B18R2.9237 Cc1ncccc1CSCc2ccc(cc2)Br 62a_100000189115_100000732876 [0,2,0,0,0,0|1,1,0]=4 20240 B18R2.9237 Cc1ncccc1CSCc2ccc(cc2)Br 62a_100000732876_100000189115 [0,2,0,0,0,0|1,1,0]=4 20241 B18R2.9237 Cc1ncccc1CSCc2ccc(cc2)Cl 62a_100000187161_100000732876 [0,2,0,0,0,0|1,1,0]=4 20242 B18R2.9237 Cc1ncccc1CSCc2ccc(cc2)Cl 62a_100000732876_100000187161 [0,2,0,0,0,0|1,1,0]=4 20243 B18R2.9237 Cc1ncccc1CSCc2ccc(cc2)F 62a_100000198546_100000732876 [0,2,0,0,0,0|1,1,0]=4 20244 B18R2.9237 Cc1ncccc1CSCc2ccc(cc2)F 62a_100000732876_100000187164 [0,2,0,0,0,0|1,1,0]=4 20245 B18R2.9237 Cc1ncccc1CSCc2ccc(cc2)I 62a_100000189116_100000732876 [0,2,0,0,0,0|1,1,0]=4 20246 B18R2.9237 Cc1ncccc1CSCc2ccc(cc2)I 62a_100000732876_100000189116 [0,2,0,0,0,0|1,1,0]=4 20247 B18R2.9237 Clc1ccc(cc1)CCNc2ccccc2Br 34a_100000210017_100011713675 [0,2,0,0,0,0|2,0,0]=4 20248 B18R2.9237 Clc1ccc(cc1)CCNc2ccccc2Cl 34a_100000185783_100011713675 [0,2,0,0,0,0|2,0,0]=4 20249 B18R2.9237 Clc1ccc(cc1)CCNc2ccccc2I 34a_100000210053_100011713675 [0,2,0,0,0,0|2,0,0]=4 20250 B18R2.9237 Clc1ccc(cc1)CCOc2ccccc2Br 34a_100000181306_100011713675 [0,2,0,0,0,0|2,0,0]=4 20251 B18R2.9237 Clc1ccc(cc1)CCOc2ccccc2Br 7a_100000181306_100011713675 [0,2,0,0,0,0|2,0,0]=4 20252 B18R2.9237 Clc1ccc(cc1)CCOc2ccccc2Cl 34a_100000210172_100011713675 [0,2,0,0,0,0|2,0,0]=4 20253 B18R2.9237 Clc1ccc(cc1)CCOc2ccccc2Cl 7a_100000210172_100011713675 [0,2,0,0,0,0|2,0,0]=4 20254 B18R2.9237 Clc1ccc(cc1)CCOc2ccccc2I 34a_100000739446_100011713675 [0,2,0,0,0,0|2,0,0]=4 20255 B18R2.9237 Clc1ccc(cc1)CCOc2ccccc2I 7a_100000739446_100011713675 [0,2,0,0,0,0|2,0,0]=4 20256 B18R2.9237 Clc1ccc(cc1)CCSc2ccccc2Br 62a_100000695589_100011713675 [0,2,0,0,0,0|2,0,0]=4 20257 B18R2.9237 Clc1ccc(cc1)CCSc2ccccc2Br 62a_100011713675_100000695589 [0,2,0,0,0,0|2,0,0]=4 20258 B18R2.9237 Clc1ccc(cc1)CCSc2ccccc2Cl 62a_100000764095_100011713675 [0,2,0,0,0,0|2,0,0]=4 20259 B18R2.9237 Clc1ccc(cc1)CCSc2ccccc2Cl 62a_100011713675_100000764095 [0,2,0,0,0,0|2,0,0]=4 20260 B18R2.9237 Clc1ccc(cc1)CNCc2ccccc2Br 207a_100000174871_100000211189 [0,2,0,0,0,0|1,0,0]=3 20261 B18R2.9237 Clc1ccc(cc1)CNCc2ccccc2Br 207a_100000689332_100000189385 [0,2,0,0,0,0|1,0,0]=3 20262 B18R2.9237 Clc1ccc(cc1)CNCc2ccccc2Br 2230a_100000174871_100000184730 [0,2,0,0,0,0|1,0,0]=3 20263 B18R2.9237 Clc1ccc(cc1)CNCc2ccccc2Br 2230a_100000689332_100000694040 [0,2,0,0,0,0|1,0,0]=3 20264 B18R2.9237 Clc1ccc(cc1)CNCc2ccccc2Br 26a_100000174871_100000181306 [0,2,0,0,0,0|1,0,0]=3 20265 B18R2.9237 Clc1ccc(cc1)CNCc2ccccc2Br 270004a_100000174871_100000211189 [0,2,0,0,0,0|1,0,0]=3 20266 B18R2.9237 Clc1ccc(cc1)CNCc2ccccc2Br 270004a_100000689332_100000189385 [0,2,0,0,0,0|1,0,0]=3 20267 B18R2.9237 Clc1ccc(cc1)CNCc2ccccc2Br 34a_100000174871_100000184730 [0,2,0,0,0,0|1,0,0]=3 20268 B18R2.9237 Clc1ccc(cc1)CNCc2ccccc2Br 34a_100000689332_100000694040 [0,2,0,0,0,0|1,0,0]=3 20269 B18R2.9237 Clc1ccc(cc1)CNCc2ccccc2Cl 207a_100000174871_100000210073 [0,2,0,0,0,0|1,0,0]=3 20270 B18R2.9237 Clc1ccc(cc1)CNCc2ccccc2Cl 207a_100000174879_100000189385 [0,2,0,0,0,0|1,0,0]=3 20271 B18R2.9237 Clc1ccc(cc1)CNCc2ccccc2Cl 2230a_100000174871_100000187162 [0,2,0,0,0,0|1,0,0]=3 20272 B18R2.9237 Clc1ccc(cc1)CNCc2ccccc2Cl 2230a_100000174879_100000694040 [0,2,0,0,0,0|1,0,0]=3 20273 B18R2.9237 Clc1ccc(cc1)CNCc2ccccc2Cl 26a_100000174871_100000210172 [0,2,0,0,0,0|1,0,0]=3 20274 B18R2.9237 Clc1ccc(cc1)CNCc2ccccc2Cl 270004a_100000174871_100000210073 [0,2,0,0,0,0|1,0,0]=3 20275 B18R2.9237 Clc1ccc(cc1)CNCc2ccccc2Cl 270004a_100000174879_100000189385 [0,2,0,0,0,0|1,0,0]=3 20276 B18R2.9237 Clc1ccc(cc1)CNCc2ccccc2Cl 34a_100000174871_100000187162 [0,2,0,0,0,0|1,0,0]=3 20277 B18R2.9237 Clc1ccc(cc1)CNCc2ccccc2Cl 34a_100000174879_100000694040 [0,2,0,0,0,0|1,0,0]=3 20278 B18R2.9237 Clc1ccc(cc1)CNCc2ccccc2I 207a_100000174871_100000010305 [0,2,0,0,0,0|1,0,0]=3 20279 B18R2.9237 Clc1ccc(cc1)CNCc2ccccc2I 207a_100015347259_100000189385 [0,2,0,0,0,0|1,0,0]=3 20280 B18R2.9237 Clc1ccc(cc1)CNCc2ccccc2I 2230a_100000174871_100011215278 [0,2,0,0,0,0|1,0,0]=3 20281 B18R2.9237 Clc1ccc(cc1)CNCc2ccccc2I 270004a_100000174871_100000010305 [0,2,0,0,0,0|1,0,0]=3 20282 B18R2.9237 Clc1ccc(cc1)CNCc2ccccc2I 270004a_100015347259_100000189385 [0,2,0,0,0,0|1,0,0]=3 20283 B18R2.9237 Clc1ccc(cc1)CNCc2ccccc2I 34a_100000174871_100011215278 [0,2,0,0,0,0|1,0,0]=3 20284 B18R2.9237 Clc1ccc(cc1)CNCc2cccnc2Br 2230a_100000174871_100010140945 [0,2,0,0,0,0|2,0,0]=4 20285 B18R2.9237 Clc1ccc(cc1)CNCc2cccnc2Br 2230a_100009818023_100000694040 [0,2,0,0,0,0|2,0,0]=4 20286 B18R2.9237 Clc1ccc(cc1)CNCc2cccnc2Br 270004a_100009818023_100000189385 [0,2,0,0,0,0|2,0,0]=4 20287 B18R2.9237 Clc1ccc(cc1)CNCc2cccnc2Br 34a_100000174871_100010140945 [0,2,0,0,0,0|2,0,0]=4 20288 B18R2.9237 Clc1ccc(cc1)CNCc2cccnc2Br 34a_100009818023_100000694040 [0,2,0,0,0,0|2,0,0]=4 20289 B18R2.9237 Clc1ccc(cc1)CNCc2cccnc2Cl 207a_100015189234_100000189385 [0,2,0,0,0,0|2,0,0]=4 20290 B18R2.9237 Clc1ccc(cc1)CNCc2cccnc2Cl 2230a_100000174871_100000045678 [0,2,0,0,0,0|2,0,0]=4 20291 B18R2.9237 Clc1ccc(cc1)CNCc2cccnc2Cl 2230a_100015189234_100000694040 [0,2,0,0,0,0|2,0,0]=4 20292 B18R2.9237 Clc1ccc(cc1)CNCc2cccnc2Cl 34a_100000174871_100000045678 [0,2,0,0,0,0|2,0,0]=4 20293 B18R2.9237 Clc1ccc(cc1)CNCc2cccnc2Cl 34a_100015189234_100000694040 [0,2,0,0,0,0|2,0,0]=4 20294 B18R2.9237 Clc1ccc(cc1)CNCc2ccncc2Br 207a_100020640021_100000189385 [0,2,0,0,0,0|2,0,0]=4 20295 B18R2.9237 Clc1ccc(cc1)CNCc2ccncc2Br 270004a_100000174871_100000755692 [0,2,0,0,0,0|2,0,0]=4 20296 B18R2.9237 Clc1ccc(cc1)CNCc2ccncc2Br 270004a_100020640021_100000189385 [0,2,0,0,0,0|2,0,0]=4 20297 B18R2.9237 Clc1ccc(cc1)CNCc2ccncc2Cl 207a_100000174871_100011934409 [0,2,0,0,0,0|2,0,0]=4 20298 B18R2.9237 Clc1ccc(cc1)CNCc2ccncc2Cl 2230a_100000174871_100000763264 [0,2,0,0,0,0|2,0,0]=4 20299 B18R2.9237 Clc1ccc(cc1)CNCc2ccncc2Cl 270004a_100000174871_100011934409 [0,2,0,0,0,0|2,0,0]=4 20300 B18R2.9237 Clc1ccc(cc1)CNCc2cnccc2Br 270004a_100000174871_100009816821 [0,2,0,0,0,0|2,0,0]=4 20301 B18R2.9237 Clc1ccc(cc1)CNCc2cnccc2Cl 270004a_100000174871_100000050567 [0,2,0,0,0,0|2,0,0]=4 20302 B18R2.9237 Clc1ccc(cc1)CNCc2ncccc2Br 207a_100000174871_100011934733 [0,2,0,0,0,0|2,0,0]=4 20303 B18R2.9237 Clc1ccc(cc1)CNCc2ncccc2Br 2230a_100000174871_100025702911 [0,2,0,0,0,0|2,0,0]=4 20304 B18R2.9237 Clc1ccc(cc1)CNCc2ncccc2Br 270004a_100000174871_100011934733 [0,2,0,0,0,0|2,0,0]=4 20305 B18R2.9237 Clc1ccc(cc1)CNCc2ncccc2Br 270004a_100020591323_100000189385 [0,2,0,0,0,0|2,0,0]=4 20306 B18R2.9237 Clc1ccc(cc1)CNCc2ncccc2Br 34a_100000174871_100025702911 [0,2,0,0,0,0|2,0,0]=4 20307 B18R2.9237 Clc1ccc(cc1)CNCc2ncccc2Cl 207a_100000174871_100012001307 [0,2,0,0,0,0|2,0,0]=4 20308 B18R2.9237 Clc1ccc(cc1)CNCc2ncccc2Cl 2230a_100000174871_100000099807 [0,2,0,0,0,0|2,0,0]=4 20309 B18R2.9237 Clc1ccc(cc1)CNCc2ncccc2Cl 2230a_100015189233_100000694040 [0,2,0,0,0,0|2,0,0]=4 20310 B18R2.9237 Clc1ccc(cc1)CNCc2ncccc2Cl 270004a_100000174871_100012001307 [0,2,0,0,0,0|2,0,0]=4 20311 B18R2.9237 Clc1ccc(cc1)CNCc2ncccc2Cl 270004a_100015189233_100000189385 [0,2,0,0,0,0|2,0,0]=4 20312 B18R2.9237 Clc1ccc(cc1)COCc2ccccc2Br 34a_100000211118_100000184730 [0,2,0,0,0,0|0,0,0]=2 20313 B18R2.9237 Clc1ccc(cc1)COCc2ccccc2Br 34a_100000756307_100000694040 [0,2,0,0,0,0|0,0,0]=2 20314 B18R2.9237 Clc1ccc(cc1)COCc2ccccc2Br 7a_100000211118_100000184730 [0,2,0,0,0,0|0,0,0]=2 20315 B18R2.9237 Clc1ccc(cc1)COCc2ccccc2Br 7a_100000756307_100000187161 [0,2,0,0,0,0|0,0,0]=2 20316 B18R2.9237 Clc1ccc(cc1)COCc2ccccc2Cl 34a_100000210847_100000694040 [0,2,0,0,0,0|0,0,0]=2 20317 B18R2.9237 Clc1ccc(cc1)COCc2ccccc2Cl 34a_100000211118_100000187162 [0,2,0,0,0,0|0,0,0]=2 20318 B18R2.9237 Clc1ccc(cc1)COCc2ccccc2Cl 7a_100000210847_100000187161 [0,2,0,0,0,0|0,0,0]=2 20319 B18R2.9237 Clc1ccc(cc1)COCc2ccccc2Cl 7a_100000211118_100000187162 [0,2,0,0,0,0|0,0,0]=2 20320 B18R2.9237 Clc1ccc(cc1)COCc2ccccc2I 34a_100000187465_100000694040 [0,2,0,0,0,0|0,0,0]=2 20321 B18R2.9237 Clc1ccc(cc1)COCc2ccccc2I 34a_100000211118_100011215278 [0,2,0,0,0,0|0,0,0]=2 20322 B18R2.9237 Clc1ccc(cc1)COCc2ccccc2I 7a_100000187465_100000187161 [0,2,0,0,0,0|0,0,0]=2 20323 B18R2.9237 Clc1ccc(cc1)COCc2ccccc2I 7a_100000211118_100011215278 [0,2,0,0,0,0|0,0,0]=2 20324 B18R2.9237 Clc1ccc(cc1)COCc2cccnc2Br 34a_100000211118_100010140945 [0,2,0,0,0,0|1,0,0]=3 20325 B18R2.9237 Clc1ccc(cc1)COCc2cccnc2Br 34a_100000719692_100000694040 [0,2,0,0,0,0|1,0,0]=3 20326 B18R2.9237 Clc1ccc(cc1)COCc2cccnc2Br 7a_100000211118_100010140945 [0,2,0,0,0,0|1,0,0]=3 20327 B18R2.9237 Clc1ccc(cc1)COCc2cccnc2Br 7a_100000719692_100000187161 [0,2,0,0,0,0|1,0,0]=3 20328 B18R2.9237 Clc1ccc(cc1)COCc2cccnc2Cl 34a_100000211118_100000045678 [0,2,0,0,0,0|1,0,0]=3 20329 B18R2.9237 Clc1ccc(cc1)COCc2cccnc2Cl 34a_100000748726_100000694040 [0,2,0,0,0,0|1,0,0]=3 20330 B18R2.9237 Clc1ccc(cc1)COCc2cccnc2Cl 7a_100000211118_100000045678 [0,2,0,0,0,0|1,0,0]=3 20331 B18R2.9237 Clc1ccc(cc1)COCc2cccnc2Cl 7a_100000748726_100000187161 [0,2,0,0,0,0|1,0,0]=3 20332 B18R2.9237 Clc1ccc(cc1)COCc2ccncc2Cl 7a_100000211118_100000763264 [0,2,0,0,0,0|1,0,0]=3 20333 B18R2.9237 Clc1ccc(cc1)COCc2cnccc2Cl 34a_100000117392_100000694040 [0,2,0,0,0,0|1,0,0]=3 20334 B18R2.9237 Clc1ccc(cc1)COCc2ncccc2Br 34a_100000211118_100025702911 [0,2,0,0,0,0|1,0,0]=3 20335 B18R2.9237 Clc1ccc(cc1)COCc2ncccc2Br 34a_100011996772_100000694040 [0,2,0,0,0,0|1,0,0]=3 20336 B18R2.9237 Clc1ccc(cc1)COCc2ncccc2Br 7a_100000211118_100025702911 [0,2,0,0,0,0|1,0,0]=3 20337 B18R2.9237 Clc1ccc(cc1)COCc2ncccc2Cl 34a_100012002383_100000694040 [0,2,0,0,0,0|1,0,0]=3 20338 B18R2.9237 Clc1ccc(cc1)COCc2ncccc2Cl 7a_100000211118_100000099807 [0,2,0,0,0,0|1,0,0]=3 20339 B18R2.9237 Clc1ccc(cc1)COCc2nccnc2Cl 34a_100000057004_100000694040 [0,2,0,0,0,0|2,0,0]=4 20340 B18R2.9237 Clc1ccc(cc1)CSCc2ccccc2Br 62a_100000184730_100000187161 [0,2,0,0,0,0|0,1,0]=3 20341 B18R2.9237 Clc1ccc(cc1)CSCc2ccccc2Br 62a_100000187161_100000184730 [0,2,0,0,0,0|0,1,0]=3 20342 B18R2.9237 Clc1ccc(cc1)CSCc2ccccc2Cl 62a_100000187161_100000187162 [0,2,0,0,0,0|0,1,0]=3 20343 B18R2.9237 Clc1ccc(cc1)CSCc2ccccc2Cl 62a_100000187162_100000187161 [0,2,0,0,0,0|0,1,0]=3 20344 B18R2.9237 Clc1ccc(cc1)CSCc2ccccc2I 62a_100000187161_100011216222 [0,2,0,0,0,0|0,1,0]=3 20345 B18R2.9237 Clc1ccc(cc1)CSCc2ccccc2I 62a_100011216222_100000187161 [0,2,0,0,0,0|0,1,0]=3 20346 B18R2.9237 Clc1ccc(cc1)CSCc2cccnc2Br 62a_100000187161_100010140945 [0,2,0,0,0,0|1,1,0]=4 20347 B18R2.9237 Clc1ccc(cc1)CSCc2cccnc2Br 62a_100010140945_100000187161 [0,2,0,0,0,0|1,1,0]=4 20348 B18R2.9237 Clc1ccc(cc1)CSCc2cccnc2Cl 62a_100000045678_100000187161 [0,2,0,0,0,0|1,1,0]=4 20349 B18R2.9237 Clc1ccc(cc1)CSCc2cccnc2Cl 62a_100000187161_100000045678 [0,2,0,0,0,0|1,1,0]=4 20350 B18R2.9237 Clc1ccc(cc1)CSCc2ccncc2Cl 62a_100000187161_100000763264 [0,2,0,0,0,0|1,1,0]=4 20351 B18R2.9237 Clc1ccc(cc1)CSCc2ccncc2Cl 62a_100000763264_100000187161 [0,2,0,0,0,0|1,1,0]=4 20352 B18R2.9237 Clc1ccc(cc1)CSCc2ncccc2Br 62a_100000187161_100025702911 [0,2,0,0,0,0|1,1,0]=4 20353 B18R2.9237 Clc1ccc(cc1)CSCc2ncccc2Br 62a_100025702911_100000187161 [0,2,0,0,0,0|1,1,0]=4 20354 B18R2.9237 Clc1ccc(cc1)CSCc2ncccc2Cl 62a_100000099807_100000187161 [0,2,0,0,0,0|1,1,0]=4 20355 B18R2.9237 Clc1ccc(cc1)CSCc2ncccc2Cl 62a_100000187161_100000099807 [0,2,0,0,0,0|1,1,0]=4 20356 B18R2.9237 Clc1ccc(cc1)NCCc2ccccc2Br 2230a_100000210052_100012161201 [0,2,0,0,0,0|2,0,0]=4 20357 B18R2.9237 Clc1ccc(cc1)NCCc2ccccc2Br 34a_100000210052_100012161201 [0,2,0,0,0,0|2,0,0]=4 20358 B18R2.9237 Clc1ccc(cc1)NCCc2ccccc2Cl 2230a_100000210052_100011713703 [0,2,0,0,0,0|2,0,0]=4 20359 B18R2.9237 Clc1ccc(cc1)NCCc2ccccc2Cl 34a_100000210052_100011713703 [0,2,0,0,0,0|2,0,0]=4 20360 B18R2.9237 Clc1ccc(cc1)OCCc2ccccc2Br 34a_100000210216_100012161201 [0,2,0,0,0,0|2,0,0]=4 20361 B18R2.9237 Clc1ccc(cc1)OCCc2ccccc2Br 7a_100000210216_100012161201 [0,2,0,0,0,0|2,0,0]=4 20362 B18R2.9237 Clc1ccc(cc1)OCCc2ccccc2Cl 34a_100000210216_100011713703 [0,2,0,0,0,0|2,0,0]=4 20363 B18R2.9237 Clc1ccc(cc1)OCCc2ccccc2Cl 7a_100000210216_100011713703 [0,2,0,0,0,0|2,0,0]=4 20364 B18R2.9237 Clc1ccc(cc1)SCCc2ccccc2Br 62a_100000755918_100012161201 [0,2,0,0,0,0|2,0,0]=4 20365 B18R2.9237 Clc1ccc(cc1)SCCc2ccccc2Br 62a_100012161201_100000755918 [0,2,0,0,0,0|2,0,0]=4 20366 B18R2.9237 Clc1ccc(cc1)SCCc2ccccc2Cl 62a_100000755918_100011713703 [0,2,0,0,0,0|2,0,0]=4 20367 B18R2.9237 Clc1ccc(cc1)SCCc2ccccc2Cl 62a_100011713703_100000755918 [0,2,0,0,0,0|2,0,0]=4 20368 B18R2.9237 Clc1ccc(cn1)CNCc2ccccc2Br 207a_100000735879_100000211189 [0,2,0,0,0,0|2,0,0]=4 20369 B18R2.9237 Clc1ccc(cn1)CNCc2ccccc2Br 2230a_100000689332_100000735431 [0,2,0,0,0,0|2,0,0]=4 20370 B18R2.9237 Clc1ccc(cn1)CNCc2ccccc2Br 2230a_100000735879_100000184730 [0,2,0,0,0,0|2,0,0]=4 20371 B18R2.9237 Clc1ccc(cn1)CNCc2ccccc2Br 270004a_100000735879_100000211189 [0,2,0,0,0,0|2,0,0]=4 20372 B18R2.9237 Clc1ccc(cn1)CNCc2ccccc2Br 34a_100000689332_100000735431 [0,2,0,0,0,0|2,0,0]=4 20373 B18R2.9237 Clc1ccc(cn1)CNCc2ccccc2Br 34a_100000735879_100000184730 [0,2,0,0,0,0|2,0,0]=4 20374 B18R2.9237 Clc1ccc(cn1)CNCc2ccccc2Cl 207a_100000735879_100000210073 [0,2,0,0,0,0|2,0,0]=4 20375 B18R2.9237 Clc1ccc(cn1)CNCc2ccccc2Cl 2230a_100000174879_100000735431 [0,2,0,0,0,0|2,0,0]=4 20376 B18R2.9237 Clc1ccc(cn1)CNCc2ccccc2Cl 2230a_100000735879_100000187162 [0,2,0,0,0,0|2,0,0]=4 20377 B18R2.9237 Clc1ccc(cn1)CNCc2ccccc2Cl 270004a_100000735879_100000210073 [0,2,0,0,0,0|2,0,0]=4 20378 B18R2.9237 Clc1ccc(cn1)CNCc2ccccc2Cl 34a_100000174879_100000735431 [0,2,0,0,0,0|2,0,0]=4 20379 B18R2.9237 Clc1ccc(cn1)CNCc2ccccc2Cl 34a_100000735879_100000187162 [0,2,0,0,0,0|2,0,0]=4 20380 B18R2.9237 Clc1ccc(cn1)CNCc2ccccc2I 207a_100000735879_100000010305 [0,2,0,0,0,0|2,0,0]=4 20381 B18R2.9237 Clc1ccc(cn1)CNCc2ccccc2I 2230a_100000735879_100011215278 [0,2,0,0,0,0|2,0,0]=4 20382 B18R2.9237 Clc1ccc(cn1)CNCc2ccccc2I 270004a_100000735879_100000010305 [0,2,0,0,0,0|2,0,0]=4 20383 B18R2.9237 Clc1ccc(cn1)CNCc2ccccc2I 34a_100000735879_100011215278 [0,2,0,0,0,0|2,0,0]=4 20384 B18R2.9237 Clc1ccc(cn1)COCc2ccccc2Br 34a_100000755211_100000184730 [0,2,0,0,0,0|1,0,0]=3 20385 B18R2.9237 Clc1ccc(cn1)COCc2ccccc2Br 34a_100000756307_100000735431 [0,2,0,0,0,0|1,0,0]=3 20386 B18R2.9237 Clc1ccc(cn1)COCc2ccccc2Br 7a_100000755211_100000184730 [0,2,0,0,0,0|1,0,0]=3 20387 B18R2.9237 Clc1ccc(cn1)COCc2ccccc2Br 7a_100000756307_100000735431 [0,2,0,0,0,0|1,0,0]=3 20388 B18R2.9237 Clc1ccc(cn1)COCc2ccccc2Cl 34a_100000210847_100000735431 [0,2,0,0,0,0|1,0,0]=3 20389 B18R2.9237 Clc1ccc(cn1)COCc2ccccc2Cl 34a_100000755211_100000187162 [0,2,0,0,0,0|1,0,0]=3 20390 B18R2.9237 Clc1ccc(cn1)COCc2ccccc2Cl 7a_100000210847_100000735431 [0,2,0,0,0,0|1,0,0]=3 20391 B18R2.9237 Clc1ccc(cn1)COCc2ccccc2Cl 7a_100000755211_100000187162 [0,2,0,0,0,0|1,0,0]=3 20392 B18R2.9237 Clc1ccc(cn1)COCc2ccccc2I 34a_100000187465_100000735431 [0,2,0,0,0,0|1,0,0]=3 20393 B18R2.9237 Clc1ccc(cn1)COCc2ccccc2I 34a_100000755211_100011215278 [0,2,0,0,0,0|1,0,0]=3 20394 B18R2.9237 Clc1ccc(cn1)COCc2ccccc2I 7a_100000187465_100000735431 [0,2,0,0,0,0|1,0,0]=3 20395 B18R2.9237 Clc1ccc(cn1)COCc2ccccc2I 7a_100000755211_100011215278 [0,2,0,0,0,0|1,0,0]=3 20396 B18R2.9237 Clc1ccc(cn1)COCc2cccnc2Br 34a_100000719692_100000735431 [0,2,0,0,0,0|2,0,0]=4 20397 B18R2.9237 Clc1ccc(cn1)COCc2cccnc2Br 34a_100000755211_100010140945 [0,2,0,0,0,0|2,0,0]=4 20398 B18R2.9237 Clc1ccc(cn1)COCc2cccnc2Br 7a_100000719692_100000735431 [0,2,0,0,0,0|2,0,0]=4 20399 B18R2.9237 Clc1ccc(cn1)COCc2cccnc2Br 7a_100000755211_100010140945 [0,2,0,0,0,0|2,0,0]=4 20400 B18R2.9237 Clc1ccc(cn1)COCc2cccnc2Cl 34a_100000748726_100000735431 [0,2,0,0,0,0|2,0,0]=4 20401 B18R2.9237 Clc1ccc(cn1)COCc2cccnc2Cl 34a_100000755211_100000045678 [0,2,0,0,0,0|2,0,0]=4 20402 B18R2.9237 Clc1ccc(cn1)COCc2cccnc2Cl 7a_100000748726_100000735431 [0,2,0,0,0,0|2,0,0]=4 20403 B18R2.9237 Clc1ccc(cn1)COCc2cccnc2Cl 7a_100000755211_100000045678 [0,2,0,0,0,0|2,0,0]=4 20404 B18R2.9237 Clc1ccc(cn1)COCc2ccncc2Cl 7a_100000755211_100000763264 [0,2,0,0,0,0|2,0,0]=4 20405 B18R2.9237 Clc1ccc(cn1)COCc2cnccc2Cl 34a_100000117392_100000735431 [0,2,0,0,0,0|2,0,0]=4 20406 B18R2.9237 Clc1ccc(cn1)COCc2ncccc2Br 34a_100000755211_100025702911 [0,2,0,0,0,0|2,0,0]=4 20407 B18R2.9237 Clc1ccc(cn1)COCc2ncccc2Br 34a_100011996772_100000735431 [0,2,0,0,0,0|2,0,0]=4 20408 B18R2.9237 Clc1ccc(cn1)COCc2ncccc2Br 7a_100000755211_100025702911 [0,2,0,0,0,0|2,0,0]=4 20409 B18R2.9237 Clc1ccc(cn1)COCc2ncccc2Cl 34a_100012002383_100000735431 [0,2,0,0,0,0|2,0,0]=4 20410 B18R2.9237 Clc1ccc(cn1)COCc2ncccc2Cl 7a_100000755211_100000099807 [0,2,0,0,0,0|2,0,0]=4 20411 B18R2.9237 Clc1ccc(cn1)CSCc2ccccc2Br 62a_100000184730_100000735431 [0,2,0,0,0,0|1,1,0]=4 20412 B18R2.9237 Clc1ccc(cn1)CSCc2ccccc2Br 62a_100000735431_100000184730 [0,2,0,0,0,0|1,1,0]=4 20413 B18R2.9237 Clc1ccc(cn1)CSCc2ccccc2Cl 62a_100000187162_100000735431 [0,2,0,0,0,0|1,1,0]=4 20414 B18R2.9237 Clc1ccc(cn1)CSCc2ccccc2Cl 62a_100000735431_100000187162 [0,2,0,0,0,0|1,1,0]=4 20415 B18R2.9237 Clc1ccc(cn1)CSCc2ccccc2I 62a_100000735431_100011216222 [0,2,0,0,0,0|1,1,0]=4 20416 B18R2.9237 Clc1ccc(cn1)CSCc2ccccc2I 62a_100011216222_100000735431 [0,2,0,0,0,0|1,1,0]=4 20417 B18R2.9237 Clc1ccc(nc1)CNCc2ccccc2Br 207a_100000689332_100011361569 [0,2,0,0,0,0|2,0,0]=4 20418 B18R2.9237 Clc1ccc(nc1)CNCc2ccccc2Br 2230a_100000689332_100012066911 [0,2,0,0,0,0|2,0,0]=4 20419 B18R2.9237 Clc1ccc(nc1)CNCc2ccccc2Br 270004a_100000689332_100011361569 [0,2,0,0,0,0|2,0,0]=4 20420 B18R2.9237 Clc1ccc(nc1)CNCc2ccccc2Br 270004a_100000697193_100000211189 [0,2,0,0,0,0|2,0,0]=4 20421 B18R2.9237 Clc1ccc(nc1)CNCc2ccccc2Br 34a_100000689332_100012066911 [0,2,0,0,0,0|2,0,0]=4 20422 B18R2.9237 Clc1ccc(nc1)CNCc2ccccc2Br 34a_100000697193_100000184730 [0,2,0,0,0,0|2,0,0]=4 20423 B18R2.9237 Clc1ccc(nc1)CNCc2ccccc2Cl 207a_100000174879_100011361569 [0,2,0,0,0,0|2,0,0]=4 20424 B18R2.9237 Clc1ccc(nc1)CNCc2ccccc2Cl 2230a_100000174879_100012066911 [0,2,0,0,0,0|2,0,0]=4 20425 B18R2.9237 Clc1ccc(nc1)CNCc2ccccc2Cl 270004a_100000174879_100011361569 [0,2,0,0,0,0|2,0,0]=4 20426 B18R2.9237 Clc1ccc(nc1)CNCc2ccccc2Cl 270004a_100000697193_100000210073 [0,2,0,0,0,0|2,0,0]=4 20427 B18R2.9237 Clc1ccc(nc1)CNCc2ccccc2Cl 34a_100000174879_100012066911 [0,2,0,0,0,0|2,0,0]=4 20428 B18R2.9237 Clc1ccc(nc1)CNCc2ccccc2Cl 34a_100000697193_100000187162 [0,2,0,0,0,0|2,0,0]=4 20429 B18R2.9237 Clc1ccc(nc1)CNCc2ccccc2I 207a_100015347259_100011361569 [0,2,0,0,0,0|2,0,0]=4 20430 B18R2.9237 Clc1ccc(nc1)CNCc2ccccc2I 270004a_100000697193_100000010305 [0,2,0,0,0,0|2,0,0]=4 20431 B18R2.9237 Clc1ccc(nc1)CNCc2ccccc2I 270004a_100015347259_100011361569 [0,2,0,0,0,0|2,0,0]=4 20432 B18R2.9237 Clc1ccc(nc1)CNCc2ccccc2I 34a_100000697193_100011215278 [0,2,0,0,0,0|2,0,0]=4 20433 B18R2.9237 Clc1ccc(nc1)COCc2ccccc2Br 34a_100000703999_100000184730 [0,2,0,0,0,0|1,0,0]=3 20434 B18R2.9237 Clc1ccc(nc1)COCc2ccccc2Br 34a_100000756307_100012066911 [0,2,0,0,0,0|1,0,0]=3 20435 B18R2.9237 Clc1ccc(nc1)COCc2ccccc2Br 7a_100000756307_100012066911 [0,2,0,0,0,0|1,0,0]=3 20436 B18R2.9237 Clc1ccc(nc1)COCc2ccccc2Cl 34a_100000210847_100012066911 [0,2,0,0,0,0|1,0,0]=3 20437 B18R2.9237 Clc1ccc(nc1)COCc2ccccc2Cl 34a_100000703999_100000187162 [0,2,0,0,0,0|1,0,0]=3 20438 B18R2.9237 Clc1ccc(nc1)COCc2ccccc2Cl 7a_100000210847_100012066911 [0,2,0,0,0,0|1,0,0]=3 20439 B18R2.9237 Clc1ccc(nc1)COCc2ccccc2I 34a_100000187465_100012066911 [0,2,0,0,0,0|1,0,0]=3 20440 B18R2.9237 Clc1ccc(nc1)COCc2ccccc2I 34a_100000703999_100011215278 [0,2,0,0,0,0|1,0,0]=3 20441 B18R2.9237 Clc1ccc(nc1)COCc2ccccc2I 7a_100000187465_100012066911 [0,2,0,0,0,0|1,0,0]=3 20442 B18R2.9237 Clc1ccc(nc1)COCc2cccnc2Br 34a_100000703999_100010140945 [0,2,0,0,0,0|2,0,0]=4 20443 B18R2.9237 Clc1ccc(nc1)COCc2cccnc2Br 34a_100000719692_100012066911 [0,2,0,0,0,0|2,0,0]=4 20444 B18R2.9237 Clc1ccc(nc1)COCc2cccnc2Br 7a_100000719692_100012066911 [0,2,0,0,0,0|2,0,0]=4 20445 B18R2.9237 Clc1ccc(nc1)COCc2cccnc2Cl 34a_100000703999_100000045678 [0,2,0,0,0,0|2,0,0]=4 20446 B18R2.9237 Clc1ccc(nc1)COCc2cccnc2Cl 34a_100000748726_100012066911 [0,2,0,0,0,0|2,0,0]=4 20447 B18R2.9237 Clc1ccc(nc1)COCc2cccnc2Cl 7a_100000748726_100012066911 [0,2,0,0,0,0|2,0,0]=4 20448 B18R2.9237 Clc1ccc(nc1)COCc2cnccc2Cl 34a_100000117392_100012066911 [0,2,0,0,0,0|2,0,0]=4 20449 B18R2.9237 Clc1ccc(nc1)COCc2ncccc2Br 34a_100000703999_100025702911 [0,2,0,0,0,0|2,0,0]=4 20450 B18R2.9237 Clc1ccc(nc1)COCc2ncccc2Br 34a_100011996772_100012066911 [0,2,0,0,0,0|2,0,0]=4 20451 B18R2.9237 Clc1ccc(nc1)COCc2ncccc2Cl 34a_100012002383_100012066911 [0,2,0,0,0,0|2,0,0]=4 20452 B18R2.9237 Clc1ccc(nc1)CSCc2ccccc2Br 62a_100000184730_100000697101 [0,2,0,0,0,0|1,1,0]=4 20453 B18R2.9237 Clc1ccc(nc1)CSCc2ccccc2Br 62a_100012066911_100000184730 [0,2,0,0,0,0|1,1,0]=4 20454 B18R2.9237 Clc1ccc(nc1)CSCc2ccccc2Cl 62a_100000187162_100000697101 [0,2,0,0,0,0|1,1,0]=4 20455 B18R2.9237 Clc1ccc(nc1)CSCc2ccccc2Cl 62a_100012066911_100000187162 [0,2,0,0,0,0|1,1,0]=4 20456 B18R2.9237 Clc1ccc(nc1)CSCc2ccccc2I 62a_100011216222_100000697101 [0,2,0,0,0,0|1,1,0]=4 20457 B18R2.9237 Clc1ccc(nc1)CSCc2ccccc2I 62a_100012066911_100011216222 [0,2,0,0,0,0|1,1,0]=4 20458 B18R2.9237 Clc1ccc(nn1)COCc2ccccc2Br 34a_100000756307_100016992710 [0,2,0,0,0,0|2,0,0]=4 20459 B18R2.9237 Clc1ccc(nn1)COCc2ccccc2Br 7a_100000756307_100016992710 [0,2,0,0,0,0|2,0,0]=4 20460 B18R2.9237 Clc1ccc(nn1)COCc2ccccc2Cl 34a_100000210847_100016992710 [0,2,0,0,0,0|2,0,0]=4 20461 B18R2.9237 Clc1ccc(nn1)COCc2ccccc2Cl 7a_100000210847_100016992710 [0,2,0,0,0,0|2,0,0]=4 20462 B18R2.9237 Clc1ccc(nn1)COCc2ccccc2I 34a_100000187465_100016992710 [0,2,0,0,0,0|2,0,0]=4 20463 B18R2.9237 Clc1ccc(nn1)COCc2ccccc2I 7a_100000187465_100016992710 [0,2,0,0,0,0|2,0,0]=4 20464 B18R2.9237 Clc1ccccc1CCNc2ccc(cc2)Br 2230a_100000210018_100011713703 [0,2,0,0,0,0|2,0,0]=4 20465 B18R2.9237 Clc1ccccc1CCNc2ccc(cc2)Br 34a_100000210018_100011713703 [0,2,0,0,0,0|2,0,0]=4 20466 B18R2.9237 Clc1ccccc1CCNc2ccc(cc2)I 34a_100000185761_100011713703 [0,2,0,0,0,0|2,0,0]=4 20467 B18R2.9237 Clc1ccccc1CCOc2ccc(cc2)Br 34a_100000185759_100011713703 [0,2,0,0,0,0|2,0,0]=4 20468 B18R2.9237 Clc1ccccc1CCOc2ccc(cc2)Br 7a_100000185759_100011713703 [0,2,0,0,0,0|2,0,0]=4 20469 B18R2.9237 Clc1ccccc1CCOc2ccc(cc2)I 34a_100000212066_100011713703 [0,2,0,0,0,0|2,0,0]=4 20470 B18R2.9237 Clc1ccccc1CCOc2ccc(cc2)I 7a_100000212066_100011713703 [0,2,0,0,0,0|2,0,0]=4 20471 B18R2.9237 Clc1ccccc1CCSc2ccc(cc2)Br 62a_100000752885_100011713703 [0,2,0,0,0,0|2,0,0]=4 20472 B18R2.9237 Clc1ccccc1CCSc2ccc(cc2)Br 62a_100011713703_100000752885 [0,2,0,0,0,0|2,0,0]=4 20473 B18R2.9237 Clc1ccccc1CNCc2ccc(cc2)Br 207a_100000174875_100000210073 [0,2,0,0,0,0|1,0,0]=3 20474 B18R2.9237 Clc1ccccc1CNCc2ccc(cc2)Br 207a_100000174879_100000186029 [0,2,0,0,0,0|1,0,0]=3 20475 B18R2.9237 Clc1ccccc1CNCc2ccc(cc2)Br 2230a_100000174875_100000187162 [0,2,0,0,0,0|1,0,0]=3 20476 B18R2.9237 Clc1ccccc1CNCc2ccc(cc2)Br 2230a_100000174879_100011217064 [0,2,0,0,0,0|1,0,0]=3 20477 B18R2.9237 Clc1ccccc1CNCc2ccc(cc2)Br 26a_100000174875_100000210172 [0,2,0,0,0,0|1,0,0]=3 20478 B18R2.9237 Clc1ccccc1CNCc2ccc(cc2)Br 26a_100000174879_100000185759 [0,2,0,0,0,0|1,0,0]=3 20479 B18R2.9237 Clc1ccccc1CNCc2ccc(cc2)Br 270004a_100000174875_100000210073 [0,2,0,0,0,0|1,0,0]=3 20480 B18R2.9237 Clc1ccccc1CNCc2ccc(cc2)Br 270004a_100000174879_100000186029 [0,2,0,0,0,0|1,0,0]=3 20481 B18R2.9237 Clc1ccccc1CNCc2ccc(cc2)Br 34a_100000174875_100000187162 [0,2,0,0,0,0|1,0,0]=3 20482 B18R2.9237 Clc1ccccc1CNCc2ccc(cc2)Br 34a_100000174879_100000189115 [0,2,0,0,0,0|1,0,0]=3 20483 B18R2.9237 Clc1ccccc1CNCc2ccc(cc2)I 207a_100000174879_100000188517 [0,2,0,0,0,0|1,0,0]=3 20484 B18R2.9237 Clc1ccccc1CNCc2ccc(cc2)I 207a_100016989417_100000210073 [0,2,0,0,0,0|1,0,0]=3 20485 B18R2.9237 Clc1ccccc1CNCc2ccc(cc2)I 2230a_100000174879_100000189116 [0,2,0,0,0,0|1,0,0]=3 20486 B18R2.9237 Clc1ccccc1CNCc2ccc(cc2)I 2230a_100016989417_100000187162 [0,2,0,0,0,0|1,0,0]=3 20487 B18R2.9237 Clc1ccccc1CNCc2ccc(cc2)I 270004a_100016989417_100000210073 [0,2,0,0,0,0|1,0,0]=3 20488 B18R2.9237 Clc1ccccc1CNCc2ccc(cc2)I 34a_100000174879_100000189116 [0,2,0,0,0,0|1,0,0]=3 20489 B18R2.9237 Clc1ccccc1CNCc2ccc(cc2)I 34a_100016989417_100000187162 [0,2,0,0,0,0|1,0,0]=3 20490 B18R2.9237 Clc1ccccc1CNCc2ccc(cn2)Br 207a_100000174879_100000754260 [0,2,0,0,0,0|2,0,0]=4 20491 B18R2.9237 Clc1ccccc1CNCc2ccc(cn2)Br 2230a_100000174879_100000702658 [0,2,0,0,0,0|2,0,0]=4 20492 B18R2.9237 Clc1ccccc1CNCc2ccc(cn2)Br 270004a_100000174879_100000754260 [0,2,0,0,0,0|2,0,0]=4 20493 B18R2.9237 Clc1ccccc1CNCc2ccc(cn2)Br 34a_100000174879_100000702658 [0,2,0,0,0,0|2,0,0]=4 20494 B18R2.9237 Clc1ccccc1CNCc2ccc(cn2)Br 34a_100015188789_100000187162 [0,2,0,0,0,0|2,0,0]=4 20495 B18R2.9237 Clc1ccccc1CNCc2ccc(nc2)Br 207a_100009817727_100000210073 [0,2,0,0,0,0|2,0,0]=4 20496 B18R2.9237 Clc1ccccc1CNCc2ccc(nc2)Br 2230a_100000174879_100009831999 [0,2,0,0,0,0|2,0,0]=4 20497 B18R2.9237 Clc1ccccc1CNCc2ccc(nc2)Br 2230a_100009817727_100000187162 [0,2,0,0,0,0|2,0,0]=4 20498 B18R2.9237 Clc1ccccc1CNCc2ccc(nc2)Br 270004a_100009817727_100000210073 [0,2,0,0,0,0|2,0,0]=4 20499 B18R2.9237 Clc1ccccc1CNCc2ccc(nc2)Br 34a_100000174879_100009831999 [0,2,0,0,0,0|2,0,0]=4 20500 B18R2.9237 Clc1ccccc1CNCc2ccc(nc2)Br 34a_100009817727_100000187162 [0,2,0,0,0,0|2,0,0]=4 20501 B18R2.9237 Clc1ccccc1COCc2ccc(cc2)Br 34a_100000210847_100000189115 [0,2,0,0,0,0|0,0,0]=2 20502 B18R2.9237 Clc1ccccc1COCc2ccc(cc2)Br 34a_100000695286_100000187162 [0,2,0,0,0,0|0,0,0]=2 20503 B18R2.9237 Clc1ccccc1COCc2ccc(cc2)Br 7a_100000210847_100011217064 [0,2,0,0,0,0|0,0,0]=2 20504 B18R2.9237 Clc1ccccc1COCc2ccc(cc2)I 34a_100000210847_100000189116 [0,2,0,0,0,0|0,0,0]=2 20505 B18R2.9237 Clc1ccccc1COCc2ccc(cc2)I 34a_100000690907_100000187162 [0,2,0,0,0,0|0,0,0]=2 20506 B18R2.9237 Clc1ccccc1COCc2ccc(cc2)I 7a_100000210847_100000189116 [0,2,0,0,0,0|0,0,0]=2 20507 B18R2.9237 Clc1ccccc1COCc2ccc(cc2)I 7a_100000690907_100000187162 [0,2,0,0,0,0|0,0,0]=2 20508 B18R2.9237 Clc1ccccc1COCc2ccc(cn2)Br 34a_100000210847_100000702658 [0,2,0,0,0,0|1,0,0]=3 20509 B18R2.9237 Clc1ccccc1COCc2ccc(cn2)Br 34a_100000754261_100000187162 [0,2,0,0,0,0|1,0,0]=3 20510 B18R2.9237 Clc1ccccc1COCc2ccc(cn2)Br 7a_100000210847_100000702658 [0,2,0,0,0,0|1,0,0]=3 20511 B18R2.9237 Clc1ccccc1COCc2ccc(nc2)Br 34a_100000210847_100009831999 [0,2,0,0,0,0|1,0,0]=3 20512 B18R2.9237 Clc1ccccc1COCc2ccc(nc2)Br 34a_100009816760_100000187162 [0,2,0,0,0,0|1,0,0]=3 20513 B18R2.9237 Clc1ccccc1COCc2ccc(nc2)Br 7a_100000210847_100009831999 [0,2,0,0,0,0|1,0,0]=3 20514 B18R2.9237 Clc1ccccc1COCc2ccc(nc2)Br 7a_100009816760_100000187162 [0,2,0,0,0,0|1,0,0]=3 20515 B18R2.9237 Clc1ccccc1COCc2ncc(cn2)Br 34a_100000210847_100010064664 [0,2,0,0,0,0|2,0,0]=4 20516 B18R2.9237 Clc1ccccc1COCc2ncc(cn2)Br 7a_100000210847_100010064664 [0,2,0,0,0,0|2,0,0]=4 20517 B18R2.9237 Clc1ccccc1CSCc2ccc(cc2)Br 62a_100000187162_100000189115 [0,2,0,0,0,0|0,1,0]=3 20518 B18R2.9237 Clc1ccccc1CSCc2ccc(cc2)Br 62a_100000189115_100000187162 [0,2,0,0,0,0|0,1,0]=3 20519 B18R2.9237 Clc1ccccc1CSCc2ccc(cc2)I 62a_100000187162_100000189116 [0,2,0,0,0,0|0,1,0]=3 20520 B18R2.9237 Clc1ccccc1CSCc2ccc(cc2)I 62a_100000189116_100000187162 [0,2,0,0,0,0|0,1,0]=3 20521 B18R2.9237 Clc1ccccc1CSCc2ccc(cn2)Br 62a_100000187162_100000702658 [0,2,0,0,0,0|1,1,0]=4 20522 B18R2.9237 Clc1ccccc1CSCc2ccc(cn2)Br 62a_100000702658_100000187162 [0,2,0,0,0,0|1,1,0]=4 20523 B18R2.9237 Clc1ccccc1CSCc2ccc(nc2)Br 62a_100000187162_100009831999 [0,2,0,0,0,0|1,1,0]=4 20524 B18R2.9237 Clc1ccccc1CSCc2ccc(nc2)Br 62a_100009831999_100000187162 [0,2,0,0,0,0|1,1,0]=4 20525 B18R2.9237 Clc1ccccc1NCCc2ccc(cc2)Br 34a_100000185783_100011740612 [0,2,0,0,0,0|2,0,0]=4 20526 B18R2.9237 Clc1ccccc1OCCc2ccc(cc2)Br 34a_100000210172_100011740612 [0,2,0,0,0,0|2,0,0]=4 20527 B18R2.9237 Clc1ccccc1OCCc2ccc(cc2)Br 7a_100000210172_100011740612 [0,2,0,0,0,0|2,0,0]=4 20528 B18R2.9237 Clc1ccccc1SCCc2ccc(cc2)Br 62a_100000764095_100011740612 [0,2,0,0,0,0|2,0,0]=4 20529 B18R2.9237 Clc1ccccc1SCCc2ccc(cc2)Br 62a_100011740612_100000764095 [0,2,0,0,0,0|2,0,0]=4 20530 B18R2.9237 Clc1cccnc1CNCc2ccc(cc2)Br 207a_100000174875_100012001307 [0,2,0,0,0,0|2,0,0]=4 20531 B18R2.9237 Clc1cccnc1CNCc2ccc(cc2)Br 2230a_100000174875_100000099807 [0,2,0,0,0,0|2,0,0]=4 20532 B18R2.9237 Clc1cccnc1CNCc2ccc(cc2)Br 2230a_100015189233_100011217064 [0,2,0,0,0,0|2,0,0]=4 20533 B18R2.9237 Clc1cccnc1CNCc2ccc(cc2)Br 270004a_100000174875_100012001307 [0,2,0,0,0,0|2,0,0]=4 20534 B18R2.9237 Clc1cccnc1CNCc2ccc(cc2)Br 270004a_100015189233_100000186029 [0,2,0,0,0,0|2,0,0]=4 20535 B18R2.9237 Clc1cccnc1CNCc2ccc(cc2)I 207a_100016989417_100012001307 [0,2,0,0,0,0|2,0,0]=4 20536 B18R2.9237 Clc1cccnc1CNCc2ccc(cc2)I 2230a_100015189233_100000189116 [0,2,0,0,0,0|2,0,0]=4 20537 B18R2.9237 Clc1cccnc1CNCc2ccc(cc2)I 2230a_100016989417_100000099807 [0,2,0,0,0,0|2,0,0]=4 20538 B18R2.9237 Clc1cccnc1CNCc2ccc(cc2)I 270004a_100016989417_100012001307 [0,2,0,0,0,0|2,0,0]=4 20539 B18R2.9237 Clc1cccnc1COCc2ccc(cc2)Br 34a_100012002383_100000189115 [0,2,0,0,0,0|1,0,0]=3 20540 B18R2.9237 Clc1cccnc1COCc2ccc(cc2)I 34a_100012002383_100000189116 [0,2,0,0,0,0|1,0,0]=3 20541 B18R2.9237 Clc1cccnc1COCc2ccc(cc2)I 7a_100000690907_100000099807 [0,2,0,0,0,0|1,0,0]=3 20542 B18R2.9237 Clc1cccnc1COCc2ccc(cn2)Br 34a_100012002383_100000702658 [0,2,0,0,0,0|2,0,0]=4 20543 B18R2.9237 Clc1cccnc1COCc2ccc(nc2)Br 34a_100012002383_100009831999 [0,2,0,0,0,0|2,0,0]=4 20544 B18R2.9237 Clc1cccnc1COCc2ccc(nc2)Br 7a_100009816760_100000099807 [0,2,0,0,0,0|2,0,0]=4 20545 B18R2.9237 Clc1cccnc1CSCc2ccc(cc2)Br 62a_100000099807_100000189115 [0,2,0,0,0,0|1,1,0]=4 20546 B18R2.9237 Clc1cccnc1CSCc2ccc(cc2)Br 62a_100000189115_100000099807 [0,2,0,0,0,0|1,1,0]=4 20547 B18R2.9237 Clc1cccnc1CSCc2ccc(cc2)I 62a_100000099807_100000189116 [0,2,0,0,0,0|1,1,0]=4 20548 B18R2.9237 Clc1cccnc1CSCc2ccc(cc2)I 62a_100000189116_100000099807 [0,2,0,0,0,0|1,1,0]=4 20549 B18R2.9237 Clc1ccncc1CNCc2ccc(cc2)Br 270004a_100000174875_100000050567 [0,2,0,0,0,0|2,0,0]=4 20550 B18R2.9237 Clc1ccncc1CNCc2ccc(cc2)I 270004a_100016989417_100000050567 [0,2,0,0,0,0|2,0,0]=4 20551 B18R2.9237 Clc1ccncc1COCc2ccc(cc2)Br 34a_100000117392_100000189115 [0,2,0,0,0,0|1,0,0]=3 20552 B18R2.9237 Clc1ccncc1COCc2ccc(cc2)I 34a_100000117392_100000189116 [0,2,0,0,0,0|1,0,0]=3 20553 B18R2.9237 Clc1ccncc1COCc2ccc(cn2)Br 34a_100000117392_100000702658 [0,2,0,0,0,0|2,0,0]=4 20554 B18R2.9237 Clc1ccncc1COCc2ccc(nc2)Br 34a_100000117392_100009831999 [0,2,0,0,0,0|2,0,0]=4 20555 B18R2.9237 Clc1cnc(cn1)COCc2ccccc2Br 34a_100012002382_100000184730 [0,2,0,0,0,0|2,0,0]=4 20556 B18R2.9237 Clc1cnc(cn1)COCc2ccccc2Cl 34a_100012002382_100000187162 [0,2,0,0,0,0|2,0,0]=4 20557 B18R2.9237 Clc1cnc(cn1)COCc2ccccc2I 34a_100012002382_100011215278 [0,2,0,0,0,0|2,0,0]=4 20558 B18R2.9237 Clc1cnccc1CNCc2ccc(cc2)Br 207a_100000174875_100011934409 [0,2,0,0,0,0|2,0,0]=4 20559 B18R2.9237 Clc1cnccc1CNCc2ccc(cc2)Br 2230a_100000174875_100000763264 [0,2,0,0,0,0|2,0,0]=4 20560 B18R2.9237 Clc1cnccc1CNCc2ccc(cc2)Br 270004a_100000174875_100011934409 [0,2,0,0,0,0|2,0,0]=4 20561 B18R2.9237 Clc1cnccc1CNCc2ccc(cc2)I 207a_100016989417_100011934409 [0,2,0,0,0,0|2,0,0]=4 20562 B18R2.9237 Clc1cnccc1CNCc2ccc(cc2)I 2230a_100016989417_100000763264 [0,2,0,0,0,0|2,0,0]=4 20563 B18R2.9237 Clc1cnccc1CNCc2ccc(cc2)I 270004a_100016989417_100011934409 [0,2,0,0,0,0|2,0,0]=4 20564 B18R2.9237 Clc1cnccc1COCc2ccc(cc2)I 7a_100000690907_100000763264 [0,2,0,0,0,0|1,0,0]=3 20565 B18R2.9237 Clc1cnccc1COCc2ccc(nc2)Br 7a_100009816760_100000763264 [0,2,0,0,0,0|2,0,0]=4 20566 B18R2.9237 Clc1cnccc1CSCc2ccc(cc2)Br 62a_100000189115_100000763264 [0,2,0,0,0,0|1,1,0]=4 20567 B18R2.9237 Clc1cnccc1CSCc2ccc(cc2)Br 62a_100000763264_100000189115 [0,2,0,0,0,0|1,1,0]=4 20568 B18R2.9237 Clc1cnccc1CSCc2ccc(cc2)I 62a_100000189116_100000763264 [0,2,0,0,0,0|1,1,0]=4 20569 B18R2.9237 Clc1cnccc1CSCc2ccc(cc2)I 62a_100000763264_100000189116 [0,2,0,0,0,0|1,1,0]=4 20570 B18R2.9237 Clc1ncc(cn1)COCc2ccccc2Br 34a_100009855073_100000184730 [0,2,0,0,0,0|2,0,0]=4 20571 B18R2.9237 Clc1ncc(cn1)COCc2ccccc2Br 7a_100009855073_100000184730 [0,2,0,0,0,0|2,0,0]=4 20572 B18R2.9237 Clc1ncc(cn1)COCc2ccccc2Cl 34a_100009855073_100000187162 [0,2,0,0,0,0|2,0,0]=4 20573 B18R2.9237 Clc1ncc(cn1)COCc2ccccc2Cl 7a_100009855073_100000187162 [0,2,0,0,0,0|2,0,0]=4 20574 B18R2.9237 Clc1ncc(cn1)COCc2ccccc2I 34a_100009855073_100011215278 [0,2,0,0,0,0|2,0,0]=4 20575 B18R2.9237 Clc1ncc(cn1)COCc2ccccc2I 7a_100009855073_100011215278 [0,2,0,0,0,0|2,0,0]=4 20576 B18R2.9237 Clc1ncccc1CNCc2ccc(cc2)Br 207a_100015189234_100000186029 [0,2,0,0,0,0|2,0,0]=4 20577 B18R2.9237 Clc1ncccc1CNCc2ccc(cc2)Br 2230a_100000174875_100000045678 [0,2,0,0,0,0|2,0,0]=4 20578 B18R2.9237 Clc1ncccc1CNCc2ccc(cc2)Br 2230a_100015189234_100011217064 [0,2,0,0,0,0|2,0,0]=4 20579 B18R2.9237 Clc1ncccc1CNCc2ccc(cc2)Br 34a_100000174875_100000045678 [0,2,0,0,0,0|2,0,0]=4 20580 B18R2.9237 Clc1ncccc1CNCc2ccc(cc2)Br 34a_100015189234_100000189115 [0,2,0,0,0,0|2,0,0]=4 20581 B18R2.9237 Clc1ncccc1CNCc2ccc(cc2)I 207a_100015189234_100000188517 [0,2,0,0,0,0|2,0,0]=4 20582 B18R2.9237 Clc1ncccc1CNCc2ccc(cc2)I 2230a_100015189234_100000189116 [0,2,0,0,0,0|2,0,0]=4 20583 B18R2.9237 Clc1ncccc1CNCc2ccc(cc2)I 2230a_100016989417_100000045678 [0,2,0,0,0,0|2,0,0]=4 20584 B18R2.9237 Clc1ncccc1CNCc2ccc(cc2)I 34a_100015189234_100000189116 [0,2,0,0,0,0|2,0,0]=4 20585 B18R2.9237 Clc1ncccc1CNCc2ccc(cc2)I 34a_100016989417_100000045678 [0,2,0,0,0,0|2,0,0]=4 20586 B18R2.9237 Clc1ncccc1COCc2ccc(cc2)Br 34a_100000695286_100000045678 [0,2,0,0,0,0|1,0,0]=3 20587 B18R2.9237 Clc1ncccc1COCc2ccc(cc2)Br 34a_100000748726_100000189115 [0,2,0,0,0,0|1,0,0]=3 20588 B18R2.9237 Clc1ncccc1COCc2ccc(cc2)Br 7a_100000748726_100011217064 [0,2,0,0,0,0|1,0,0]=3 20589 B18R2.9237 Clc1ncccc1COCc2ccc(cc2)I 34a_100000690907_100000045678 [0,2,0,0,0,0|1,0,0]=3 20590 B18R2.9237 Clc1ncccc1COCc2ccc(cc2)I 34a_100000748726_100000189116 [0,2,0,0,0,0|1,0,0]=3 20591 B18R2.9237 Clc1ncccc1COCc2ccc(cc2)I 7a_100000690907_100000045678 [0,2,0,0,0,0|1,0,0]=3 20592 B18R2.9237 Clc1ncccc1COCc2ccc(cc2)I 7a_100000748726_100000189116 [0,2,0,0,0,0|1,0,0]=3 20593 B18R2.9237 Clc1ncccc1COCc2ccc(cn2)Br 34a_100000748726_100000702658 [0,2,0,0,0,0|2,0,0]=4 20594 B18R2.9237 Clc1ncccc1COCc2ccc(cn2)Br 34a_100000754261_100000045678 [0,2,0,0,0,0|2,0,0]=4 20595 B18R2.9237 Clc1ncccc1COCc2ccc(cn2)Br 7a_100000748726_100000702658 [0,2,0,0,0,0|2,0,0]=4 20596 B18R2.9237 Clc1ncccc1COCc2ccc(nc2)Br 34a_100000748726_100009831999 [0,2,0,0,0,0|2,0,0]=4 20597 B18R2.9237 Clc1ncccc1COCc2ccc(nc2)Br 34a_100009816760_100000045678 [0,2,0,0,0,0|2,0,0]=4 20598 B18R2.9237 Clc1ncccc1COCc2ccc(nc2)Br 7a_100000748726_100009831999 [0,2,0,0,0,0|2,0,0]=4 20599 B18R2.9237 Clc1ncccc1COCc2ccc(nc2)Br 7a_100009816760_100000045678 [0,2,0,0,0,0|2,0,0]=4 20600 B18R2.9237 Clc1ncccc1CSCc2ccc(cc2)Br 62a_100000045678_100000189115 [0,2,0,0,0,0|1,1,0]=4 20601 B18R2.9237 Clc1ncccc1CSCc2ccc(cc2)Br 62a_100000189115_100000045678 [0,2,0,0,0,0|1,1,0]=4 20602 B18R2.9237 Clc1ncccc1CSCc2ccc(cc2)I 62a_100000045678_100000189116 [0,2,0,0,0,0|1,1,0]=4 20603 B18R2.9237 Clc1ncccc1CSCc2ccc(cc2)I 62a_100000189116_100000045678 [0,2,0,0,0,0|1,1,0]=4 20604 B18R2.9237 Clc1nccnc1COCc2ccc(cc2)Br 34a_100000057004_100000189115 [0,2,0,0,0,0|2,0,0]=4 20605 B18R2.9237 Clc1nccnc1COCc2ccc(cc2)I 34a_100000057004_100000189116 [0,2,0,0,0,0|2,0,0]=4 20606 B18R2.9237 Fc1ccc(cc1)CCNc2ccccc2Br 34a_100000210017_100011217392 [0,2,0,0,0,0|2,0,0]=4 20607 B18R2.9237 Fc1ccc(cc1)CCNc2ccccc2Cl 34a_100000185783_100011217392 [0,2,0,0,0,0|2,0,0]=4 20608 B18R2.9237 Fc1ccc(cc1)CCNc2ccccc2F 34a_100000210422_100011217392 [0,2,0,0,0,0|2,0,0]=4 20609 B18R2.9237 Fc1ccc(cc1)CCNc2ccccc2I 34a_100000210053_100011217392 [0,2,0,0,0,0|2,0,0]=4 20610 B18R2.9237 Fc1ccc(cc1)CCOc2ccccc2Br 34a_100000181306_100011217392 [0,2,0,0,0,0|2,0,0]=4 20611 B18R2.9237 Fc1ccc(cc1)CCOc2ccccc2Br 7a_100000181306_100011217392 [0,2,0,0,0,0|2,0,0]=4 20612 B18R2.9237 Fc1ccc(cc1)CCOc2ccccc2Cl 34a_100000210172_100011217392 [0,2,0,0,0,0|2,0,0]=4 20613 B18R2.9237 Fc1ccc(cc1)CCOc2ccccc2Cl 7a_100000210172_100011217392 [0,2,0,0,0,0|2,0,0]=4 20614 B18R2.9237 Fc1ccc(cc1)CCOc2ccccc2F 34a_100000210171_100011217392 [0,2,0,0,0,0|2,0,0]=4 20615 B18R2.9237 Fc1ccc(cc1)CCOc2ccccc2F 7a_100000210171_100011217392 [0,2,0,0,0,0|2,0,0]=4 20616 B18R2.9237 Fc1ccc(cc1)CCOc2ccccc2I 34a_100000739446_100011217392 [0,2,0,0,0,0|2,0,0]=4 20617 B18R2.9237 Fc1ccc(cc1)CCOc2ccccc2I 7a_100000739446_100011217392 [0,2,0,0,0,0|2,0,0]=4 20618 B18R2.9237 Fc1ccc(cc1)CCSc2ccccc2Br 62a_100000695589_100011217392 [0,2,0,0,0,0|2,0,0]=4 20619 B18R2.9237 Fc1ccc(cc1)CCSc2ccccc2Br 62a_100011217392_100000695589 [0,2,0,0,0,0|2,0,0]=4 20620 B18R2.9237 Fc1ccc(cc1)CCSc2ccccc2Cl 62a_100000764095_100011217392 [0,2,0,0,0,0|2,0,0]=4 20621 B18R2.9237 Fc1ccc(cc1)CCSc2ccccc2Cl 62a_100011217392_100000764095 [0,2,0,0,0,0|2,0,0]=4 20622 B18R2.9237 Fc1ccc(cc1)CCSc2ccccc2F 62a_100011215700_100011217392 [0,2,0,0,0,0|2,0,0]=4 20623 B18R2.9237 Fc1ccc(cc1)CCSc2ccccc2F 62a_100011217392_100011215700 [0,2,0,0,0,0|2,0,0]=4 20624 B18R2.9237 Fc1ccc(cc1)CNCc2ccccc2Br 207a_100000174882_100000211189 [0,2,0,0,0,0|1,0,0]=3 20625 B18R2.9237 Fc1ccc(cc1)CNCc2ccccc2Br 207a_100000689332_100000210084 [0,2,0,0,0,0|1,0,0]=3 20626 B18R2.9237 Fc1ccc(cc1)CNCc2ccccc2Br 2230a_100000174882_100000184730 [0,2,0,0,0,0|1,0,0]=3 20627 B18R2.9237 Fc1ccc(cc1)CNCc2ccccc2Br 2230a_100000689332_100000198546 [0,2,0,0,0,0|1,0,0]=3 20628 B18R2.9237 Fc1ccc(cc1)CNCc2ccccc2Br 270004a_100000174882_100000211189 [0,2,0,0,0,0|1,0,0]=3 20629 B18R2.9237 Fc1ccc(cc1)CNCc2ccccc2Br 270004a_100000689332_100000210084 [0,2,0,0,0,0|1,0,0]=3 20630 B18R2.9237 Fc1ccc(cc1)CNCc2ccccc2Br 34a_100000174882_100000184730 [0,2,0,0,0,0|1,0,0]=3 20631 B18R2.9237 Fc1ccc(cc1)CNCc2ccccc2Br 34a_100000689332_100000198546 [0,2,0,0,0,0|1,0,0]=3 20632 B18R2.9237 Fc1ccc(cc1)CNCc2ccccc2Cl 207a_100000174879_100000210084 [0,2,0,0,0,0|1,0,0]=3 20633 B18R2.9237 Fc1ccc(cc1)CNCc2ccccc2Cl 207a_100000174882_100000210073 [0,2,0,0,0,0|1,0,0]=3 20634 B18R2.9237 Fc1ccc(cc1)CNCc2ccccc2Cl 2230a_100000174879_100000198546 [0,2,0,0,0,0|1,0,0]=3 20635 B18R2.9237 Fc1ccc(cc1)CNCc2ccccc2Cl 2230a_100000174882_100000187162 [0,2,0,0,0,0|1,0,0]=3 20636 B18R2.9237 Fc1ccc(cc1)CNCc2ccccc2Cl 270004a_100000174879_100000210084 [0,2,0,0,0,0|1,0,0]=3 20637 B18R2.9237 Fc1ccc(cc1)CNCc2ccccc2Cl 270004a_100000174882_100000210073 [0,2,0,0,0,0|1,0,0]=3 20638 B18R2.9237 Fc1ccc(cc1)CNCc2ccccc2Cl 34a_100000174879_100000198546 [0,2,0,0,0,0|1,0,0]=3 20639 B18R2.9237 Fc1ccc(cc1)CNCc2ccccc2Cl 34a_100000174882_100000187162 [0,2,0,0,0,0|1,0,0]=3 20640 B18R2.9237 Fc1ccc(cc1)CNCc2ccccc2F 207a_100000174869_100000210084 [0,2,0,0,0,0|1,0,0]=3 20641 B18R2.9237 Fc1ccc(cc1)CNCc2ccccc2F 207a_100000174882_100000210811 [0,2,0,0,0,0|1,0,0]=3 20642 B18R2.9237 Fc1ccc(cc1)CNCc2ccccc2F 2230a_100000174882_100000211605 [0,2,0,0,0,0|1,0,0]=3 20643 B18R2.9237 Fc1ccc(cc1)CNCc2ccccc2F 270004a_100000174869_100000210084 [0,2,0,0,0,0|1,0,0]=3 20644 B18R2.9237 Fc1ccc(cc1)CNCc2ccccc2F 270004a_100000174882_100000210811 [0,2,0,0,0,0|1,0,0]=3 20645 B18R2.9237 Fc1ccc(cc1)CNCc2ccccc2F 34a_100000174869_100000198546 [0,2,0,0,0,0|1,0,0]=3 20646 B18R2.9237 Fc1ccc(cc1)CNCc2ccccc2F 34a_100000174882_100000211605 [0,2,0,0,0,0|1,0,0]=3 20647 B18R2.9237 Fc1ccc(cc1)CNCc2ccccc2I 207a_100000174882_100000010305 [0,2,0,0,0,0|1,0,0]=3 20648 B18R2.9237 Fc1ccc(cc1)CNCc2ccccc2I 207a_100015347259_100000210084 [0,2,0,0,0,0|1,0,0]=3 20649 B18R2.9237 Fc1ccc(cc1)CNCc2ccccc2I 2230a_100000174882_100011215278 [0,2,0,0,0,0|1,0,0]=3 20650 B18R2.9237 Fc1ccc(cc1)CNCc2ccccc2I 270004a_100000174882_100000010305 [0,2,0,0,0,0|1,0,0]=3 20651 B18R2.9237 Fc1ccc(cc1)CNCc2ccccc2I 270004a_100015347259_100000210084 [0,2,0,0,0,0|1,0,0]=3 20652 B18R2.9237 Fc1ccc(cc1)CNCc2ccccc2I 34a_100000174882_100011215278 [0,2,0,0,0,0|1,0,0]=3 20653 B18R2.9237 Fc1ccc(cc1)CNCc2cccnc2Br 2230a_100000174882_100010140945 [0,2,0,0,0,0|2,0,0]=4 20654 B18R2.9237 Fc1ccc(cc1)CNCc2cccnc2Br 2230a_100009818023_100000198546 [0,2,0,0,0,0|2,0,0]=4 20655 B18R2.9237 Fc1ccc(cc1)CNCc2cccnc2Br 270004a_100009818023_100000210084 [0,2,0,0,0,0|2,0,0]=4 20656 B18R2.9237 Fc1ccc(cc1)CNCc2cccnc2Br 34a_100000174882_100010140945 [0,2,0,0,0,0|2,0,0]=4 20657 B18R2.9237 Fc1ccc(cc1)CNCc2cccnc2Br 34a_100009818023_100000198546 [0,2,0,0,0,0|2,0,0]=4 20658 B18R2.9237 Fc1ccc(cc1)CNCc2cccnc2Cl 207a_100015189234_100000210084 [0,2,0,0,0,0|2,0,0]=4 20659 B18R2.9237 Fc1ccc(cc1)CNCc2cccnc2Cl 2230a_100000174882_100000045678 [0,2,0,0,0,0|2,0,0]=4 20660 B18R2.9237 Fc1ccc(cc1)CNCc2cccnc2Cl 2230a_100015189234_100000198546 [0,2,0,0,0,0|2,0,0]=4 20661 B18R2.9237 Fc1ccc(cc1)CNCc2cccnc2Cl 34a_100000174882_100000045678 [0,2,0,0,0,0|2,0,0]=4 20662 B18R2.9237 Fc1ccc(cc1)CNCc2cccnc2Cl 34a_100015189234_100000198546 [0,2,0,0,0,0|2,0,0]=4 20663 B18R2.9237 Fc1ccc(cc1)CNCc2cccnc2F 2230a_100000174882_100000099810 [0,2,0,0,0,0|2,0,0]=4 20664 B18R2.9237 Fc1ccc(cc1)CNCc2cccnc2F 270004a_100000724633_100000210084 [0,2,0,0,0,0|2,0,0]=4 20665 B18R2.9237 Fc1ccc(cc1)CNCc2cccnc2F 34a_100000174882_100000099810 [0,2,0,0,0,0|2,0,0]=4 20666 B18R2.9237 Fc1ccc(cc1)CNCc2cccnc2F 34a_100000724633_100000198546 [0,2,0,0,0,0|2,0,0]=4 20667 B18R2.9237 Fc1ccc(cc1)CNCc2ccncc2Br 207a_100020640021_100000210084 [0,2,0,0,0,0|2,0,0]=4 20668 B18R2.9237 Fc1ccc(cc1)CNCc2ccncc2Br 270004a_100000174882_100000755692 [0,2,0,0,0,0|2,0,0]=4 20669 B18R2.9237 Fc1ccc(cc1)CNCc2ccncc2Br 270004a_100020640021_100000210084 [0,2,0,0,0,0|2,0,0]=4 20670 B18R2.9237 Fc1ccc(cc1)CNCc2ccncc2Cl 207a_100000174882_100011934409 [0,2,0,0,0,0|2,0,0]=4 20671 B18R2.9237 Fc1ccc(cc1)CNCc2ccncc2Cl 2230a_100000174882_100000763264 [0,2,0,0,0,0|2,0,0]=4 20672 B18R2.9237 Fc1ccc(cc1)CNCc2ccncc2Cl 270004a_100000174882_100011934409 [0,2,0,0,0,0|2,0,0]=4 20673 B18R2.9237 Fc1ccc(cc1)CNCc2ccncc2F 207a_100011935246_100000210084 [0,2,0,0,0,0|2,0,0]=4 20674 B18R2.9237 Fc1ccc(cc1)CNCc2ccncc2F 270004a_100011935246_100000210084 [0,2,0,0,0,0|2,0,0]=4 20675 B18R2.9237 Fc1ccc(cc1)CNCc2ccncc2F 34a_100011935246_100000198546 [0,2,0,0,0,0|2,0,0]=4 20676 B18R2.9237 Fc1ccc(cc1)CNCc2cnccc2Br 270004a_100000174882_100009816821 [0,2,0,0,0,0|2,0,0]=4 20677 B18R2.9237 Fc1ccc(cc1)CNCc2cnccc2Cl 270004a_100000174882_100000050567 [0,2,0,0,0,0|2,0,0]=4 20678 B18R2.9237 Fc1ccc(cc1)CNCc2ncccc2Br 207a_100000174882_100011934733 [0,2,0,0,0,0|2,0,0]=4 20679 B18R2.9237 Fc1ccc(cc1)CNCc2ncccc2Br 2230a_100000174882_100025702911 [0,2,0,0,0,0|2,0,0]=4 20680 B18R2.9237 Fc1ccc(cc1)CNCc2ncccc2Br 270004a_100000174882_100011934733 [0,2,0,0,0,0|2,0,0]=4 20681 B18R2.9237 Fc1ccc(cc1)CNCc2ncccc2Br 270004a_100020591323_100000210084 [0,2,0,0,0,0|2,0,0]=4 20682 B18R2.9237 Fc1ccc(cc1)CNCc2ncccc2Br 34a_100000174882_100025702911 [0,2,0,0,0,0|2,0,0]=4 20683 B18R2.9237 Fc1ccc(cc1)CNCc2ncccc2Cl 207a_100000174882_100012001307 [0,2,0,0,0,0|2,0,0]=4 20684 B18R2.9237 Fc1ccc(cc1)CNCc2ncccc2Cl 2230a_100000174882_100000099807 [0,2,0,0,0,0|2,0,0]=4 20685 B18R2.9237 Fc1ccc(cc1)CNCc2ncccc2Cl 2230a_100015189233_100000198546 [0,2,0,0,0,0|2,0,0]=4 20686 B18R2.9237 Fc1ccc(cc1)CNCc2ncccc2Cl 270004a_100000174882_100012001307 [0,2,0,0,0,0|2,0,0]=4 20687 B18R2.9237 Fc1ccc(cc1)CNCc2ncccc2Cl 270004a_100015189233_100000210084 [0,2,0,0,0,0|2,0,0]=4 20688 B18R2.9237 Fc1ccc(cc1)CNCc2ncccc2F 207a_100000174882_100011934734 [0,2,0,0,0,0|2,0,0]=4 20689 B18R2.9237 Fc1ccc(cc1)CNCc2ncccc2F 2230a_100000174882_100000104219 [0,2,0,0,0,0|2,0,0]=4 20690 B18R2.9237 Fc1ccc(cc1)CNCc2ncccc2F 270004a_100000174882_100011934734 [0,2,0,0,0,0|2,0,0]=4 20691 B18R2.9237 Fc1ccc(cc1)CNCc2ncccc2F 270004a_100000690088_100000210084 [0,2,0,0,0,0|2,0,0]=4 20692 B18R2.9237 Fc1ccc(cc1)CNCc2ncccc2F 34a_100000174882_100000104219 [0,2,0,0,0,0|2,0,0]=4 20693 B18R2.9237 Fc1ccc(cc1)CNCc2ncccc2F 34a_100000690088_100000198546 [0,2,0,0,0,0|2,0,0]=4 20694 B18R2.9237 Fc1ccc(cc1)COCc2ccccc2Br 34a_100000210977_100000184730 [0,2,0,0,0,0|0,0,0]=2 20695 B18R2.9237 Fc1ccc(cc1)COCc2ccccc2Br 34a_100000756307_100000198546 [0,2,0,0,0,0|0,0,0]=2 20696 B18R2.9237 Fc1ccc(cc1)COCc2ccccc2Br 7a_100000210977_100000184730 [0,2,0,0,0,0|0,0,0]=2 20697 B18R2.9237 Fc1ccc(cc1)COCc2ccccc2Br 7a_100000756307_100000198546 [0,2,0,0,0,0|0,0,0]=2 20698 B18R2.9237 Fc1ccc(cc1)COCc2ccccc2Cl 34a_100000210847_100000198546 [0,2,0,0,0,0|0,0,0]=2 20699 B18R2.9237 Fc1ccc(cc1)COCc2ccccc2Cl 34a_100000210977_100000187162 [0,2,0,0,0,0|0,0,0]=2 20700 B18R2.9237 Fc1ccc(cc1)COCc2ccccc2Cl 7a_100000210847_100000198546 [0,2,0,0,0,0|0,0,0]=2 20701 B18R2.9237 Fc1ccc(cc1)COCc2ccccc2Cl 7a_100000210977_100000187162 [0,2,0,0,0,0|0,0,0]=2 20702 B18R2.9237 Fc1ccc(cc1)COCc2ccccc2F 34a_100000210977_100000211605 [0,2,0,0,0,0|0,0,0]=2 20703 B18R2.9237 Fc1ccc(cc1)COCc2ccccc2F 34a_100000211962_100000198546 [0,2,0,0,0,0|0,0,0]=2 20704 B18R2.9237 Fc1ccc(cc1)COCc2ccccc2F 7a_100000210977_100000211605 [0,2,0,0,0,0|0,0,0]=2 20705 B18R2.9237 Fc1ccc(cc1)COCc2ccccc2F 7a_100000211962_100000198546 [0,2,0,0,0,0|0,0,0]=2 20706 B18R2.9237 Fc1ccc(cc1)COCc2ccccc2I 34a_100000187465_100000198546 [0,2,0,0,0,0|0,0,0]=2 20707 B18R2.9237 Fc1ccc(cc1)COCc2ccccc2I 34a_100000210977_100011215278 [0,2,0,0,0,0|0,0,0]=2 20708 B18R2.9237 Fc1ccc(cc1)COCc2ccccc2I 7a_100000187465_100000198546 [0,2,0,0,0,0|0,0,0]=2 20709 B18R2.9237 Fc1ccc(cc1)COCc2ccccc2I 7a_100000210977_100011215278 [0,2,0,0,0,0|0,0,0]=2 20710 B18R2.9237 Fc1ccc(cc1)COCc2cccnc2Br 34a_100000210977_100010140945 [0,2,0,0,0,0|1,0,0]=3 20711 B18R2.9237 Fc1ccc(cc1)COCc2cccnc2Br 34a_100000719692_100000198546 [0,2,0,0,0,0|1,0,0]=3 20712 B18R2.9237 Fc1ccc(cc1)COCc2cccnc2Br 7a_100000210977_100010140945 [0,2,0,0,0,0|1,0,0]=3 20713 B18R2.9237 Fc1ccc(cc1)COCc2cccnc2Br 7a_100000719692_100000198546 [0,2,0,0,0,0|1,0,0]=3 20714 B18R2.9237 Fc1ccc(cc1)COCc2cccnc2Cl 34a_100000210977_100000045678 [0,2,0,0,0,0|1,0,0]=3 20715 B18R2.9237 Fc1ccc(cc1)COCc2cccnc2Cl 34a_100000748726_100000198546 [0,2,0,0,0,0|1,0,0]=3 20716 B18R2.9237 Fc1ccc(cc1)COCc2cccnc2Cl 7a_100000210977_100000045678 [0,2,0,0,0,0|1,0,0]=3 20717 B18R2.9237 Fc1ccc(cc1)COCc2cccnc2Cl 7a_100000748726_100000198546 [0,2,0,0,0,0|1,0,0]=3 20718 B18R2.9237 Fc1ccc(cc1)COCc2cccnc2F 34a_100000079888_100000198546 [0,2,0,0,0,0|1,0,0]=3 20719 B18R2.9237 Fc1ccc(cc1)COCc2cccnc2F 34a_100000210977_100000099810 [0,2,0,0,0,0|1,0,0]=3 20720 B18R2.9237 Fc1ccc(cc1)COCc2cccnc2F 7a_100000079888_100000198546 [0,2,0,0,0,0|1,0,0]=3 20721 B18R2.9237 Fc1ccc(cc1)COCc2cccnc2F 7a_100000210977_100000099810 [0,2,0,0,0,0|1,0,0]=3 20722 B18R2.9237 Fc1ccc(cc1)COCc2ccncc2Cl 7a_100000210977_100000763264 [0,2,0,0,0,0|1,0,0]=3 20723 B18R2.9237 Fc1ccc(cc1)COCc2ccncc2F 34a_100012172863_100000198546 [0,2,0,0,0,0|1,0,0]=3 20724 B18R2.9237 Fc1ccc(cc1)COCc2cnccc2Cl 34a_100000117392_100000198546 [0,2,0,0,0,0|1,0,0]=3 20725 B18R2.9237 Fc1ccc(cc1)COCc2ncccc2Br 34a_100000210977_100025702911 [0,2,0,0,0,0|1,0,0]=3 20726 B18R2.9237 Fc1ccc(cc1)COCc2ncccc2Br 34a_100011996772_100000198546 [0,2,0,0,0,0|1,0,0]=3 20727 B18R2.9237 Fc1ccc(cc1)COCc2ncccc2Br 7a_100000210977_100025702911 [0,2,0,0,0,0|1,0,0]=3 20728 B18R2.9237 Fc1ccc(cc1)COCc2ncccc2Cl 34a_100012002383_100000198546 [0,2,0,0,0,0|1,0,0]=3 20729 B18R2.9237 Fc1ccc(cc1)COCc2ncccc2Cl 7a_100000210977_100000099807 [0,2,0,0,0,0|1,0,0]=3 20730 B18R2.9237 Fc1ccc(cc1)COCc2ncccc2F 34a_100000210977_100000104219 [0,2,0,0,0,0|1,0,0]=3 20731 B18R2.9237 Fc1ccc(cc1)COCc2ncccc2F 34a_100011934865_100000198546 [0,2,0,0,0,0|1,0,0]=3 20732 B18R2.9237 Fc1ccc(cc1)COCc2ncccc2F 7a_100000210977_100000104219 [0,2,0,0,0,0|1,0,0]=3 20733 B18R2.9237 Fc1ccc(cc1)COCc2nccnc2Cl 34a_100000057004_100000198546 [0,2,0,0,0,0|2,0,0]=4 20734 B18R2.9237 Fc1ccc(cc1)CSCc2ccccc2Br 62a_100000184730_100000187164 [0,2,0,0,0,0|0,1,0]=3 20735 B18R2.9237 Fc1ccc(cc1)CSCc2ccccc2Br 62a_100000198546_100000184730 [0,2,0,0,0,0|0,1,0]=3 20736 B18R2.9237 Fc1ccc(cc1)CSCc2ccccc2Cl 62a_100000187162_100000187164 [0,2,0,0,0,0|0,1,0]=3 20737 B18R2.9237 Fc1ccc(cc1)CSCc2ccccc2Cl 62a_100000198546_100000187162 [0,2,0,0,0,0|0,1,0]=3 20738 B18R2.9237 Fc1ccc(cc1)CSCc2ccccc2F 62a_100000198546_100000211605 [0,2,0,0,0,0|0,1,0]=3 20739 B18R2.9237 Fc1ccc(cc1)CSCc2ccccc2F 62a_100000211605_100000187164 [0,2,0,0,0,0|0,1,0]=3 20740 B18R2.9237 Fc1ccc(cc1)CSCc2ccccc2I 62a_100000198546_100011216222 [0,2,0,0,0,0|0,1,0]=3 20741 B18R2.9237 Fc1ccc(cc1)CSCc2ccccc2I 62a_100011216222_100000187164 [0,2,0,0,0,0|0,1,0]=3 20742 B18R2.9237 Fc1ccc(cc1)CSCc2cccnc2Br 62a_100000198546_100010140945 [0,2,0,0,0,0|1,1,0]=4 20743 B18R2.9237 Fc1ccc(cc1)CSCc2cccnc2Br 62a_100010140945_100000187164 [0,2,0,0,0,0|1,1,0]=4 20744 B18R2.9237 Fc1ccc(cc1)CSCc2cccnc2Cl 62a_100000045678_100000187164 [0,2,0,0,0,0|1,1,0]=4 20745 B18R2.9237 Fc1ccc(cc1)CSCc2cccnc2Cl 62a_100000198546_100000045678 [0,2,0,0,0,0|1,1,0]=4 20746 B18R2.9237 Fc1ccc(cc1)CSCc2cccnc2F 62a_100000099810_100000187164 [0,2,0,0,0,0|1,1,0]=4 20747 B18R2.9237 Fc1ccc(cc1)CSCc2cccnc2F 62a_100000198546_100000099810 [0,2,0,0,0,0|1,1,0]=4 20748 B18R2.9237 Fc1ccc(cc1)CSCc2ccncc2Cl 62a_100000198546_100000763264 [0,2,0,0,0,0|1,1,0]=4 20749 B18R2.9237 Fc1ccc(cc1)CSCc2ccncc2Cl 62a_100000763264_100000187164 [0,2,0,0,0,0|1,1,0]=4 20750 B18R2.9237 Fc1ccc(cc1)CSCc2ncccc2Br 62a_100000198546_100025702911 [0,2,0,0,0,0|1,1,0]=4 20751 B18R2.9237 Fc1ccc(cc1)CSCc2ncccc2Br 62a_100025702911_100000187164 [0,2,0,0,0,0|1,1,0]=4 20752 B18R2.9237 Fc1ccc(cc1)CSCc2ncccc2Cl 62a_100000099807_100000187164 [0,2,0,0,0,0|1,1,0]=4 20753 B18R2.9237 Fc1ccc(cc1)CSCc2ncccc2Cl 62a_100000198546_100000099807 [0,2,0,0,0,0|1,1,0]=4 20754 B18R2.9237 Fc1ccc(cc1)CSCc2ncccc2F 62a_100000104219_100000187164 [0,2,0,0,0,0|1,1,0]=4 20755 B18R2.9237 Fc1ccc(cc1)CSCc2ncccc2F 62a_100000198546_100000104219 [0,2,0,0,0,0|1,1,0]=4 20756 B18R2.9237 Fc1ccc(cc1)NCCc2ccccc2Br 34a_100000185862_100012161201 [0,2,0,0,0,0|2,0,0]=4 20757 B18R2.9237 Fc1ccc(cc1)NCCc2ccccc2Cl 34a_100000185862_100011713703 [0,2,0,0,0,0|2,0,0]=4 20758 B18R2.9237 Fc1ccc(cc1)NCCc2ccccc2F 34a_100000185862_100000720011 [0,2,0,0,0,0|2,0,0]=4 20759 B18R2.9237 Fc1ccc(cc1)OCCc2ccccc2Br 34a_100000210339_100012161201 [0,2,0,0,0,0|2,0,0]=4 20760 B18R2.9237 Fc1ccc(cc1)OCCc2ccccc2Cl 34a_100000210339_100011713703 [0,2,0,0,0,0|2,0,0]=4 20761 B18R2.9237 Fc1ccc(cc1)OCCc2ccccc2F 34a_100000210339_100000720011 [0,2,0,0,0,0|2,0,0]=4 20762 B18R2.9237 Fc1ccc(cc1)SCCc2ccccc2Br 62a_100000211213_100012161201 [0,2,0,0,0,0|2,0,0]=4 20763 B18R2.9237 Fc1ccc(cc1)SCCc2ccccc2Br 62a_100012161201_100000211213 [0,2,0,0,0,0|2,0,0]=4 20764 B18R2.9237 Fc1ccc(cc1)SCCc2ccccc2Cl 62a_100000211213_100011713703 [0,2,0,0,0,0|2,0,0]=4 20765 B18R2.9237 Fc1ccc(cc1)SCCc2ccccc2Cl 62a_100011713703_100000211213 [0,2,0,0,0,0|2,0,0]=4 20766 B18R2.9237 Fc1ccc(cc1)SCCc2ccccc2F 62a_100000211213_100011713696 [0,2,0,0,0,0|2,0,0]=4 20767 B18R2.9237 Fc1ccc(cc1)SCCc2ccccc2F 62a_100011713696_100000211213 [0,2,0,0,0,0|2,0,0]=4 20768 B18R2.9237 Fc1ccc(cn1)CNCc2ccccc2Br 2230a_100000101913_100000184730 [0,2,0,0,0,0|2,0,0]=4 20769 B18R2.9237 Fc1ccc(cn1)CNCc2ccccc2Br 2230a_100000689332_100009820150 [0,2,0,0,0,0|2,0,0]=4 20770 B18R2.9237 Fc1ccc(cn1)CNCc2ccccc2Br 270004a_100000101913_100000211189 [0,2,0,0,0,0|2,0,0]=4 20771 B18R2.9237 Fc1ccc(cn1)CNCc2ccccc2Br 34a_100000101913_100000184730 [0,2,0,0,0,0|2,0,0]=4 20772 B18R2.9237 Fc1ccc(cn1)CNCc2ccccc2Br 34a_100000689332_100000099788 [0,2,0,0,0,0|2,0,0]=4 20773 B18R2.9237 Fc1ccc(cn1)CNCc2ccccc2Cl 2230a_100000101913_100000187162 [0,2,0,0,0,0|2,0,0]=4 20774 B18R2.9237 Fc1ccc(cn1)CNCc2ccccc2Cl 2230a_100000174879_100009820150 [0,2,0,0,0,0|2,0,0]=4 20775 B18R2.9237 Fc1ccc(cn1)CNCc2ccccc2Cl 270004a_100000101913_100000210073 [0,2,0,0,0,0|2,0,0]=4 20776 B18R2.9237 Fc1ccc(cn1)CNCc2ccccc2Cl 34a_100000101913_100000187162 [0,2,0,0,0,0|2,0,0]=4 20777 B18R2.9237 Fc1ccc(cn1)CNCc2ccccc2Cl 34a_100000174879_100000099788 [0,2,0,0,0,0|2,0,0]=4 20778 B18R2.9237 Fc1ccc(cn1)CNCc2ccccc2F 2230a_100000101913_100000211605 [0,2,0,0,0,0|2,0,0]=4 20779 B18R2.9237 Fc1ccc(cn1)CNCc2ccccc2F 270004a_100000101913_100000210811 [0,2,0,0,0,0|2,0,0]=4 20780 B18R2.9237 Fc1ccc(cn1)CNCc2ccccc2F 34a_100000101913_100000211605 [0,2,0,0,0,0|2,0,0]=4 20781 B18R2.9237 Fc1ccc(cn1)CNCc2ccccc2F 34a_100000174869_100000099788 [0,2,0,0,0,0|2,0,0]=4 20782 B18R2.9237 Fc1ccc(cn1)CNCc2ccccc2I 2230a_100000101913_100011215278 [0,2,0,0,0,0|2,0,0]=4 20783 B18R2.9237 Fc1ccc(cn1)CNCc2ccccc2I 270004a_100000101913_100000010305 [0,2,0,0,0,0|2,0,0]=4 20784 B18R2.9237 Fc1ccc(cn1)CNCc2ccccc2I 34a_100000101913_100011215278 [0,2,0,0,0,0|2,0,0]=4 20785 B18R2.9237 Fc1ccc(cn1)COCc2ccccc2Br 34a_100000079959_100000184730 [0,2,0,0,0,0|1,0,0]=3 20786 B18R2.9237 Fc1ccc(cn1)COCc2ccccc2Br 34a_100000756307_100000099788 [0,2,0,0,0,0|1,0,0]=3 20787 B18R2.9237 Fc1ccc(cn1)COCc2ccccc2Br 7a_100000756307_100009820150 [0,2,0,0,0,0|1,0,0]=3 20788 B18R2.9237 Fc1ccc(cn1)COCc2ccccc2Cl 34a_100000079959_100000187162 [0,2,0,0,0,0|1,0,0]=3 20789 B18R2.9237 Fc1ccc(cn1)COCc2ccccc2Cl 34a_100000210847_100000099788 [0,2,0,0,0,0|1,0,0]=3 20790 B18R2.9237 Fc1ccc(cn1)COCc2ccccc2Cl 7a_100000210847_100009820150 [0,2,0,0,0,0|1,0,0]=3 20791 B18R2.9237 Fc1ccc(cn1)COCc2ccccc2F 34a_100000079959_100000211605 [0,2,0,0,0,0|1,0,0]=3 20792 B18R2.9237 Fc1ccc(cn1)COCc2ccccc2F 34a_100000211962_100000099788 [0,2,0,0,0,0|1,0,0]=3 20793 B18R2.9237 Fc1ccc(cn1)COCc2ccccc2F 7a_100000211962_100009820150 [0,2,0,0,0,0|1,0,0]=3 20794 B18R2.9237 Fc1ccc(cn1)COCc2ccccc2I 34a_100000079959_100011215278 [0,2,0,0,0,0|1,0,0]=3 20795 B18R2.9237 Fc1ccc(cn1)COCc2ccccc2I 34a_100000187465_100000099788 [0,2,0,0,0,0|1,0,0]=3 20796 B18R2.9237 Fc1ccc(cn1)COCc2ccccc2I 7a_100000187465_100009820150 [0,2,0,0,0,0|1,0,0]=3 20797 B18R2.9237 Fc1ccc(cn1)COCc2cccnc2Br 34a_100000079959_100010140945 [0,2,0,0,0,0|2,0,0]=4 20798 B18R2.9237 Fc1ccc(cn1)COCc2cccnc2Br 34a_100000719692_100000099788 [0,2,0,0,0,0|2,0,0]=4 20799 B18R2.9237 Fc1ccc(cn1)COCc2cccnc2Br 7a_100000719692_100009820150 [0,2,0,0,0,0|2,0,0]=4 20800 B18R2.9237 Fc1ccc(cn1)COCc2cccnc2Cl 34a_100000079959_100000045678 [0,2,0,0,0,0|2,0,0]=4 20801 B18R2.9237 Fc1ccc(cn1)COCc2cccnc2Cl 34a_100000748726_100000099788 [0,2,0,0,0,0|2,0,0]=4 20802 B18R2.9237 Fc1ccc(cn1)COCc2cccnc2Cl 7a_100000748726_100009820150 [0,2,0,0,0,0|2,0,0]=4 20803 B18R2.9237 Fc1ccc(cn1)COCc2cccnc2F 34a_100000079888_100000099788 [0,2,0,0,0,0|2,0,0]=4 20804 B18R2.9237 Fc1ccc(cn1)COCc2cccnc2F 34a_100000079959_100000099810 [0,2,0,0,0,0|2,0,0]=4 20805 B18R2.9237 Fc1ccc(cn1)COCc2cccnc2F 7a_100000079888_100009820150 [0,2,0,0,0,0|2,0,0]=4 20806 B18R2.9237 Fc1ccc(cn1)COCc2ccncc2F 34a_100012172863_100000099788 [0,2,0,0,0,0|2,0,0]=4 20807 B18R2.9237 Fc1ccc(cn1)COCc2cnccc2Cl 34a_100000117392_100000099788 [0,2,0,0,0,0|2,0,0]=4 20808 B18R2.9237 Fc1ccc(cn1)COCc2ncccc2Br 34a_100000079959_100025702911 [0,2,0,0,0,0|2,0,0]=4 20809 B18R2.9237 Fc1ccc(cn1)COCc2ncccc2Br 34a_100011996772_100000099788 [0,2,0,0,0,0|2,0,0]=4 20810 B18R2.9237 Fc1ccc(cn1)COCc2ncccc2Cl 34a_100012002383_100000099788 [0,2,0,0,0,0|2,0,0]=4 20811 B18R2.9237 Fc1ccc(cn1)COCc2ncccc2F 34a_100000079959_100000104219 [0,2,0,0,0,0|2,0,0]=4 20812 B18R2.9237 Fc1ccc(cn1)COCc2ncccc2F 34a_100011934865_100000099788 [0,2,0,0,0,0|2,0,0]=4 20813 B18R2.9237 Fc1ccc(cn1)CSCc2ccccc2Br 62a_100000184730_100000099788 [0,2,0,0,0,0|1,1,0]=4 20814 B18R2.9237 Fc1ccc(cn1)CSCc2ccccc2Br 62a_100009820150_100000184730 [0,2,0,0,0,0|1,1,0]=4 20815 B18R2.9237 Fc1ccc(cn1)CSCc2ccccc2Cl 62a_100000187162_100000099788 [0,2,0,0,0,0|1,1,0]=4 20816 B18R2.9237 Fc1ccc(cn1)CSCc2ccccc2Cl 62a_100009820150_100000187162 [0,2,0,0,0,0|1,1,0]=4 20817 B18R2.9237 Fc1ccc(cn1)CSCc2ccccc2F 62a_100000211605_100000099788 [0,2,0,0,0,0|1,1,0]=4 20818 B18R2.9237 Fc1ccc(cn1)CSCc2ccccc2F 62a_100009820150_100000211605 [0,2,0,0,0,0|1,1,0]=4 20819 B18R2.9237 Fc1ccc(cn1)CSCc2ccccc2I 62a_100009820150_100011216222 [0,2,0,0,0,0|1,1,0]=4 20820 B18R2.9237 Fc1ccc(cn1)CSCc2ccccc2I 62a_100011216222_100000099788 [0,2,0,0,0,0|1,1,0]=4 20821 B18R2.9237 Fc1ccc(nc1)CNCc2ccccc2Br 207a_100000689332_100011934744 [0,2,0,0,0,0|2,0,0]=4 20822 B18R2.9237 Fc1ccc(nc1)CNCc2ccccc2Br 2230a_100000689332_100000703193 [0,2,0,0,0,0|2,0,0]=4 20823 B18R2.9237 Fc1ccc(nc1)CNCc2ccccc2Br 270004a_100000689332_100011934744 [0,2,0,0,0,0|2,0,0]=4 20824 B18R2.9237 Fc1ccc(nc1)CNCc2ccccc2Br 34a_100000689332_100000703193 [0,2,0,0,0,0|2,0,0]=4 20825 B18R2.9237 Fc1ccc(nc1)CNCc2ccccc2Br 34a_100020620131_100000184730 [0,2,0,0,0,0|2,0,0]=4 20826 B18R2.9237 Fc1ccc(nc1)CNCc2ccccc2Cl 207a_100000174879_100011934744 [0,2,0,0,0,0|2,0,0]=4 20827 B18R2.9237 Fc1ccc(nc1)CNCc2ccccc2Cl 2230a_100000174879_100000703193 [0,2,0,0,0,0|2,0,0]=4 20828 B18R2.9237 Fc1ccc(nc1)CNCc2ccccc2Cl 270004a_100000174879_100011934744 [0,2,0,0,0,0|2,0,0]=4 20829 B18R2.9237 Fc1ccc(nc1)CNCc2ccccc2Cl 34a_100000174879_100000703193 [0,2,0,0,0,0|2,0,0]=4 20830 B18R2.9237 Fc1ccc(nc1)CNCc2ccccc2Cl 34a_100020620131_100000187162 [0,2,0,0,0,0|2,0,0]=4 20831 B18R2.9237 Fc1ccc(nc1)CNCc2ccccc2F 207a_100000174869_100011934744 [0,2,0,0,0,0|2,0,0]=4 20832 B18R2.9237 Fc1ccc(nc1)CNCc2ccccc2F 270004a_100000174869_100011934744 [0,2,0,0,0,0|2,0,0]=4 20833 B18R2.9237 Fc1ccc(nc1)CNCc2ccccc2F 34a_100000174869_100000703193 [0,2,0,0,0,0|2,0,0]=4 20834 B18R2.9237 Fc1ccc(nc1)CNCc2ccccc2F 34a_100020620131_100000211605 [0,2,0,0,0,0|2,0,0]=4 20835 B18R2.9237 Fc1ccc(nc1)CNCc2ccccc2I 207a_100015347259_100011934744 [0,2,0,0,0,0|2,0,0]=4 20836 B18R2.9237 Fc1ccc(nc1)CNCc2ccccc2I 270004a_100015347259_100011934744 [0,2,0,0,0,0|2,0,0]=4 20837 B18R2.9237 Fc1ccc(nc1)CNCc2ccccc2I 34a_100020620131_100011215278 [0,2,0,0,0,0|2,0,0]=4 20838 B18R2.9237 Fc1ccc(nc1)COCc2ccccc2Br 34a_100000756307_100000703193 [0,2,0,0,0,0|1,0,0]=3 20839 B18R2.9237 Fc1ccc(nc1)COCc2ccccc2Br 34a_100011999454_100000184730 [0,2,0,0,0,0|1,0,0]=3 20840 B18R2.9237 Fc1ccc(nc1)COCc2ccccc2Br 7a_100000756307_100000703193 [0,2,0,0,0,0|1,0,0]=3 20841 B18R2.9237 Fc1ccc(nc1)COCc2ccccc2Cl 34a_100000210847_100000703193 [0,2,0,0,0,0|1,0,0]=3 20842 B18R2.9237 Fc1ccc(nc1)COCc2ccccc2Cl 34a_100011999454_100000187162 [0,2,0,0,0,0|1,0,0]=3 20843 B18R2.9237 Fc1ccc(nc1)COCc2ccccc2Cl 7a_100000210847_100000703193 [0,2,0,0,0,0|1,0,0]=3 20844 B18R2.9237 Fc1ccc(nc1)COCc2ccccc2F 34a_100000211962_100000703193 [0,2,0,0,0,0|1,0,0]=3 20845 B18R2.9237 Fc1ccc(nc1)COCc2ccccc2F 34a_100011999454_100000211605 [0,2,0,0,0,0|1,0,0]=3 20846 B18R2.9237 Fc1ccc(nc1)COCc2ccccc2F 7a_100000211962_100000703193 [0,2,0,0,0,0|1,0,0]=3 20847 B18R2.9237 Fc1ccc(nc1)COCc2ccccc2I 34a_100000187465_100000703193 [0,2,0,0,0,0|1,0,0]=3 20848 B18R2.9237 Fc1ccc(nc1)COCc2ccccc2I 34a_100011999454_100011215278 [0,2,0,0,0,0|1,0,0]=3 20849 B18R2.9237 Fc1ccc(nc1)COCc2ccccc2I 7a_100000187465_100000703193 [0,2,0,0,0,0|1,0,0]=3 20850 B18R2.9237 Fc1ccc(nc1)COCc2cccnc2Br 34a_100000719692_100000703193 [0,2,0,0,0,0|2,0,0]=4 20851 B18R2.9237 Fc1ccc(nc1)COCc2cccnc2Br 34a_100011999454_100010140945 [0,2,0,0,0,0|2,0,0]=4 20852 B18R2.9237 Fc1ccc(nc1)COCc2cccnc2Br 7a_100000719692_100000703193 [0,2,0,0,0,0|2,0,0]=4 20853 B18R2.9237 Fc1ccc(nc1)COCc2cccnc2Cl 34a_100000748726_100000703193 [0,2,0,0,0,0|2,0,0]=4 20854 B18R2.9237 Fc1ccc(nc1)COCc2cccnc2Cl 34a_100011999454_100000045678 [0,2,0,0,0,0|2,0,0]=4 20855 B18R2.9237 Fc1ccc(nc1)COCc2cccnc2Cl 7a_100000748726_100000703193 [0,2,0,0,0,0|2,0,0]=4 20856 B18R2.9237 Fc1ccc(nc1)COCc2cccnc2F 34a_100000079888_100000703193 [0,2,0,0,0,0|2,0,0]=4 20857 B18R2.9237 Fc1ccc(nc1)COCc2cccnc2F 34a_100011999454_100000099810 [0,2,0,0,0,0|2,0,0]=4 20858 B18R2.9237 Fc1ccc(nc1)COCc2cccnc2F 7a_100000079888_100000703193 [0,2,0,0,0,0|2,0,0]=4 20859 B18R2.9237 Fc1ccc(nc1)COCc2ccncc2F 34a_100012172863_100000703193 [0,2,0,0,0,0|2,0,0]=4 20860 B18R2.9237 Fc1ccc(nc1)COCc2cnccc2Cl 34a_100000117392_100000703193 [0,2,0,0,0,0|2,0,0]=4 20861 B18R2.9237 Fc1ccc(nc1)COCc2ncccc2Br 34a_100011996772_100000703193 [0,2,0,0,0,0|2,0,0]=4 20862 B18R2.9237 Fc1ccc(nc1)COCc2ncccc2Br 34a_100011999454_100025702911 [0,2,0,0,0,0|2,0,0]=4 20863 B18R2.9237 Fc1ccc(nc1)COCc2ncccc2Cl 34a_100012002383_100000703193 [0,2,0,0,0,0|2,0,0]=4 20864 B18R2.9237 Fc1ccc(nc1)COCc2ncccc2F 34a_100011934865_100000703193 [0,2,0,0,0,0|2,0,0]=4 20865 B18R2.9237 Fc1ccc(nc1)COCc2ncccc2F 34a_100011999454_100000104219 [0,2,0,0,0,0|2,0,0]=4 20866 B18R2.9237 Fc1ccc(nc1)CSCc2ccccc2Br 62a_100000184730_100000703193 [0,2,0,0,0,0|1,1,0]=4 20867 B18R2.9237 Fc1ccc(nc1)CSCc2ccccc2Br 62a_100000703193_100000184730 [0,2,0,0,0,0|1,1,0]=4 20868 B18R2.9237 Fc1ccc(nc1)CSCc2ccccc2Cl 62a_100000187162_100000703193 [0,2,0,0,0,0|1,1,0]=4 20869 B18R2.9237 Fc1ccc(nc1)CSCc2ccccc2Cl 62a_100000703193_100000187162 [0,2,0,0,0,0|1,1,0]=4 20870 B18R2.9237 Fc1ccc(nc1)CSCc2ccccc2F 62a_100000211605_100000703193 [0,2,0,0,0,0|1,1,0]=4 20871 B18R2.9237 Fc1ccc(nc1)CSCc2ccccc2F 62a_100000703193_100000211605 [0,2,0,0,0,0|1,1,0]=4 20872 B18R2.9237 Fc1ccc(nc1)CSCc2ccccc2I 62a_100000703193_100011216222 [0,2,0,0,0,0|1,1,0]=4 20873 B18R2.9237 Fc1ccc(nc1)CSCc2ccccc2I 62a_100011216222_100000703193 [0,2,0,0,0,0|1,1,0]=4 20874 B18R2.9237 Fc1ccccc1CCNc2ccc(cc2)Br 2230a_100000210018_100011713696 [0,2,0,0,0,0|2,0,0]=4 20875 B18R2.9237 Fc1ccccc1CCNc2ccc(cc2)Br 34a_100000210018_100000720011 [0,2,0,0,0,0|2,0,0]=4 20876 B18R2.9237 Fc1ccccc1CCNc2ccc(cc2)Cl 2230a_100000210052_100011713696 [0,2,0,0,0,0|2,0,0]=4 20877 B18R2.9237 Fc1ccccc1CCNc2ccc(cc2)Cl 34a_100000210052_100000720011 [0,2,0,0,0,0|2,0,0]=4 20878 B18R2.9237 Fc1ccccc1CCNc2ccc(cc2)I 34a_100000185761_100000720011 [0,2,0,0,0,0|2,0,0]=4 20879 B18R2.9237 Fc1ccccc1CCOc2ccc(cc2)Br 34a_100000185759_100000720011 [0,2,0,0,0,0|2,0,0]=4 20880 B18R2.9237 Fc1ccccc1CCOc2ccc(cc2)Br 7a_100000185759_100000720011 [0,2,0,0,0,0|2,0,0]=4 20881 B18R2.9237 Fc1ccccc1CCOc2ccc(cc2)Cl 34a_100000210216_100000720011 [0,2,0,0,0,0|2,0,0]=4 20882 B18R2.9237 Fc1ccccc1CCOc2ccc(cc2)Cl 7a_100000210216_100000720011 [0,2,0,0,0,0|2,0,0]=4 20883 B18R2.9237 Fc1ccccc1CCOc2ccc(cc2)I 34a_100000212066_100000720011 [0,2,0,0,0,0|2,0,0]=4 20884 B18R2.9237 Fc1ccccc1CCOc2ccc(cc2)I 7a_100000212066_100000720011 [0,2,0,0,0,0|2,0,0]=4 20885 B18R2.9237 Fc1ccccc1CCSc2ccc(cc2)Br 62a_100000752885_100011713696 [0,2,0,0,0,0|2,0,0]=4 20886 B18R2.9237 Fc1ccccc1CCSc2ccc(cc2)Br 62a_100011713696_100000752885 [0,2,0,0,0,0|2,0,0]=4 20887 B18R2.9237 Fc1ccccc1CCSc2ccc(cc2)Cl 62a_100000755918_100011713696 [0,2,0,0,0,0|2,0,0]=4 20888 B18R2.9237 Fc1ccccc1CCSc2ccc(cc2)Cl 62a_100011713696_100000755918 [0,2,0,0,0,0|2,0,0]=4 20889 B18R2.9237 Fc1ccccc1CNCc2ccc(cc2)Br 207a_100000174869_100000186029 [0,2,0,0,0,0|1,0,0]=3 20890 B18R2.9237 Fc1ccccc1CNCc2ccc(cc2)Br 207a_100000174875_100000210811 [0,2,0,0,0,0|1,0,0]=3 20891 B18R2.9237 Fc1ccccc1CNCc2ccc(cc2)Br 2230a_100000174875_100000211605 [0,2,0,0,0,0|1,0,0]=3 20892 B18R2.9237 Fc1ccccc1CNCc2ccc(cc2)Br 270004a_100000174869_100000186029 [0,2,0,0,0,0|1,0,0]=3 20893 B18R2.9237 Fc1ccccc1CNCc2ccc(cc2)Br 270004a_100000174875_100000210811 [0,2,0,0,0,0|1,0,0]=3 20894 B18R2.9237 Fc1ccccc1CNCc2ccc(cc2)Br 34a_100000174869_100000189115 [0,2,0,0,0,0|1,0,0]=3 20895 B18R2.9237 Fc1ccccc1CNCc2ccc(cc2)Br 34a_100000174875_100000211605 [0,2,0,0,0,0|1,0,0]=3 20896 B18R2.9237 Fc1ccccc1CNCc2ccc(cc2)Cl 207a_100000174869_100000189385 [0,2,0,0,0,0|1,0,0]=3 20897 B18R2.9237 Fc1ccccc1CNCc2ccc(cc2)Cl 207a_100000174871_100000210811 [0,2,0,0,0,0|1,0,0]=3 20898 B18R2.9237 Fc1ccccc1CNCc2ccc(cc2)Cl 2230a_100000174871_100000211605 [0,2,0,0,0,0|1,0,0]=3 20899 B18R2.9237 Fc1ccccc1CNCc2ccc(cc2)Cl 270004a_100000174869_100000189385 [0,2,0,0,0,0|1,0,0]=3 20900 B18R2.9237 Fc1ccccc1CNCc2ccc(cc2)Cl 270004a_100000174871_100000210811 [0,2,0,0,0,0|1,0,0]=3 20901 B18R2.9237 Fc1ccccc1CNCc2ccc(cc2)Cl 34a_100000174869_100000694040 [0,2,0,0,0,0|1,0,0]=3 20902 B18R2.9237 Fc1ccccc1CNCc2ccc(cc2)Cl 34a_100000174871_100000211605 [0,2,0,0,0,0|1,0,0]=3 20903 B18R2.9237 Fc1ccccc1CNCc2ccc(cc2)I 207a_100000174869_100000188517 [0,2,0,0,0,0|1,0,0]=3 20904 B18R2.9237 Fc1ccccc1CNCc2ccc(cc2)I 207a_100016989417_100000210811 [0,2,0,0,0,0|1,0,0]=3 20905 B18R2.9237 Fc1ccccc1CNCc2ccc(cc2)I 2230a_100016989417_100000211605 [0,2,0,0,0,0|1,0,0]=3 20906 B18R2.9237 Fc1ccccc1CNCc2ccc(cc2)I 270004a_100016989417_100000210811 [0,2,0,0,0,0|1,0,0]=3 20907 B18R2.9237 Fc1ccccc1CNCc2ccc(cc2)I 34a_100000174869_100000189116 [0,2,0,0,0,0|1,0,0]=3 20908 B18R2.9237 Fc1ccccc1CNCc2ccc(cc2)I 34a_100016989417_100000211605 [0,2,0,0,0,0|1,0,0]=3 20909 B18R2.9237 Fc1ccccc1CNCc2ccc(cn2)Br 207a_100000174869_100000754260 [0,2,0,0,0,0|2,0,0]=4 20910 B18R2.9237 Fc1ccccc1CNCc2ccc(cn2)Br 270004a_100000174869_100000754260 [0,2,0,0,0,0|2,0,0]=4 20911 B18R2.9237 Fc1ccccc1CNCc2ccc(cn2)Br 34a_100000174869_100000702658 [0,2,0,0,0,0|2,0,0]=4 20912 B18R2.9237 Fc1ccccc1CNCc2ccc(cn2)Br 34a_100015188789_100000211605 [0,2,0,0,0,0|2,0,0]=4 20913 B18R2.9237 Fc1ccccc1CNCc2ccc(cn2)Cl 207a_100000174869_100011361569 [0,2,0,0,0,0|2,0,0]=4 20914 B18R2.9237 Fc1ccccc1CNCc2ccc(cn2)Cl 270004a_100000174869_100011361569 [0,2,0,0,0,0|2,0,0]=4 20915 B18R2.9237 Fc1ccccc1CNCc2ccc(cn2)Cl 270004a_100000697193_100000210811 [0,2,0,0,0,0|2,0,0]=4 20916 B18R2.9237 Fc1ccccc1CNCc2ccc(cn2)Cl 34a_100000174869_100012066911 [0,2,0,0,0,0|2,0,0]=4 20917 B18R2.9237 Fc1ccccc1CNCc2ccc(cn2)Cl 34a_100000697193_100000211605 [0,2,0,0,0,0|2,0,0]=4 20918 B18R2.9237 Fc1ccccc1CNCc2ccc(nc2)Br 207a_100009817727_100000210811 [0,2,0,0,0,0|2,0,0]=4 20919 B18R2.9237 Fc1ccccc1CNCc2ccc(nc2)Br 2230a_100009817727_100000211605 [0,2,0,0,0,0|2,0,0]=4 20920 B18R2.9237 Fc1ccccc1CNCc2ccc(nc2)Br 270004a_100009817727_100000210811 [0,2,0,0,0,0|2,0,0]=4 20921 B18R2.9237 Fc1ccccc1CNCc2ccc(nc2)Br 34a_100000174869_100009831999 [0,2,0,0,0,0|2,0,0]=4 20922 B18R2.9237 Fc1ccccc1CNCc2ccc(nc2)Br 34a_100009817727_100000211605 [0,2,0,0,0,0|2,0,0]=4 20923 B18R2.9237 Fc1ccccc1CNCc2ccc(nc2)Cl 207a_100000735879_100000210811 [0,2,0,0,0,0|2,0,0]=4 20924 B18R2.9237 Fc1ccccc1CNCc2ccc(nc2)Cl 2230a_100000735879_100000211605 [0,2,0,0,0,0|2,0,0]=4 20925 B18R2.9237 Fc1ccccc1CNCc2ccc(nc2)Cl 270004a_100000735879_100000210811 [0,2,0,0,0,0|2,0,0]=4 20926 B18R2.9237 Fc1ccccc1CNCc2ccc(nc2)Cl 34a_100000174869_100000735431 [0,2,0,0,0,0|2,0,0]=4 20927 B18R2.9237 Fc1ccccc1CNCc2ccc(nc2)Cl 34a_100000735879_100000211605 [0,2,0,0,0,0|2,0,0]=4 20928 B18R2.9237 Fc1ccccc1COCc2ccc(cc2)Br 34a_100000211962_100000189115 [0,2,0,0,0,0|0,0,0]=2 20929 B18R2.9237 Fc1ccccc1COCc2ccc(cc2)Br 34a_100000695286_100000211605 [0,2,0,0,0,0|0,0,0]=2 20930 B18R2.9237 Fc1ccccc1COCc2ccc(cc2)Br 7a_100000211962_100011217064 [0,2,0,0,0,0|0,0,0]=2 20931 B18R2.9237 Fc1ccccc1COCc2ccc(cc2)Cl 34a_100000211118_100000211605 [0,2,0,0,0,0|0,0,0]=2 20932 B18R2.9237 Fc1ccccc1COCc2ccc(cc2)Cl 34a_100000211962_100000694040 [0,2,0,0,0,0|0,0,0]=2 20933 B18R2.9237 Fc1ccccc1COCc2ccc(cc2)Cl 7a_100000211118_100000211605 [0,2,0,0,0,0|0,0,0]=2 20934 B18R2.9237 Fc1ccccc1COCc2ccc(cc2)Cl 7a_100000211962_100000187161 [0,2,0,0,0,0|0,0,0]=2 20935 B18R2.9237 Fc1ccccc1COCc2ccc(cc2)I 34a_100000211962_100000189116 [0,2,0,0,0,0|0,0,0]=2 20936 B18R2.9237 Fc1ccccc1COCc2ccc(cc2)I 34a_100000690907_100000211605 [0,2,0,0,0,0|0,0,0]=2 20937 B18R2.9237 Fc1ccccc1COCc2ccc(cc2)I 7a_100000211962_100000189116 [0,2,0,0,0,0|0,0,0]=2 20938 B18R2.9237 Fc1ccccc1COCc2ccc(cc2)I 7a_100000690907_100000211605 [0,2,0,0,0,0|0,0,0]=2 20939 B18R2.9237 Fc1ccccc1COCc2ccc(cn2)Br 34a_100000211962_100000702658 [0,2,0,0,0,0|1,0,0]=3 20940 B18R2.9237 Fc1ccccc1COCc2ccc(cn2)Br 34a_100000754261_100000211605 [0,2,0,0,0,0|1,0,0]=3 20941 B18R2.9237 Fc1ccccc1COCc2ccc(cn2)Br 7a_100000211962_100000702658 [0,2,0,0,0,0|1,0,0]=3 20942 B18R2.9237 Fc1ccccc1COCc2ccc(cn2)Cl 34a_100000211962_100012066911 [0,2,0,0,0,0|1,0,0]=3 20943 B18R2.9237 Fc1ccccc1COCc2ccc(cn2)Cl 34a_100000703999_100000211605 [0,2,0,0,0,0|1,0,0]=3 20944 B18R2.9237 Fc1ccccc1COCc2ccc(cn2)Cl 7a_100000211962_100012066911 [0,2,0,0,0,0|1,0,0]=3 20945 B18R2.9237 Fc1ccccc1COCc2ccc(nc2)Br 34a_100000211962_100009831999 [0,2,0,0,0,0|1,0,0]=3 20946 B18R2.9237 Fc1ccccc1COCc2ccc(nc2)Br 34a_100009816760_100000211605 [0,2,0,0,0,0|1,0,0]=3 20947 B18R2.9237 Fc1ccccc1COCc2ccc(nc2)Br 7a_100000211962_100009831999 [0,2,0,0,0,0|1,0,0]=3 20948 B18R2.9237 Fc1ccccc1COCc2ccc(nc2)Br 7a_100009816760_100000211605 [0,2,0,0,0,0|1,0,0]=3 20949 B18R2.9237 Fc1ccccc1COCc2ccc(nc2)Cl 34a_100000211962_100000735431 [0,2,0,0,0,0|1,0,0]=3 20950 B18R2.9237 Fc1ccccc1COCc2ccc(nc2)Cl 34a_100000755211_100000211605 [0,2,0,0,0,0|1,0,0]=3 20951 B18R2.9237 Fc1ccccc1COCc2ccc(nc2)Cl 7a_100000211962_100000735431 [0,2,0,0,0,0|1,0,0]=3 20952 B18R2.9237 Fc1ccccc1COCc2ccc(nc2)Cl 7a_100000755211_100000211605 [0,2,0,0,0,0|1,0,0]=3 20953 B18R2.9237 Fc1ccccc1COCc2ccc(nn2)Cl 34a_100000211962_100016992710 [0,2,0,0,0,0|2,0,0]=4 20954 B18R2.9237 Fc1ccccc1COCc2ccc(nn2)Cl 7a_100000211962_100016992710 [0,2,0,0,0,0|2,0,0]=4 20955 B18R2.9237 Fc1ccccc1COCc2cnc(cn2)Cl 34a_100012002382_100000211605 [0,2,0,0,0,0|2,0,0]=4 20956 B18R2.9237 Fc1ccccc1COCc2cnc(nc2)Cl 34a_100009855073_100000211605 [0,2,0,0,0,0|2,0,0]=4 20957 B18R2.9237 Fc1ccccc1COCc2cnc(nc2)Cl 7a_100009855073_100000211605 [0,2,0,0,0,0|2,0,0]=4 20958 B18R2.9237 Fc1ccccc1COCc2ncc(cn2)Br 34a_100000211962_100010064664 [0,2,0,0,0,0|2,0,0]=4 20959 B18R2.9237 Fc1ccccc1COCc2ncc(cn2)Br 7a_100000211962_100010064664 [0,2,0,0,0,0|2,0,0]=4 20960 B18R2.9237 Fc1ccccc1CSCc2ccc(cc2)Br 62a_100000189115_100000211605 [0,2,0,0,0,0|0,1,0]=3 20961 B18R2.9237 Fc1ccccc1CSCc2ccc(cc2)Br 62a_100000211605_100000189115 [0,2,0,0,0,0|0,1,0]=3 20962 B18R2.9237 Fc1ccccc1CSCc2ccc(cc2)Cl 62a_100000187161_100000211605 [0,2,0,0,0,0|0,1,0]=3 20963 B18R2.9237 Fc1ccccc1CSCc2ccc(cc2)Cl 62a_100000211605_100000187161 [0,2,0,0,0,0|0,1,0]=3 20964 B18R2.9237 Fc1ccccc1CSCc2ccc(cc2)I 62a_100000189116_100000211605 [0,2,0,0,0,0|0,1,0]=3 20965 B18R2.9237 Fc1ccccc1CSCc2ccc(cc2)I 62a_100000211605_100000189116 [0,2,0,0,0,0|0,1,0]=3 20966 B18R2.9237 Fc1ccccc1CSCc2ccc(cn2)Br 62a_100000211605_100000702658 [0,2,0,0,0,0|1,1,0]=4 20967 B18R2.9237 Fc1ccccc1CSCc2ccc(cn2)Br 62a_100000702658_100000211605 [0,2,0,0,0,0|1,1,0]=4 20968 B18R2.9237 Fc1ccccc1CSCc2ccc(cn2)Cl 62a_100000211605_100000697101 [0,2,0,0,0,0|1,1,0]=4 20969 B18R2.9237 Fc1ccccc1CSCc2ccc(cn2)Cl 62a_100012066911_100000211605 [0,2,0,0,0,0|1,1,0]=4 20970 B18R2.9237 Fc1ccccc1CSCc2ccc(nc2)Br 62a_100000211605_100009831999 [0,2,0,0,0,0|1,1,0]=4 20971 B18R2.9237 Fc1ccccc1CSCc2ccc(nc2)Br 62a_100009831999_100000211605 [0,2,0,0,0,0|1,1,0]=4 20972 B18R2.9237 Fc1ccccc1CSCc2ccc(nc2)Cl 62a_100000211605_100000735431 [0,2,0,0,0,0|1,1,0]=4 20973 B18R2.9237 Fc1ccccc1CSCc2ccc(nc2)Cl 62a_100000735431_100000211605 [0,2,0,0,0,0|1,1,0]=4 20974 B18R2.9237 Fc1ccccc1NCCc2ccc(cc2)Br 34a_100000210422_100011740612 [0,2,0,0,0,0|2,0,0]=4 20975 B18R2.9237 Fc1ccccc1NCCc2ccc(cc2)Cl 34a_100000210422_100011713675 [0,2,0,0,0,0|2,0,0]=4 20976 B18R2.9237 Fc1ccccc1OCCc2ccc(cc2)Br 34a_100000210171_100011740612 [0,2,0,0,0,0|2,0,0]=4 20977 B18R2.9237 Fc1ccccc1OCCc2ccc(cc2)Br 7a_100000210171_100011740612 [0,2,0,0,0,0|2,0,0]=4 20978 B18R2.9237 Fc1ccccc1OCCc2ccc(cc2)Cl 34a_100000210171_100011713675 [0,2,0,0,0,0|2,0,0]=4 20979 B18R2.9237 Fc1ccccc1OCCc2ccc(cc2)Cl 7a_100000210171_100011713675 [0,2,0,0,0,0|2,0,0]=4 20980 B18R2.9237 Fc1ccccc1SCCc2ccc(cc2)Br 62a_100011215700_100011740612 [0,2,0,0,0,0|2,0,0]=4 20981 B18R2.9237 Fc1ccccc1SCCc2ccc(cc2)Br 62a_100011740612_100011215700 [0,2,0,0,0,0|2,0,0]=4 20982 B18R2.9237 Fc1ccccc1SCCc2ccc(cc2)Cl 62a_100011215700_100011713675 [0,2,0,0,0,0|2,0,0]=4 20983 B18R2.9237 Fc1ccccc1SCCc2ccc(cc2)Cl 62a_100011713675_100011215700 [0,2,0,0,0,0|2,0,0]=4 20984 B18R2.9237 Fc1cccnc1CNCc2ccc(cc2)Br 207a_100000174875_100011934734 [0,2,0,0,0,0|2,0,0]=4 20985 B18R2.9237 Fc1cccnc1CNCc2ccc(cc2)Br 2230a_100000174875_100000104219 [0,2,0,0,0,0|2,0,0]=4 20986 B18R2.9237 Fc1cccnc1CNCc2ccc(cc2)Br 270004a_100000174875_100011934734 [0,2,0,0,0,0|2,0,0]=4 20987 B18R2.9237 Fc1cccnc1CNCc2ccc(cc2)Br 270004a_100000690088_100000186029 [0,2,0,0,0,0|2,0,0]=4 20988 B18R2.9237 Fc1cccnc1CNCc2ccc(cc2)Br 34a_100000174875_100000104219 [0,2,0,0,0,0|2,0,0]=4 20989 B18R2.9237 Fc1cccnc1CNCc2ccc(cc2)Br 34a_100000690088_100000189115 [0,2,0,0,0,0|2,0,0]=4 20990 B18R2.9237 Fc1cccnc1CNCc2ccc(cc2)Cl 207a_100000174871_100011934734 [0,2,0,0,0,0|2,0,0]=4 20991 B18R2.9237 Fc1cccnc1CNCc2ccc(cc2)Cl 2230a_100000174871_100000104219 [0,2,0,0,0,0|2,0,0]=4 20992 B18R2.9237 Fc1cccnc1CNCc2ccc(cc2)Cl 270004a_100000174871_100011934734 [0,2,0,0,0,0|2,0,0]=4 20993 B18R2.9237 Fc1cccnc1CNCc2ccc(cc2)Cl 270004a_100000690088_100000189385 [0,2,0,0,0,0|2,0,0]=4 20994 B18R2.9237 Fc1cccnc1CNCc2ccc(cc2)Cl 34a_100000174871_100000104219 [0,2,0,0,0,0|2,0,0]=4 20995 B18R2.9237 Fc1cccnc1CNCc2ccc(cc2)Cl 34a_100000690088_100000694040 [0,2,0,0,0,0|2,0,0]=4 20996 B18R2.9237 Fc1cccnc1CNCc2ccc(cc2)I 207a_100016989417_100011934734 [0,2,0,0,0,0|2,0,0]=4 20997 B18R2.9237 Fc1cccnc1CNCc2ccc(cc2)I 2230a_100016989417_100000104219 [0,2,0,0,0,0|2,0,0]=4 20998 B18R2.9237 Fc1cccnc1CNCc2ccc(cc2)I 270004a_100016989417_100011934734 [0,2,0,0,0,0|2,0,0]=4 20999 B18R2.9237 Fc1cccnc1CNCc2ccc(cc2)I 34a_100000690088_100000189116 [0,2,0,0,0,0|2,0,0]=4 21000 B18R2.9237 Fc1cccnc1CNCc2ccc(cc2)I 34a_100016989417_100000104219 [0,2,0,0,0,0|2,0,0]=4 21001 B18R2.9237 Fc1cccnc1COCc2ccc(cc2)Br 34a_100000695286_100000104219 [0,2,0,0,0,0|1,0,0]=3 21002 B18R2.9237 Fc1cccnc1COCc2ccc(cc2)Br 34a_100011934865_100000189115 [0,2,0,0,0,0|1,0,0]=3 21003 B18R2.9237 Fc1cccnc1COCc2ccc(cc2)Cl 34a_100000211118_100000104219 [0,2,0,0,0,0|1,0,0]=3 21004 B18R2.9237 Fc1cccnc1COCc2ccc(cc2)Cl 34a_100011934865_100000694040 [0,2,0,0,0,0|1,0,0]=3 21005 B18R2.9237 Fc1cccnc1COCc2ccc(cc2)Cl 7a_100000211118_100000104219 [0,2,0,0,0,0|1,0,0]=3 21006 B18R2.9237 Fc1cccnc1COCc2ccc(cc2)I 34a_100000690907_100000104219 [0,2,0,0,0,0|1,0,0]=3 21007 B18R2.9237 Fc1cccnc1COCc2ccc(cc2)I 34a_100011934865_100000189116 [0,2,0,0,0,0|1,0,0]=3 21008 B18R2.9237 Fc1cccnc1COCc2ccc(cc2)I 7a_100000690907_100000104219 [0,2,0,0,0,0|1,0,0]=3 21009 B18R2.9237 Fc1cccnc1COCc2ccc(cn2)Br 34a_100000754261_100000104219 [0,2,0,0,0,0|2,0,0]=4 21010 B18R2.9237 Fc1cccnc1COCc2ccc(cn2)Br 34a_100011934865_100000702658 [0,2,0,0,0,0|2,0,0]=4 21011 B18R2.9237 Fc1cccnc1COCc2ccc(cn2)Cl 34a_100000703999_100000104219 [0,2,0,0,0,0|2,0,0]=4 21012 B18R2.9237 Fc1cccnc1COCc2ccc(cn2)Cl 34a_100011934865_100012066911 [0,2,0,0,0,0|2,0,0]=4 21013 B18R2.9237 Fc1cccnc1COCc2ccc(nc2)Br 34a_100009816760_100000104219 [0,2,0,0,0,0|2,0,0]=4 21014 B18R2.9237 Fc1cccnc1COCc2ccc(nc2)Br 34a_100011934865_100009831999 [0,2,0,0,0,0|2,0,0]=4 21015 B18R2.9237 Fc1cccnc1COCc2ccc(nc2)Br 7a_100009816760_100000104219 [0,2,0,0,0,0|2,0,0]=4 21016 B18R2.9237 Fc1cccnc1COCc2ccc(nc2)Cl 34a_100000755211_100000104219 [0,2,0,0,0,0|2,0,0]=4 21017 B18R2.9237 Fc1cccnc1COCc2ccc(nc2)Cl 34a_100011934865_100000735431 [0,2,0,0,0,0|2,0,0]=4 21018 B18R2.9237 Fc1cccnc1COCc2ccc(nc2)Cl 7a_100000755211_100000104219 [0,2,0,0,0,0|2,0,0]=4 21019 B18R2.9237 Fc1cccnc1CSCc2ccc(cc2)Br 62a_100000104219_100000189115 [0,2,0,0,0,0|1,1,0]=4 21020 B18R2.9237 Fc1cccnc1CSCc2ccc(cc2)Br 62a_100000189115_100000104219 [0,2,0,0,0,0|1,1,0]=4 21021 B18R2.9237 Fc1cccnc1CSCc2ccc(cc2)Cl 62a_100000104219_100000187161 [0,2,0,0,0,0|1,1,0]=4 21022 B18R2.9237 Fc1cccnc1CSCc2ccc(cc2)Cl 62a_100000187161_100000104219 [0,2,0,0,0,0|1,1,0]=4 21023 B18R2.9237 Fc1cccnc1CSCc2ccc(cc2)I 62a_100000104219_100000189116 [0,2,0,0,0,0|1,1,0]=4 21024 B18R2.9237 Fc1cccnc1CSCc2ccc(cc2)I 62a_100000189116_100000104219 [0,2,0,0,0,0|1,1,0]=4 21025 B18R2.9237 Fc1cnccc1CNCc2ccc(cc2)Br 207a_100011935246_100000186029 [0,2,0,0,0,0|2,0,0]=4 21026 B18R2.9237 Fc1cnccc1CNCc2ccc(cc2)Br 270004a_100011935246_100000186029 [0,2,0,0,0,0|2,0,0]=4 21027 B18R2.9237 Fc1cnccc1CNCc2ccc(cc2)Br 34a_100011935246_100000189115 [0,2,0,0,0,0|2,0,0]=4 21028 B18R2.9237 Fc1cnccc1CNCc2ccc(cc2)Cl 207a_100011935246_100000189385 [0,2,0,0,0,0|2,0,0]=4 21029 B18R2.9237 Fc1cnccc1CNCc2ccc(cc2)Cl 270004a_100011935246_100000189385 [0,2,0,0,0,0|2,0,0]=4 21030 B18R2.9237 Fc1cnccc1CNCc2ccc(cc2)Cl 34a_100011935246_100000694040 [0,2,0,0,0,0|2,0,0]=4 21031 B18R2.9237 Fc1cnccc1CNCc2ccc(cc2)I 207a_100011935246_100000188517 [0,2,0,0,0,0|2,0,0]=4 21032 B18R2.9237 Fc1cnccc1CNCc2ccc(cc2)I 34a_100011935246_100000189116 [0,2,0,0,0,0|2,0,0]=4 21033 B18R2.9237 Fc1cnccc1COCc2ccc(cc2)Br 34a_100012172863_100000189115 [0,2,0,0,0,0|1,0,0]=3 21034 B18R2.9237 Fc1cnccc1COCc2ccc(cc2)Cl 34a_100012172863_100000694040 [0,2,0,0,0,0|1,0,0]=3 21035 B18R2.9237 Fc1cnccc1COCc2ccc(cc2)I 34a_100012172863_100000189116 [0,2,0,0,0,0|1,0,0]=3 21036 B18R2.9237 Fc1cnccc1COCc2ccc(cn2)Br 34a_100012172863_100000702658 [0,2,0,0,0,0|2,0,0]=4 21037 B18R2.9237 Fc1cnccc1COCc2ccc(cn2)Cl 34a_100012172863_100012066911 [0,2,0,0,0,0|2,0,0]=4 21038 B18R2.9237 Fc1cnccc1COCc2ccc(nc2)Br 34a_100012172863_100009831999 [0,2,0,0,0,0|2,0,0]=4 21039 B18R2.9237 Fc1cnccc1COCc2ccc(nc2)Cl 34a_100012172863_100000735431 [0,2,0,0,0,0|2,0,0]=4 21040 B18R2.9237 Fc1ncccc1CNCc2ccc(cc2)Br 2230a_100000174875_100000099810 [0,2,0,0,0,0|2,0,0]=4 21041 B18R2.9237 Fc1ncccc1CNCc2ccc(cc2)Br 270004a_100000724633_100000186029 [0,2,0,0,0,0|2,0,0]=4 21042 B18R2.9237 Fc1ncccc1CNCc2ccc(cc2)Br 34a_100000174875_100000099810 [0,2,0,0,0,0|2,0,0]=4 21043 B18R2.9237 Fc1ncccc1CNCc2ccc(cc2)Br 34a_100000724633_100000189115 [0,2,0,0,0,0|2,0,0]=4 21044 B18R2.9237 Fc1ncccc1CNCc2ccc(cc2)Cl 2230a_100000174871_100000099810 [0,2,0,0,0,0|2,0,0]=4 21045 B18R2.9237 Fc1ncccc1CNCc2ccc(cc2)Cl 270004a_100000724633_100000189385 [0,2,0,0,0,0|2,0,0]=4 21046 B18R2.9237 Fc1ncccc1CNCc2ccc(cc2)Cl 34a_100000174871_100000099810 [0,2,0,0,0,0|2,0,0]=4 21047 B18R2.9237 Fc1ncccc1CNCc2ccc(cc2)Cl 34a_100000724633_100000694040 [0,2,0,0,0,0|2,0,0]=4 21048 B18R2.9237 Fc1ncccc1CNCc2ccc(cc2)I 2230a_100016989417_100000099810 [0,2,0,0,0,0|2,0,0]=4 21049 B18R2.9237 Fc1ncccc1CNCc2ccc(cc2)I 34a_100000724633_100000189116 [0,2,0,0,0,0|2,0,0]=4 21050 B18R2.9237 Fc1ncccc1CNCc2ccc(cc2)I 34a_100016989417_100000099810 [0,2,0,0,0,0|2,0,0]=4 21051 B18R2.9237 Fc1ncccc1COCc2ccc(cc2)Br 34a_100000079888_100000189115 [0,2,0,0,0,0|1,0,0]=3 21052 B18R2.9237 Fc1ncccc1COCc2ccc(cc2)Br 34a_100000695286_100000099810 [0,2,0,0,0,0|1,0,0]=3 21053 B18R2.9237 Fc1ncccc1COCc2ccc(cc2)Br 7a_100000079888_100011217064 [0,2,0,0,0,0|1,0,0]=3 21054 B18R2.9237 Fc1ncccc1COCc2ccc(cc2)Cl 34a_100000079888_100000694040 [0,2,0,0,0,0|1,0,0]=3 21055 B18R2.9237 Fc1ncccc1COCc2ccc(cc2)Cl 34a_100000211118_100000099810 [0,2,0,0,0,0|1,0,0]=3 21056 B18R2.9237 Fc1ncccc1COCc2ccc(cc2)Cl 7a_100000079888_100000187161 [0,2,0,0,0,0|1,0,0]=3 21057 B18R2.9237 Fc1ncccc1COCc2ccc(cc2)Cl 7a_100000211118_100000099810 [0,2,0,0,0,0|1,0,0]=3 21058 B18R2.9237 Fc1ncccc1COCc2ccc(cc2)I 34a_100000079888_100000189116 [0,2,0,0,0,0|1,0,0]=3 21059 B18R2.9237 Fc1ncccc1COCc2ccc(cc2)I 34a_100000690907_100000099810 [0,2,0,0,0,0|1,0,0]=3 21060 B18R2.9237 Fc1ncccc1COCc2ccc(cc2)I 7a_100000079888_100000189116 [0,2,0,0,0,0|1,0,0]=3 21061 B18R2.9237 Fc1ncccc1COCc2ccc(cc2)I 7a_100000690907_100000099810 [0,2,0,0,0,0|1,0,0]=3 21062 B18R2.9237 Fc1ncccc1COCc2ccc(cn2)Br 34a_100000079888_100000702658 [0,2,0,0,0,0|2,0,0]=4 21063 B18R2.9237 Fc1ncccc1COCc2ccc(cn2)Br 34a_100000754261_100000099810 [0,2,0,0,0,0|2,0,0]=4 21064 B18R2.9237 Fc1ncccc1COCc2ccc(cn2)Br 7a_100000079888_100000702658 [0,2,0,0,0,0|2,0,0]=4 21065 B18R2.9237 Fc1ncccc1COCc2ccc(cn2)Cl 34a_100000079888_100012066911 [0,2,0,0,0,0|2,0,0]=4 21066 B18R2.9237 Fc1ncccc1COCc2ccc(cn2)Cl 34a_100000703999_100000099810 [0,2,0,0,0,0|2,0,0]=4 21067 B18R2.9237 Fc1ncccc1COCc2ccc(cn2)Cl 7a_100000079888_100012066911 [0,2,0,0,0,0|2,0,0]=4 21068 B18R2.9237 Fc1ncccc1COCc2ccc(nc2)Br 34a_100000079888_100009831999 [0,2,0,0,0,0|2,0,0]=4 21069 B18R2.9237 Fc1ncccc1COCc2ccc(nc2)Br 34a_100009816760_100000099810 [0,2,0,0,0,0|2,0,0]=4 21070 B18R2.9237 Fc1ncccc1COCc2ccc(nc2)Br 7a_100000079888_100009831999 [0,2,0,0,0,0|2,0,0]=4 21071 B18R2.9237 Fc1ncccc1COCc2ccc(nc2)Br 7a_100009816760_100000099810 [0,2,0,0,0,0|2,0,0]=4 21072 B18R2.9237 Fc1ncccc1COCc2ccc(nc2)Cl 34a_100000079888_100000735431 [0,2,0,0,0,0|2,0,0]=4 21073 B18R2.9237 Fc1ncccc1COCc2ccc(nc2)Cl 34a_100000755211_100000099810 [0,2,0,0,0,0|2,0,0]=4 21074 B18R2.9237 Fc1ncccc1COCc2ccc(nc2)Cl 7a_100000079888_100000735431 [0,2,0,0,0,0|2,0,0]=4 21075 B18R2.9237 Fc1ncccc1COCc2ccc(nc2)Cl 7a_100000755211_100000099810 [0,2,0,0,0,0|2,0,0]=4 21076 B18R2.9237 Fc1ncccc1CSCc2ccc(cc2)Br 62a_100000099810_100000189115 [0,2,0,0,0,0|1,1,0]=4 21077 B18R2.9237 Fc1ncccc1CSCc2ccc(cc2)Br 62a_100000189115_100000099810 [0,2,0,0,0,0|1,1,0]=4 21078 B18R2.9237 Fc1ncccc1CSCc2ccc(cc2)Cl 62a_100000099810_100000187161 [0,2,0,0,0,0|1,1,0]=4 21079 B18R2.9237 Fc1ncccc1CSCc2ccc(cc2)Cl 62a_100000187161_100000099810 [0,2,0,0,0,0|1,1,0]=4 21080 B18R2.9237 Fc1ncccc1CSCc2ccc(cc2)I 62a_100000099810_100000189116 [0,2,0,0,0,0|1,1,0]=4 21081 B18R2.9237 Fc1ncccc1CSCc2ccc(cc2)I 62a_100000189116_100000099810 [0,2,0,0,0,0|1,1,0]=4 21082 B18R2.9237 Ic1ccc(cc1)CNCc2ccccc2I 207a_100015347259_100000188517 [0,2,0,0,0,0|1,0,0]=3 21083 B18R2.9237 Ic1ccc(cc1)CNCc2ccccc2I 207a_100016989417_100000010305 [0,2,0,0,0,0|1,0,0]=3 21084 B18R2.9237 Ic1ccc(cc1)CNCc2ccccc2I 2230a_100016989417_100011215278 [0,2,0,0,0,0|1,0,0]=3 21085 B18R2.9237 Ic1ccc(cc1)CNCc2ccccc2I 270004a_100016989417_100000010305 [0,2,0,0,0,0|1,0,0]=3 21086 B18R2.9237 Ic1ccc(cc1)CNCc2ccccc2I 34a_100016989417_100011215278 [0,2,0,0,0,0|1,0,0]=3 21087 B18R2.9237 Ic1ccc(cc1)COCc2ccccc2I 34a_100000187465_100000189116 [0,2,0,0,0,0|0,0,0]=2 21088 B18R2.9237 Ic1ccc(cc1)COCc2ccccc2I 34a_100000690907_100011215278 [0,2,0,0,0,0|0,0,0]=2 21089 B18R2.9237 Ic1ccc(cc1)COCc2ccccc2I 7a_100000187465_100000189116 [0,2,0,0,0,0|0,0,0]=2 21090 B18R2.9237 Ic1ccc(cc1)COCc2ccccc2I 7a_100000690907_100011215278 [0,2,0,0,0,0|0,0,0]=2 21091 B18R2.9237 Ic1ccc(cc1)CSCc2ccccc2I 62a_100000189116_100011216222 [0,2,0,0,0,0|0,1,0]=3 21092 B18R2.9237 Ic1ccc(cc1)CSCc2ccccc2I 62a_100011216222_100000189116 [0,2,0,0,0,0|0,1,0]=3 21093 B18R2.9237 Nc1ccc(cc1)COCc2ccccc2Br 34a_100011215238_100000184730 [0,2,0,0,0,0|0,0,0]=2 21094 B18R2.9237 Nc1ccc(cc1)COCc2ccccc2Cl 34a_100011215238_100000187162 [0,2,0,0,0,0|0,0,0]=2 21095 B18R2.9237 Nc1ccc(cc1)COCc2ccccc2F 34a_100011215238_100000211605 [0,2,0,0,0,0|0,0,0]=2 21096 B18R2.9237 Nc1ccc(cc1)COCc2ccccc2I 34a_100011215238_100011215278 [0,2,0,0,0,0|0,0,0]=2 21097 B18R2.9237 Nc1ccc(cc1)COCc2cccnc2Br 34a_100011215238_100010140945 [0,2,0,0,0,0|1,0,0]=3 21098 B18R2.9237 Nc1ccc(cc1)COCc2cccnc2Cl 34a_100011215238_100000045678 [0,2,0,0,0,0|1,0,0]=3 21099 B18R2.9237 Nc1ccc(cc1)COCc2cccnc2F 34a_100011215238_100000099810 [0,2,0,0,0,0|1,0,0]=3 21100 B18R2.9237 Nc1ccc(cc1)COCc2ncccc2Br 34a_100011215238_100025702911 [0,2,0,0,0,0|1,0,0]=3 21101 B18R2.9237 Nc1ccc(cc1)COCc2ncccc2F 34a_100011215238_100000104219 [0,2,0,0,0,0|1,0,0]=3 21102 B18R2.9237 Nc1ccc(cc1)COCc2ncccc2O 34a_100011215238_200020655725 [0,2,0,0,0,0|1,0,0]=3 21103 B18R2.9237 Nc1ccc(cc1)OCCc2ccccc2Br 34a_100000185829_100012161201 [0,2,0,0,0,0|2,0,0]=4 21104 B18R2.9237 Nc1ccc(cc1)OCCc2ccccc2Cl 34a_100000185829_100011713703 [0,2,0,0,0,0|2,0,0]=4 21105 B18R2.9237 Nc1ccc(cc1)OCCc2ccccc2F 34a_100000185829_100000720011 [0,2,0,0,0,0|2,0,0]=4 21106 B18R2.9237 Nc1ccc(cc1)OCCc2ccccc2O 34a_100000185829_100000722297 [0,2,0,0,0,0|2,0,0]=4 21107 B18R2.9237 Nc1ccc(cc1)SCCc2ccccc2Br 62a_100000185761_100012161201 [0,2,0,0,0,0|2,0,0]=4 21108 B18R2.9237 Nc1ccc(cc1)SCCc2ccccc2Br 62a_100012161201_100000185761 [0,2,0,0,0,0|2,0,0]=4 21109 B18R2.9237 Nc1ccc(cc1)SCCc2ccccc2Cl 62a_100000185761_100011713703 [0,2,0,0,0,0|2,0,0]=4 21110 B18R2.9237 Nc1ccc(cc1)SCCc2ccccc2Cl 62a_100011713703_100000185761 [0,2,0,0,0,0|2,0,0]=4 21111 B18R2.9237 Nc1ccc(cc1)SCCc2ccccc2F 62a_100000185761_100011713696 [0,2,0,0,0,0|2,0,0]=4 21112 B18R2.9237 Nc1ccc(cc1)SCCc2ccccc2F 62a_100011713696_100000185761 [0,2,0,0,0,0|2,0,0]=4 21113 B18R2.9237 Nc1ccc(cc1)SCCc2ccccc2O 62a_100000185761_100000722297 [0,2,0,0,0,0|2,0,0]=4 21114 B18R2.9237 Nc1ccc(cc1)SCCc2ccccc2O 62a_100000722297_100000185761 [0,2,0,0,0,0|2,0,0]=4 21115 B18R2.9237 Nc1ccc(cn1)COCc2ccccc2Br 34a_100000704267_100000184730 [0,2,0,0,0,0|1,0,0]=3 21116 B18R2.9237 Nc1ccc(cn1)COCc2ccccc2Cl 34a_100000704267_100000187162 [0,2,0,0,0,0|1,0,0]=3 21117 B18R2.9237 Nc1ccc(cn1)COCc2ccccc2F 34a_100000704267_100000211605 [0,2,0,0,0,0|1,0,0]=3 21118 B18R2.9237 Nc1ccc(cn1)COCc2ccccc2I 34a_100000704267_100011215278 [0,2,0,0,0,0|1,0,0]=3 21119 B18R2.9237 Nc1ccc(cn1)COCc2cccnc2Br 34a_100000704267_100010140945 [0,2,0,0,0,0|2,0,0]=4 21120 B18R2.9237 Nc1ccc(cn1)COCc2cccnc2Cl 34a_100000704267_100000045678 [0,2,0,0,0,0|2,0,0]=4 21121 B18R2.9237 Nc1ccc(cn1)COCc2cccnc2F 34a_100000704267_100000099810 [0,2,0,0,0,0|2,0,0]=4 21122 B18R2.9237 Nc1ccc(cn1)COCc2ncccc2Br 34a_100000704267_100025702911 [0,2,0,0,0,0|2,0,0]=4 21123 B18R2.9237 Nc1ccc(cn1)COCc2ncccc2F 34a_100000704267_100000104219 [0,2,0,0,0,0|2,0,0]=4 21124 B18R2.9237 Nc1ccc(cn1)COCc2ncccc2O 34a_100000704267_200020655725 [0,2,0,0,0,0|2,0,0]=4 21125 B18R2.9237 Nc1ccc(nc1)COCc2ccccc2Br 34a_100011998161_100000184730 [0,2,0,0,0,0|1,0,0]=3 21126 B18R2.9237 Nc1ccc(nc1)COCc2ccccc2Cl 34a_100011998161_100000187162 [0,2,0,0,0,0|1,0,0]=3 21127 B18R2.9237 Nc1ccc(nc1)COCc2ccccc2F 34a_100011998161_100000211605 [0,2,0,0,0,0|1,0,0]=3 21128 B18R2.9237 Nc1ccc(nc1)COCc2ccccc2I 34a_100011998161_100011215278 [0,2,0,0,0,0|1,0,0]=3 21129 B18R2.9237 Nc1ccc(nc1)COCc2cccnc2Br 34a_100011998161_100010140945 [0,2,0,0,0,0|2,0,0]=4 21130 B18R2.9237 Nc1ccc(nc1)COCc2cccnc2Cl 34a_100011998161_100000045678 [0,2,0,0,0,0|2,0,0]=4 21131 B18R2.9237 Nc1ccc(nc1)COCc2cccnc2F 34a_100011998161_100000099810 [0,2,0,0,0,0|2,0,0]=4 21132 B18R2.9237 Nc1ccc(nc1)COCc2ncccc2Br 34a_100011998161_100025702911 [0,2,0,0,0,0|2,0,0]=4 21133 B18R2.9237 Nc1ccc(nc1)COCc2ncccc2F 34a_100011998161_100000104219 [0,2,0,0,0,0|2,0,0]=4 21134 B18R2.9237 Nc1ccc(nc1)COCc2ncccc2O 34a_100011998161_200020655725 [0,2,0,0,0,0|2,0,0]=4 21135 B18R2.9237 Nc1ccccc1COCc2ccc(cc2)Br 34a_100000212039_100000189115 [0,2,0,0,0,0|0,0,0]=2 21136 B18R2.9237 Nc1ccccc1COCc2ccc(cc2)Cl 34a_100000212039_100000694040 [0,2,0,0,0,0|0,0,0]=2 21137 B18R2.9237 Nc1ccccc1COCc2ccc(cc2)F 34a_100000212039_100000198546 [0,2,0,0,0,0|0,0,0]=2 21138 B18R2.9237 Nc1ccccc1COCc2ccc(cc2)I 34a_100000212039_100000189116 [0,2,0,0,0,0|0,0,0]=2 21139 B18R2.9237 Nc1ccccc1COCc2ccc(cn2)Br 34a_100000212039_100000702658 [0,2,0,0,0,0|1,0,0]=3 21140 B18R2.9237 Nc1ccccc1COCc2ccc(cn2)Cl 34a_100000212039_100012066911 [0,2,0,0,0,0|1,0,0]=3 21141 B18R2.9237 Nc1ccccc1COCc2ccc(cn2)F 34a_100000212039_100000703193 [0,2,0,0,0,0|1,0,0]=3 21142 B18R2.9237 Nc1ccccc1COCc2ccc(nc2)Br 34a_100000212039_100009831999 [0,2,0,0,0,0|1,0,0]=3 21143 B18R2.9237 Nc1ccccc1COCc2ccc(nc2)Cl 34a_100000212039_100000735431 [0,2,0,0,0,0|1,0,0]=3 21144 B18R2.9237 Nc1ccccc1COCc2ccc(nc2)F 34a_100000212039_100000099788 [0,2,0,0,0,0|1,0,0]=3 21145 B18R2.9237 Nc1ccccc1COCc2ccc(nn2)Cl 34a_100000212039_100016992710 [0,2,0,0,0,0|2,0,0]=4 21146 B18R2.9237 Nc1ccccc1COCc2ncc(cn2)Br 34a_100000212039_100010064664 [0,2,0,0,0,0|2,0,0]=4 21147 B18R2.9237 Nc1ccccc1OCCc2ccc(cc2)Br 34a_100000185747_100011740612 [0,2,0,0,0,0|2,0,0]=4 21148 B18R2.9237 Nc1ccccc1OCCc2ccc(cc2)Br 7a_100000185747_100011740612 [0,2,0,0,0,0|2,0,0]=4 21149 B18R2.9237 Nc1ccccc1OCCc2ccc(cc2)Cl 34a_100000185747_100011713675 [0,2,0,0,0,0|2,0,0]=4 21150 B18R2.9237 Nc1ccccc1OCCc2ccc(cc2)Cl 7a_100000185747_100011713675 [0,2,0,0,0,0|2,0,0]=4 21151 B18R2.9237 Nc1ccccc1OCCc2ccc(cc2)F 34a_100000185747_100011217392 [0,2,0,0,0,0|2,0,0]=4 21152 B18R2.9237 Nc1ccccc1OCCc2ccc(cc2)F 7a_100000185747_100011217392 [0,2,0,0,0,0|2,0,0]=4 21153 B18R2.9237 Nc1ccccc1OCCc2ccc(cc2)O 7a_100000185747_100009816426 [0,2,0,0,0,0|2,0,0]=4 21154 B18R2.9237 Nc1ccccc1SCCc2ccc(cc2)Br 62a_100000210017_100011740612 [0,2,0,0,0,0|2,0,0]=4 21155 B18R2.9237 Nc1ccccc1SCCc2ccc(cc2)Br 62a_100011740612_100000210017 [0,2,0,0,0,0|2,0,0]=4 21156 B18R2.9237 Nc1ccccc1SCCc2ccc(cc2)Cl 62a_100000210017_100011713675 [0,2,0,0,0,0|2,0,0]=4 21157 B18R2.9237 Nc1ccccc1SCCc2ccc(cc2)Cl 62a_100011713675_100000210017 [0,2,0,0,0,0|2,0,0]=4 21158 B18R2.9237 Nc1ccccc1SCCc2ccc(cc2)F 62a_100000210017_100011217392 [0,2,0,0,0,0|2,0,0]=4 21159 B18R2.9237 Nc1ccccc1SCCc2ccc(cc2)F 62a_100011217392_100000210017 [0,2,0,0,0,0|2,0,0]=4 21160 B18R2.9237 Nc1ccccc1SCCc2ccc(cc2)O 62a_100000210017_100009816426 [0,2,0,0,0,0|2,0,0]=4 21161 B18R2.9237 Nc1ccccc1SCCc2ccc(cc2)O 62a_100009816426_100000210017 [0,2,0,0,0,0|2,0,0]=4 21162 B18R2.9237 Nc1cccnc1COCc2ccc(cc2)Br 34a_114873767017_100000189115 [0,2,0,0,0,0|1,0,0]=3 21163 B18R2.9237 Nc1cccnc1COCc2ccc(cc2)Cl 34a_114873767017_100000694040 [0,2,0,0,0,0|1,0,0]=3 21164 B18R2.9237 Nc1cccnc1COCc2ccc(cc2)F 34a_114873767017_100000198546 [0,2,0,0,0,0|1,0,0]=3 21165 B18R2.9237 Nc1cccnc1COCc2ccc(cc2)I 34a_114873767017_100000189116 [0,2,0,0,0,0|1,0,0]=3 21166 B18R2.9237 Nc1cccnc1COCc2ccc(cn2)Br 34a_114873767017_100000702658 [0,2,0,0,0,0|2,0,0]=4 21167 B18R2.9237 Nc1cccnc1COCc2ccc(cn2)Cl 34a_114873767017_100012066911 [0,2,0,0,0,0|2,0,0]=4 21168 B18R2.9237 Nc1cccnc1COCc2ccc(cn2)F 34a_114873767017_100000703193 [0,2,0,0,0,0|2,0,0]=4 21169 B18R2.9237 Nc1cccnc1COCc2ccc(nc2)Br 34a_114873767017_100009831999 [0,2,0,0,0,0|2,0,0]=4 21170 B18R2.9237 Nc1cccnc1COCc2ccc(nc2)Cl 34a_114873767017_100000735431 [0,2,0,0,0,0|2,0,0]=4 21171 B18R2.9237 Nc1cccnc1COCc2ccc(nc2)F 34a_114873767017_100000099788 [0,2,0,0,0,0|2,0,0]=4 21172 B18R2.9237 O=c1ccc(c[nH]1)COCc2ccccc2Br 34a_100011999846_100000184730 [0,2,0,0,0,0|1,0,0]=3 21173 B18R2.9237 O=c1ccc(c[nH]1)COCc2ccccc2Cl 34a_100011999846_100000187162 [0,2,0,0,0,0|1,0,0]=3 21174 B18R2.9237 O=c1ccc(c[nH]1)COCc2ccccc2F 34a_100011999846_100000211605 [0,2,0,0,0,0|1,0,0]=3 21175 B18R2.9237 O=c1ccc(c[nH]1)COCc2ccccc2I 34a_100011999846_100011215278 [0,2,0,0,0,0|1,0,0]=3 21176 B18R2.9237 O=c1ccc(c[nH]1)COCc2cccnc2Br 34a_100011999846_100010140945 [0,2,0,0,0,0|2,0,0]=4 21177 B18R2.9237 O=c1ccc(c[nH]1)COCc2cccnc2Cl 34a_100011999846_100000045678 [0,2,0,0,0,0|2,0,0]=4 21178 B18R2.9237 O=c1ccc(c[nH]1)COCc2cccnc2F 34a_100011999846_100000099810 [0,2,0,0,0,0|2,0,0]=4 21179 B18R2.9237 O=c1ccc(c[nH]1)COCc2ncccc2Br 34a_100011999846_100025702911 [0,2,0,0,0,0|2,0,0]=4 21180 B18R2.9237 O=c1ccc(c[nH]1)COCc2ncccc2F 34a_100011999846_100000104219 [0,2,0,0,0,0|2,0,0]=4 21181 B18R2.9237 O=c1ccc(c[nH]1)COCc2ncccc2O 34a_100011999846_200020655725 [0,2,0,0,0,0|2,0,0]=4 21182 B18R2.9237 Oc1ccc(cc1)CCOc2ccccc2Br 7a_100000181306_100009816426 [0,2,0,0,0,0|2,0,0]=4 21183 B18R2.9237 Oc1ccc(cc1)CCOc2ccccc2Cl 7a_100000210172_100009816426 [0,2,0,0,0,0|2,0,0]=4 21184 B18R2.9237 Oc1ccc(cc1)CCOc2ccccc2F 7a_100000210171_100009816426 [0,2,0,0,0,0|2,0,0]=4 21185 B18R2.9237 Oc1ccc(cc1)CCOc2ccccc2I 7a_100000739446_100009816426 [0,2,0,0,0,0|2,0,0]=4 21186 B18R2.9237 Oc1ccc(cc1)CCSc2ccccc2Br 62a_100000695589_100009816426 [0,2,0,0,0,0|2,0,0]=4 21187 B18R2.9237 Oc1ccc(cc1)CCSc2ccccc2Br 62a_100009816426_100000695589 [0,2,0,0,0,0|2,0,0]=4 21188 B18R2.9237 Oc1ccc(cc1)CCSc2ccccc2Cl 62a_100000764095_100009816426 [0,2,0,0,0,0|2,0,0]=4 21189 B18R2.9237 Oc1ccc(cc1)CCSc2ccccc2Cl 62a_100009816426_100000764095 [0,2,0,0,0,0|2,0,0]=4 21190 B18R2.9237 Oc1ccc(cc1)CCSc2ccccc2F 62a_100009816426_100011215700 [0,2,0,0,0,0|2,0,0]=4 21191 B18R2.9237 Oc1ccc(cc1)CCSc2ccccc2F 62a_100011215700_100009816426 [0,2,0,0,0,0|2,0,0]=4 21192 B18R2.9237 Oc1ccc(cc1)CCSc2ccccc2O 62a_100000739446_100009816426 [0,2,0,0,0,0|2,0,0]=4 21193 B18R2.9237 Oc1ccc(cc1)CCSc2ccccc2O 62a_100009816426_100000739446 [0,2,0,0,0,0|2,0,0]=4 21194 B18R2.9237 Oc1ccc(cc1)CNCc2ccccc2Br 34a_100000185549_100000184730 [0,2,0,0,0,0|1,0,0]=3 21195 B18R2.9237 Oc1ccc(cc1)CNCc2ccccc2Cl 34a_100000185549_100000187162 [0,2,0,0,0,0|1,0,0]=3 21196 B18R2.9237 Oc1ccc(cc1)CNCc2ccccc2F 34a_100000185549_100000211605 [0,2,0,0,0,0|1,0,0]=3 21197 B18R2.9237 Oc1ccc(cc1)CNCc2ccccc2I 34a_100000185549_100011215278 [0,2,0,0,0,0|1,0,0]=3 21198 B18R2.9237 Oc1ccc(cc1)CNCc2cccnc2Br 34a_100000185549_100010140945 [0,2,0,0,0,0|2,0,0]=4 21199 B18R2.9237 Oc1ccc(cc1)CNCc2cccnc2Cl 34a_100000185549_100000045678 [0,2,0,0,0,0|2,0,0]=4 21200 B18R2.9237 Oc1ccc(cc1)CNCc2cccnc2F 34a_100000185549_100000099810 [0,2,0,0,0,0|2,0,0]=4 21201 B18R2.9237 Oc1ccc(cc1)CNCc2ncccc2Br 34a_100000185549_100025702911 [0,2,0,0,0,0|2,0,0]=4 21202 B18R2.9237 Oc1ccc(cc1)CNCc2ncccc2F 34a_100000185549_100000104219 [0,2,0,0,0,0|2,0,0]=4 21203 B18R2.9237 Oc1ccc(cc1)CNCc2ncccc2O 34a_100000185549_200020655725 [0,2,0,0,0,0|2,0,0]=4 21204 B18R2.9237 Oc1ccc(cc1)NCCc2ccccc2Br 34a_100000185829_100012161201 [0,2,0,0,0,0|2,0,0]=4 21205 B18R2.9237 Oc1ccc(cc1)NCCc2ccccc2Cl 34a_100000185829_100011713703 [0,2,0,0,0,0|2,0,0]=4 21206 B18R2.9237 Oc1ccc(cc1)NCCc2ccccc2F 34a_100000185829_100000720011 [0,2,0,0,0,0|2,0,0]=4 21207 B18R2.9237 Oc1ccc(cc1)NCCc2ccccc2O 34a_100000185829_100000722297 [0,2,0,0,0,0|2,0,0]=4 21208 B18R2.9237 Oc1ccc(cc1)SCCc2ccccc2Br 62a_100012161201_100000185759 [0,2,0,0,0,0|2,0,0]=4 21209 B18R2.9237 Oc1ccc(cc1)SCCc2ccccc2Cl 62a_100011713703_100000185759 [0,2,0,0,0,0|2,0,0]=4 21210 B18R2.9237 Oc1ccc(cc1)SCCc2ccccc2F 62a_100011713696_100000185759 [0,2,0,0,0,0|2,0,0]=4 21211 B18R2.9237 Oc1ccc(cc1)SCCc2ccccc2O 62a_100000722297_100000185759 [0,2,0,0,0,0|2,0,0]=4 21212 B18R2.9237 Oc1ccc(cn1)CNCc2ccccc2Br 207a_100000689332_100011361521 [0,2,0,0,0,0|2,0,0]=4 21213 B18R2.9237 Oc1ccc(cn1)CNCc2ccccc2Br 2230a_100000757128_100000184730 [0,2,0,0,0,0|2,0,0]=4 21214 B18R2.9237 Oc1ccc(cn1)CNCc2ccccc2Cl 207a_100000174879_100011361521 [0,2,0,0,0,0|2,0,0]=4 21215 B18R2.9237 Oc1ccc(cn1)CNCc2ccccc2Cl 2230a_100000757128_100000187162 [0,2,0,0,0,0|2,0,0]=4 21216 B18R2.9237 Oc1ccc(cn1)CNCc2ccccc2F 207a_100000174869_100011361521 [0,2,0,0,0,0|2,0,0]=4 21217 B18R2.9237 Oc1ccc(cn1)CNCc2ccccc2F 2230a_100000757128_100000211605 [0,2,0,0,0,0|2,0,0]=4 21218 B18R2.9237 Oc1ccc(cn1)CNCc2ccccc2I 207a_100015347259_100011361521 [0,2,0,0,0,0|2,0,0]=4 21219 B18R2.9237 Oc1ccc(cn1)CNCc2ccccc2I 2230a_100000757128_100011215278 [0,2,0,0,0,0|2,0,0]=4 21220 B18R2.9237 Oc1ccc(cn1)CNCc2ccccc2O 207a_100000185550_100011361521 [0,2,0,0,0,0|2,0,0]=4 21221 B18R2.9237 Oc1ccccc1CCNc2ccc(cc2)Br 34a_100000210018_100000722297 [0,2,0,0,0,0|2,0,0]=4 21222 B18R2.9237 Oc1ccccc1CCNc2ccc(cc2)Cl 34a_100000210052_100000722297 [0,2,0,0,0,0|2,0,0]=4 21223 B18R2.9237 Oc1ccccc1CCNc2ccc(cc2)F 34a_100000185862_100000722297 [0,2,0,0,0,0|2,0,0]=4 21224 B18R2.9237 Oc1ccccc1CCNc2ccc(cc2)I 34a_100000185761_100000722297 [0,2,0,0,0,0|2,0,0]=4 21225 B18R2.9237 Oc1ccccc1CCOc2ccc(cc2)Br 34a_100000185759_100000722297 [0,2,0,0,0,0|2,0,0]=4 21226 B18R2.9237 Oc1ccccc1CCOc2ccc(cc2)Br 7a_100000185759_100000722297 [0,2,0,0,0,0|2,0,0]=4 21227 B18R2.9237 Oc1ccccc1CCOc2ccc(cc2)Cl 34a_100000210216_100000722297 [0,2,0,0,0,0|2,0,0]=4 21228 B18R2.9237 Oc1ccccc1CCOc2ccc(cc2)Cl 7a_100000210216_100000722297 [0,2,0,0,0,0|2,0,0]=4 21229 B18R2.9237 Oc1ccccc1CCOc2ccc(cc2)F 34a_100000210339_100000722297 [0,2,0,0,0,0|2,0,0]=4 21230 B18R2.9237 Oc1ccccc1CCOc2ccc(cc2)I 34a_100000212066_100000722297 [0,2,0,0,0,0|2,0,0]=4 21231 B18R2.9237 Oc1ccccc1CCOc2ccc(cc2)I 7a_100000212066_100000722297 [0,2,0,0,0,0|2,0,0]=4 21232 B18R2.9237 Oc1ccccc1CCSc2ccc(cc2)Br 62a_100000722297_100000752885 [0,2,0,0,0,0|2,0,0]=4 21233 B18R2.9237 Oc1ccccc1CCSc2ccc(cc2)Br 62a_100000752885_100000722297 [0,2,0,0,0,0|2,0,0]=4 21234 B18R2.9237 Oc1ccccc1CCSc2ccc(cc2)Cl 62a_100000722297_100000755918 [0,2,0,0,0,0|2,0,0]=4 21235 B18R2.9237 Oc1ccccc1CCSc2ccc(cc2)Cl 62a_100000755918_100000722297 [0,2,0,0,0,0|2,0,0]=4 21236 B18R2.9237 Oc1ccccc1CCSc2ccc(cc2)F 62a_100000211213_100000722297 [0,2,0,0,0,0|2,0,0]=4 21237 B18R2.9237 Oc1ccccc1CCSc2ccc(cc2)F 62a_100000722297_100000211213 [0,2,0,0,0,0|2,0,0]=4 21238 B18R2.9237 Oc1ccccc1CNCc2ccc(cc2)Br 207a_100000185550_100000186029 [0,2,0,0,0,0|1,0,0]=3 21239 B18R2.9237 Oc1ccccc1CNCc2ccc(cc2)Br 270004a_100000185550_100000186029 [0,2,0,0,0,0|1,0,0]=3 21240 B18R2.9237 Oc1ccccc1CNCc2ccc(cc2)Br 34a_100000185550_100000189115 [0,2,0,0,0,0|1,0,0]=3 21241 B18R2.9237 Oc1ccccc1CNCc2ccc(cc2)Cl 207a_100000185550_100000189385 [0,2,0,0,0,0|1,0,0]=3 21242 B18R2.9237 Oc1ccccc1CNCc2ccc(cc2)Cl 270004a_100000185550_100000189385 [0,2,0,0,0,0|1,0,0]=3 21243 B18R2.9237 Oc1ccccc1CNCc2ccc(cc2)Cl 34a_100000185550_100000694040 [0,2,0,0,0,0|1,0,0]=3 21244 B18R2.9237 Oc1ccccc1CNCc2ccc(cc2)F 207a_100000185550_100000210084 [0,2,0,0,0,0|1,0,0]=3 21245 B18R2.9237 Oc1ccccc1CNCc2ccc(cc2)F 270004a_100000185550_100000210084 [0,2,0,0,0,0|1,0,0]=3 21246 B18R2.9237 Oc1ccccc1CNCc2ccc(cc2)F 34a_100000185550_100000198546 [0,2,0,0,0,0|1,0,0]=3 21247 B18R2.9237 Oc1ccccc1CNCc2ccc(cc2)I 207a_100000185550_100000188517 [0,2,0,0,0,0|1,0,0]=3 21248 B18R2.9237 Oc1ccccc1CNCc2ccc(cc2)I 34a_100000185550_100000189116 [0,2,0,0,0,0|1,0,0]=3 21249 B18R2.9237 Oc1ccccc1CNCc2ccc(cn2)Br 207a_100000185550_100000754260 [0,2,0,0,0,0|2,0,0]=4 21250 B18R2.9237 Oc1ccccc1CNCc2ccc(cn2)Br 270004a_100000185550_100000754260 [0,2,0,0,0,0|2,0,0]=4 21251 B18R2.9237 Oc1ccccc1CNCc2ccc(cn2)Br 34a_100000185550_100000702658 [0,2,0,0,0,0|2,0,0]=4 21252 B18R2.9237 Oc1ccccc1CNCc2ccc(cn2)Cl 207a_100000185550_100011361569 [0,2,0,0,0,0|2,0,0]=4 21253 B18R2.9237 Oc1ccccc1CNCc2ccc(cn2)Cl 270004a_100000185550_100011361569 [0,2,0,0,0,0|2,0,0]=4 21254 B18R2.9237 Oc1ccccc1CNCc2ccc(cn2)Cl 34a_100000185550_100012066911 [0,2,0,0,0,0|2,0,0]=4 21255 B18R2.9237 Oc1ccccc1CNCc2ccc(cn2)F 207a_100000185550_100011934744 [0,2,0,0,0,0|2,0,0]=4 21256 B18R2.9237 Oc1ccccc1CNCc2ccc(cn2)F 270004a_100000185550_100011934744 [0,2,0,0,0,0|2,0,0]=4 21257 B18R2.9237 Oc1ccccc1CNCc2ccc(cn2)F 34a_100000185550_100000703193 [0,2,0,0,0,0|2,0,0]=4 21258 B18R2.9237 Oc1ccccc1CNCc2ccc(nc2)Br 34a_100000185550_100009831999 [0,2,0,0,0,0|2,0,0]=4 21259 B18R2.9237 Oc1ccccc1CNCc2ccc(nc2)Cl 34a_100000185550_100000735431 [0,2,0,0,0,0|2,0,0]=4 21260 B18R2.9237 Oc1ccccc1CNCc2ccc(nc2)F 34a_100000185550_100000099788 [0,2,0,0,0,0|2,0,0]=4 21261 B18R2.9237 Oc1ccccc1NCCc2ccc(cc2)Br 34a_100000185747_100011740612 [0,2,0,0,0,0|2,0,0]=4 21262 B18R2.9237 Oc1ccccc1NCCc2ccc(cc2)Cl 34a_100000185747_100011713675 [0,2,0,0,0,0|2,0,0]=4 21263 B18R2.9237 Oc1ccccc1NCCc2ccc(cc2)F 34a_100000185747_100011217392 [0,2,0,0,0,0|2,0,0]=4 21264 B18R2.9237 Oc1ccccc1SCCc2ccc(cc2)Br 62a_100000739446_100011740612 [0,2,0,0,0,0|2,0,0]=4 21265 B18R2.9237 Oc1ccccc1SCCc2ccc(cc2)Br 62a_100011740612_100000739446 [0,2,0,0,0,0|2,0,0]=4 21266 B18R2.9237 Oc1ccccc1SCCc2ccc(cc2)Cl 62a_100000739446_100011713675 [0,2,0,0,0,0|2,0,0]=4 21267 B18R2.9237 Oc1ccccc1SCCc2ccc(cc2)Cl 62a_100011713675_100000739446 [0,2,0,0,0,0|2,0,0]=4 21268 B18R2.9237 Oc1ccccc1SCCc2ccc(cc2)F 62a_100000739446_100011217392 [0,2,0,0,0,0|2,0,0]=4 21269 B18R2.9237 Oc1ccccc1SCCc2ccc(cc2)F 62a_100011217392_100000739446 [0,2,0,0,0,0|2,0,0]=4 21270 B18R2.9237 Oc1cccnc1CNCc2ccc(cc2)Br 34a_100000174875_200020655725 [0,2,0,0,0,0|2,0,0]=4 21271 B18R2.9237 Oc1cccnc1CNCc2ccc(cc2)Cl 34a_100000174871_200020655725 [0,2,0,0,0,0|2,0,0]=4 21272 B18R2.9237 Oc1cccnc1CNCc2ccc(cc2)F 34a_100000174882_200020655725 [0,2,0,0,0,0|2,0,0]=4 21273 B18R2.9237 Oc1cccnc1CNCc2ccc(cc2)I 34a_100016989417_200020655725 [0,2,0,0,0,0|2,0,0]=4 21274 B18R2.9237 Oc1cccnc1COCc2ccc(cc2)Br 34a_100000695286_200020655725 [0,2,0,0,0,0|1,0,0]=3 21275 B18R2.9237 Oc1cccnc1COCc2ccc(cc2)Cl 34a_100000211118_200020655725 [0,2,0,0,0,0|1,0,0]=3 21276 B18R2.9237 Oc1cccnc1COCc2ccc(cc2)Cl 7a_100000211118_200020655725 [0,2,0,0,0,0|1,0,0]=3 21277 B18R2.9237 Oc1cccnc1COCc2ccc(cc2)F 34a_100000210977_200020655725 [0,2,0,0,0,0|1,0,0]=3 21278 B18R2.9237 Oc1cccnc1COCc2ccc(cc2)F 7a_100000210977_200020655725 [0,2,0,0,0,0|1,0,0]=3 21279 B18R2.9237 Oc1cccnc1COCc2ccc(cc2)I 34a_100000690907_200020655725 [0,2,0,0,0,0|1,0,0]=3 21280 B18R2.9237 Oc1cccnc1COCc2ccc(cc2)I 7a_100000690907_200020655725 [0,2,0,0,0,0|1,0,0]=3 21281 B18R2.9237 Oc1cccnc1COCc2ccc(cn2)Br 34a_100000754261_200020655725 [0,2,0,0,0,0|2,0,0]=4 21282 B18R2.9237 Oc1cccnc1COCc2ccc(cn2)Cl 34a_100000703999_200020655725 [0,2,0,0,0,0|2,0,0]=4 21283 B18R2.9237 Oc1cccnc1COCc2ccc(cn2)F 34a_100011999454_200020655725 [0,2,0,0,0,0|2,0,0]=4 21284 B18R2.9237 Oc1cccnc1COCc2ccc(nc2)Br 34a_100009816760_200020655725 [0,2,0,0,0,0|2,0,0]=4 21285 B18R2.9237 Oc1cccnc1COCc2ccc(nc2)Br 7a_100009816760_200020655725 [0,2,0,0,0,0|2,0,0]=4 21286 B18R2.9237 Oc1cccnc1COCc2ccc(nc2)Cl 34a_100000755211_200020655725 [0,2,0,0,0,0|2,0,0]=4 21287 B18R2.9237 Oc1cccnc1COCc2ccc(nc2)Cl 7a_100000755211_200020655725 [0,2,0,0,0,0|2,0,0]=4 21288 B18R2.9237 Oc1cccnc1COCc2ccc(nc2)F 34a_100000079959_200020655725 [0,2,0,0,0,0|2,0,0]=4 21289 B18R2.9237 Oc1cccnc1CSCc2ccc(cc2)Br 62a_100000189115_200020655725 [0,2,0,0,0,0|1,1,0]=4 21290 B18R2.9237 Oc1cccnc1CSCc2ccc(cc2)Br 62a_200020655725_100000189115 [0,2,0,0,0,0|1,1,0]=4 21291 B18R2.9237 Oc1cccnc1CSCc2ccc(cc2)Cl 62a_100000187161_200020655725 [0,2,0,0,0,0|1,1,0]=4 21292 B18R2.9237 Oc1cccnc1CSCc2ccc(cc2)Cl 62a_200020655725_100000187161 [0,2,0,0,0,0|1,1,0]=4 21293 B18R2.9237 Oc1cccnc1CSCc2ccc(cc2)F 62a_100000198546_200020655725 [0,2,0,0,0,0|1,1,0]=4 21294 B18R2.9237 Oc1cccnc1CSCc2ccc(cc2)F 62a_200020655725_100000187164 [0,2,0,0,0,0|1,1,0]=4 21295 B18R2.9237 Oc1cccnc1CSCc2ccc(cc2)I 62a_100000189116_200020655725 [0,2,0,0,0,0|1,1,0]=4 21296 B18R2.9237 Oc1cccnc1CSCc2ccc(cc2)I 62a_200020655725_100000189116 [0,2,0,0,0,0|1,1,0]=4 21297 B18R2.9237 Oc1ncccc1CNCc2ccc(cc2)Br 207a_100000174875_100011998315 [0,2,0,0,0,0|2,0,0]=4 21298 B18R2.9237 Oc1ncccc1CNCc2ccc(cc2)Br 270004a_100000174875_100011998315 [0,2,0,0,0,0|2,0,0]=4 21299 B18R2.9237 Oc1ncccc1CNCc2ccc(cc2)Cl 207a_100000174871_100011998315 [0,2,0,0,0,0|2,0,0]=4 21300 B18R2.9237 Oc1ncccc1CNCc2ccc(cc2)Cl 270004a_100000174871_100011998315 [0,2,0,0,0,0|2,0,0]=4 21301 B18R2.9237 Oc1ncccc1CNCc2ccc(cc2)F 207a_100000174882_100011998315 [0,2,0,0,0,0|2,0,0]=4 21302 B18R2.9237 Oc1ncccc1CNCc2ccc(cc2)F 270004a_100000174882_100011998315 [0,2,0,0,0,0|2,0,0]=4 21303 B18R2.9237 Oc1ncccc1CNCc2ccc(cc2)I 207a_100016989417_100011998315 [0,2,0,0,0,0|2,0,0]=4 21304 B18R2.9237 Oc1ncccc1CNCc2ccc(cc2)I 270004a_100016989417_100011998315 [0,2,0,0,0,0|2,0,0]=4 21305 B18R2.9237 [O-][n+]1ccc(cc1)COCc2ccccc2Br 34a_100000031831_100000184730 [0,2,0,0,0,0|1,0,0]=3 21306 B18R2.9237 [O-][n+]1ccc(cc1)COCc2ccccc2Br 7a_100000031831_100000184730 [0,2,0,0,0,0|1,0,0]=3 21307 B18R2.9237 [O-][n+]1ccc(cc1)COCc2ccccc2Cl 34a_100000031831_100000187162 [0,2,0,0,0,0|1,0,0]=3 21308 B18R2.9237 [O-][n+]1ccc(cc1)COCc2ccccc2Cl 7a_100000031831_100000187162 [0,2,0,0,0,0|1,0,0]=3 21309 B18R2.9237 [O-][n+]1ccc(cc1)COCc2ccccc2F 34a_100000031831_100000211605 [0,2,0,0,0,0|1,0,0]=3 21310 B18R2.9237 [O-][n+]1ccc(cc1)COCc2ccccc2F 7a_100000031831_100000211605 [0,2,0,0,0,0|1,0,0]=3 21311 B18R2.9237 [O-][n+]1ccc(cc1)COCc2ccccc2I 34a_100000031831_100011215278 [0,2,0,0,0,0|1,0,0]=3 21312 B18R2.9237 [O-][n+]1ccc(cc1)COCc2ccccc2I 7a_100000031831_100011215278 [0,2,0,0,0,0|1,0,0]=3 21313 B18R2.9237 [O-][n+]1ccc(cc1)COCc2cccnc2Br 34a_100000031831_100010140945 [0,2,0,0,0,0|2,0,0]=4 21314 B18R2.9237 [O-][n+]1ccc(cc1)COCc2cccnc2Br 7a_100000031831_100010140945 [0,2,0,0,0,0|2,0,0]=4 21315 B18R2.9237 [O-][n+]1ccc(cc1)COCc2cccnc2Cl 34a_100000031831_100000045678 [0,2,0,0,0,0|2,0,0]=4 21316 B18R2.9237 [O-][n+]1ccc(cc1)COCc2cccnc2Cl 7a_100000031831_100000045678 [0,2,0,0,0,0|2,0,0]=4 21317 B18R2.9237 [O-][n+]1ccc(cc1)COCc2cccnc2F 34a_100000031831_100000099810 [0,2,0,0,0,0|2,0,0]=4 21318 B18R2.9237 [O-][n+]1ccc(cc1)COCc2cccnc2F 7a_100000031831_100000099810 [0,2,0,0,0,0|2,0,0]=4 21319 B18R2.9237 [O-][n+]1ccc(cc1)COCc2ccncc2Cl 7a_100000031831_100000763264 [0,2,0,0,0,0|2,0,0]=4 21320 B18R2.9237 [O-][n+]1ccc(cc1)COCc2ncccc2Br 34a_100000031831_100025702911 [0,2,0,0,0,0|2,0,0]=4 21321 B18R2.9237 [O-][n+]1ccc(cc1)COCc2ncccc2Br 7a_100000031831_100025702911 [0,2,0,0,0,0|2,0,0]=4 21322 B18R2.9237 [O-][n+]1ccc(cc1)COCc2ncccc2Cl 7a_100000031831_100000099807 [0,2,0,0,0,0|2,0,0]=4 21323 B18R2.9237 [O-][n+]1ccc(cc1)COCc2ncccc2F 34a_100000031831_100000104219 [0,2,0,0,0,0|2,0,0]=4 21324 B18R2.9237 [O-][n+]1ccc(cc1)COCc2ncccc2F 7a_100000031831_100000104219 [0,2,0,0,0,0|2,0,0]=4 21325 B18R2.9237 [O-][n+]1ccc(cc1)COCc2ncccc2O 34a_100000031831_200020655725 [0,2,0,0,0,0|2,0,0]=4 21326 B18R2.9237 [O-][n+]1ccc(cc1)COCc2ncccc2O 7a_100000031831_200020655725 [0,2,0,0,0,0|2,0,0]=4 21327 B18R2.3606 BrCC(OCc1ccccc1)c2ccccc2 7a_100000185958_100000211182 [0,2,0,0,0,0|0,0,0]=2 21328 B18R2.3606 BrCC(OCc1ccccn1)c2ccccc2 7a_100000185958_100000721315 [0,2,0,0,0,0|1,0,0]=3 21329 B18R2.3606 BrCC(OCc1cccnc1)c2ccccc2 7a_100000185958_100000741622 [0,2,0,0,0,0|1,0,0]=3 21330 B18R2.3606 BrCC(OCc1cccnn1)c2ccccc2 7a_100000185958_100016990269 [0,2,0,0,0,0|2,0,0]=4 21331 B18R2.3606 BrCC(OCc1ccncc1)c2ccccc2 7a_100000185958_100015193705 [0,2,0,0,0,0|1,0,0]=3 21332 B18R2.3606 BrCC(OCc1cnccn1)c2ccccc2 7a_100000185958_100016995436 [0,2,0,0,0,0|2,0,0]=4 21333 B18R2.3606 BrCC(OCc1cncnc1)c2ccccc2 7a_100000185958_100015196519 [0,2,0,0,0,0|2,0,0]=4 21334 B18R2.3606 BrCC(OCc1ncccn1)c2ccccc2 7a_100000185958_100000703007 [0,2,0,0,0,0|2,0,0]=4 21335 B18R2.3606 C#CC(OCc1ccccc1)c2ccccc2 34a_100011219616_100015291786 [0,2,0,0,0,0|0,0,0]=2 21336 B18R2.3606 C#CC(OCc1ccccc1)c2ccccc2 7a_100011219616_100000211182 [0,2,0,0,0,0|0,0,0]=2 21337 B18R2.3606 C#CC(OCc1ccccn1)c2ccccc2 34a_100011219616_100000721315 [0,2,0,0,0,0|1,0,0]=3 21338 B18R2.3606 C#CC(OCc1ccccn1)c2ccccc2 7a_100011219616_100000721315 [0,2,0,0,0,0|1,0,0]=3 21339 B18R2.3606 C#CC(OCc1cccnc1)c2ccccc2 34a_100011219616_100000733263 [0,2,0,0,0,0|1,0,0]=3 21340 B18R2.3606 C#CC(OCc1cccnc1)c2ccccc2 7a_100011219616_100000741622 [0,2,0,0,0,0|1,0,0]=3 21341 B18R2.3606 C#CC(OCc1cccnn1)c2ccccc2 34a_100011219616_100016990269 [0,2,0,0,0,0|2,0,0]=4 21342 B18R2.3606 C#CC(OCc1cccnn1)c2ccccc2 7a_100011219616_100016990269 [0,2,0,0,0,0|2,0,0]=4 21343 B18R2.3606 C#CC(OCc1ccncc1)c2ccccc2 7a_100011219616_100015193705 [0,2,0,0,0,0|1,0,0]=3 21344 B18R2.3606 C#CC(OCc1cnccn1)c2ccccc2 34a_100011219616_100016995436 [0,2,0,0,0,0|2,0,0]=4 21345 B18R2.3606 C#CC(OCc1cnccn1)c2ccccc2 7a_100011219616_100016995436 [0,2,0,0,0,0|2,0,0]=4 21346 B18R2.3606 C#CC(OCc1cncnc1)c2ccccc2 34a_100011219616_100015196519 [0,2,0,0,0,0|2,0,0]=4 21347 B18R2.3606 C#CC(OCc1cncnc1)c2ccccc2 7a_100011219616_100015196519 [0,2,0,0,0,0|2,0,0]=4 21348 B18R2.3606 C#CC(OCc1ncccn1)c2ccccc2 34a_100011219616_100000703007 [0,2,0,0,0,0|2,0,0]=4 21349 B18R2.3606 C#CC(OCc1ncccn1)c2ccccc2 7a_100011219616_100000703007 [0,2,0,0,0,0|2,0,0]=4 21350 B18R2.3606 C=CC(NCc1ccccc1)c2ccccc2 2230a_100015324214_200000085779 [0,2,0,0,0,0|1,0,0]=3 21351 B18R2.3606 C=CC(OCc1ccccc1)c2ccccc2 34a_100011215659_100015291786 [0,2,0,0,0,0|0,0,0]=2 21352 B18R2.3606 C=CC(OCc1ccccc1)c2ccccc2 7a_100011215659_100000211182 [0,2,0,0,0,0|0,0,0]=2 21353 B18R2.3606 C=CC(OCc1ccccn1)c2ccccc2 34a_100011215659_100000721315 [0,2,0,0,0,0|1,0,0]=3 21354 B18R2.3606 C=CC(OCc1ccccn1)c2ccccc2 7a_100011215659_100000721315 [0,2,0,0,0,0|1,0,0]=3 21355 B18R2.3606 C=CC(OCc1cccnc1)c2ccccc2 34a_100011215659_100000733263 [0,2,0,0,0,0|1,0,0]=3 21356 B18R2.3606 C=CC(OCc1cccnc1)c2ccccc2 7a_100011215659_100000741622 [0,2,0,0,0,0|1,0,0]=3 21357 B18R2.3606 C=CC(OCc1cccnn1)c2ccccc2 34a_100011215659_100016990269 [0,2,0,0,0,0|2,0,0]=4 21358 B18R2.3606 C=CC(OCc1cccnn1)c2ccccc2 7a_100011215659_100016990269 [0,2,0,0,0,0|2,0,0]=4 21359 B18R2.3606 C=CC(OCc1ccncc1)c2ccccc2 7a_100011215659_100015193705 [0,2,0,0,0,0|1,0,0]=3 21360 B18R2.3606 C=CC(OCc1cnccn1)c2ccccc2 34a_100011215659_100016995436 [0,2,0,0,0,0|2,0,0]=4 21361 B18R2.3606 C=CC(OCc1cnccn1)c2ccccc2 7a_100011215659_100016995436 [0,2,0,0,0,0|2,0,0]=4 21362 B18R2.3606 C=CC(OCc1cncnc1)c2ccccc2 34a_100011215659_100015196519 [0,2,0,0,0,0|2,0,0]=4 21363 B18R2.3606 C=CC(OCc1cncnc1)c2ccccc2 7a_100011215659_100015196519 [0,2,0,0,0,0|2,0,0]=4 21364 B18R2.3606 C=CC(OCc1ncccn1)c2ccccc2 34a_100011215659_100000703007 [0,2,0,0,0,0|2,0,0]=4 21365 B18R2.3606 C=CC(OCc1ncccn1)c2ccccc2 7a_100011215659_100000703007 [0,2,0,0,0,0|2,0,0]=4 21366 B18R2.3606 C=CC(SCc1ccccc1)c2ccccc2 62a_100000211182_200000085779 [0,2,0,0,0,0|0,1,0]=3 21367 B18R2.3606 C=CC(SCc1ccccc1)c2ccccc2 62a_200000085779_100015291786 [0,2,0,0,0,0|0,1,0]=3 21368 B18R2.3606 C=CC(SCc1ccccn1)c2ccccc2 62a_100000721315_200000085779 [0,2,0,0,0,0|1,1,0]=4 21369 B18R2.3606 C=CC(SCc1ccccn1)c2ccccc2 62a_200000085779_100000721315 [0,2,0,0,0,0|1,1,0]=4 21370 B18R2.3606 C=CC(SCc1cccnc1)c2ccccc2 62a_100000741622_200000085779 [0,2,0,0,0,0|1,1,0]=4 21371 B18R2.3606 C=CC(SCc1cccnc1)c2ccccc2 62a_200000085779_100000741622 [0,2,0,0,0,0|1,1,0]=4 21372 B18R2.3606 C=CC(SCc1ccncc1)c2ccccc2 62a_100015193705_200000085779 [0,2,0,0,0,0|1,1,0]=4 21373 B18R2.3606 C=CC(SCc1ccncc1)c2ccccc2 62a_200000085779_100015193705 [0,2,0,0,0,0|1,1,0]=4 21374 B18R2.3606 CCC(NCc1ccccc1)c2ccccc2 207a_100000737752_100015611070 [0,2,0,0,0,0|1,0,0]=3 21375 B18R2.3606 CCC(NCc1ccccc1)c2ccccc2 2230a_100000737752_100015291786 [0,2,0,0,0,0|1,0,0]=3 21376 B18R2.3606 CCC(NCc1ccccc1)c2ccccc2 269862a_100015324214_100000210124 [0,2,0,0,0,0|1,0,0]=3 21377 B18R2.3606 CCC(NCc1ccccc1)c2ccccc2 270004a_100000737752_100015611070 [0,2,0,0,0,0|1,0,0]=3 21378 B18R2.3606 CCC(NCc1ccccc1)c2ccccn2 207a_100015186561_100015611070 [0,2,0,0,0,0|2,0,0]=4 21379 B18R2.3606 CCC(NCc1ccccc1)c2ccccn2 2230a_100015186561_100015291786 [0,2,0,0,0,0|2,0,0]=4 21380 B18R2.3606 CCC(NCc1ccccc1)c2ccccn2 269862a_100015324214_100000748178 [0,2,0,0,0,0|2,0,0]=4 21381 B18R2.3606 CCC(NCc1ccccc1)c2ccccn2 270004a_100015186561_100015611070 [0,2,0,0,0,0|2,0,0]=4 21382 B18R2.3606 CCC(NCc1ccccc1)c2cccnc2 207a_100000246009_100015611070 [0,2,0,0,0,0|2,0,0]=4 21383 B18R2.3606 CCC(NCc1ccccc1)c2cccnc2 2230a_100000246009_100015291786 [0,2,0,0,0,0|2,0,0]=4 21384 B18R2.3606 CCC(NCc1ccccc1)c2cccnc2 269862a_100015324214_100011218761 [0,2,0,0,0,0|2,0,0]=4 21385 B18R2.3606 CCC(NCc1ccccc1)c2cccnc2 270004a_100000246009_100015611070 [0,2,0,0,0,0|2,0,0]=4 21386 B18R2.3606 CCC(NCc1ccccc1)c2ccncc2 207a_100000246010_100015611070 [0,2,0,0,0,0|2,0,0]=4 21387 B18R2.3606 CCC(NCc1ccccc1)c2ccncc2 269862a_100015324214_100011216016 [0,2,0,0,0,0|2,0,0]=4 21388 B18R2.3606 CCC(NCc1ccccc1)c2ccncc2 270004a_100000246010_100015611070 [0,2,0,0,0,0|2,0,0]=4 21389 B18R2.3606 CCC(NCc1ccccn1)c2ccccc2 207a_100000737752_100000209966 [0,2,0,0,0,0|2,0,0]=4 21390 B18R2.3606 CCC(NCc1ccccn1)c2ccccc2 2230a_100000737752_100000721315 [0,2,0,0,0,0|2,0,0]=4 21391 B18R2.3606 CCC(NCc1ccccn1)c2ccccc2 270004a_100000737752_100000209966 [0,2,0,0,0,0|2,0,0]=4 21392 B18R2.3606 CCC(NCc1cccnc1)c2ccccc2 207a_100000737752_100000209961 [0,2,0,0,0,0|2,0,0]=4 21393 B18R2.3606 CCC(NCc1cccnc1)c2ccccc2 2230a_100000737752_100000741622 [0,2,0,0,0,0|2,0,0]=4 21394 B18R2.3606 CCC(NCc1cccnc1)c2ccccc2 269862a_100000210453_100000210124 [0,2,0,0,0,0|2,0,0]=4 21395 B18R2.3606 CCC(NCc1cccnc1)c2ccccc2 270004a_100000737752_100000209961 [0,2,0,0,0,0|2,0,0]=4 21396 B18R2.3606 CCC(NCc1ccncc1)c2ccccc2 207a_100000737752_100000186114 [0,2,0,0,0,0|2,0,0]=4 21397 B18R2.3606 CCC(NCc1ccncc1)c2ccccc2 2230a_100000737752_100015193705 [0,2,0,0,0,0|2,0,0]=4 21398 B18R2.3606 CCC(NCc1ccncc1)c2ccccc2 269862a_100000210450_100000210124 [0,2,0,0,0,0|2,0,0]=4 21399 B18R2.3606 CCC(OCc1ccccc1)c2ccccc2 34a_100000698172_100015291786 [0,2,0,0,0,0|0,0,0]=2 21400 B18R2.3606 CCC(OCc1ccccc1)c2ccccc2 7a_100000698172_100000211182 [0,2,0,0,0,0|0,0,0]=2 21401 B18R2.3606 CCC(OCc1ccccn1)c2ccccc2 34a_100000698172_100000721315 [0,2,0,0,0,0|1,0,0]=3 21402 B18R2.3606 CCC(OCc1ccccn1)c2ccccc2 7a_100000698172_100000721315 [0,2,0,0,0,0|1,0,0]=3 21403 B18R2.3606 CCC(OCc1cccnc1)c2ccccc2 34a_100000698172_100000733263 [0,2,0,0,0,0|1,0,0]=3 21404 B18R2.3606 CCC(OCc1cccnc1)c2ccccc2 7a_100000698172_100000741622 [0,2,0,0,0,0|1,0,0]=3 21405 B18R2.3606 CCC(OCc1cccnn1)c2ccccc2 34a_100000698172_100016990269 [0,2,0,0,0,0|2,0,0]=4 21406 B18R2.3606 CCC(OCc1cccnn1)c2ccccc2 7a_100000698172_100016990269 [0,2,0,0,0,0|2,0,0]=4 21407 B18R2.3606 CCC(OCc1ccncc1)c2ccccc2 7a_100000698172_100015193705 [0,2,0,0,0,0|1,0,0]=3 21408 B18R2.3606 CCC(OCc1cnccn1)c2ccccc2 34a_100000698172_100016995436 [0,2,0,0,0,0|2,0,0]=4 21409 B18R2.3606 CCC(OCc1cnccn1)c2ccccc2 7a_100000698172_100016995436 [0,2,0,0,0,0|2,0,0]=4 21410 B18R2.3606 CCC(OCc1cncnc1)c2ccccc2 34a_100000698172_100015196519 [0,2,0,0,0,0|2,0,0]=4 21411 B18R2.3606 CCC(OCc1cncnc1)c2ccccc2 7a_100000698172_100015196519 [0,2,0,0,0,0|2,0,0]=4 21412 B18R2.3606 CCC(OCc1ncccn1)c2ccccc2 34a_100000698172_100000703007 [0,2,0,0,0,0|2,0,0]=4 21413 B18R2.3606 CCC(OCc1ncccn1)c2ccccc2 7a_100000698172_100000703007 [0,2,0,0,0,0|2,0,0]=4 21414 B18R2.3606 CCN(CCc1ccccc1)c2ccccc2 2230a_100000210013_100000765856 [0,2,0,0,0,0|2,0,0]=4 21415 B18R2.3606 CCN(CCc1ccccc1)c2ccccc2 269982a_100000210013_100000765856 [0,2,0,0,0,0|2,0,0]=4 21416 B18R2.3606 CCN(CCc1ccccc1)c2ccccc2 34a_100000210013_100000765856 [0,2,0,0,0,0|2,0,0]=4 21417 B18R2.3606 CNC(CCc1ccccc1)c2ccccc2 2230a_100000741669_200000210301 [0,2,0,0,0,0|1,0,0]=3 21418 B18R2.3606 CNC(CCc1ccccc1)c2ccccc2 269862a_106832991636_100000685657 [0,2,0,0,0,0|1,0,0]=3 21419 B18R2.3606 CNC(CCc1ccccc1)c2ccccc2 34a_100000741669_200000210301 [0,2,0,0,0,0|1,0,0]=3 21420 B18R2.3606 CNC(COc1ccccc1)c2ccccc2 269862a_106832991636_100000150584 [0,2,0,0,0,0|2,0,0]=4 21421 B18R2.3606 CNC(COc1ccccc1)c2ccccc2 270004a_106832991635_100000150584 [0,2,0,0,0,0|2,0,0]=4 21422 B18R2.3606 COC(/C=C/c1ccccc1)c2ccccc2 34a_100000043163_200000210301 [0,2,0,0,0,0|1,0,1]=4 21423 B18R2.3606 COC(/C=C/c1ccccc1)c2ccccc2 7a_100000043163_200000210301 [0,2,0,0,0,0|1,0,1]=4 21424 B18R2.3606 COC(C#Cc1ccccc1)c2ccccc2 34a_200000068236_200000210301 [0,2,0,0,0,0|1,0,1]=4 21425 B18R2.3606 COC(C#Cc1ccccc1)c2ccccc2 7a_200000068236_200000210301 [0,2,0,0,0,0|1,0,1]=4 21426 B18R2.3606 COC(CCc1ccccc1)c2ccccc2 34a_200000373236_200000210301 [0,2,0,0,0,0|1,0,0]=3 21427 B18R2.3606 COC(CCc1ccccc1)c2ccccc2 7a_200000373236_200000210301 [0,2,0,0,0,0|1,0,0]=3 21428 B18R2.3606 COC(COc1ccccc1)c2ccccc2 34a_100000259978_200000210301 [0,2,0,0,0,0|2,0,0]=4 21429 B18R2.3606 COC(COc1ccccc1)c2ccccc2 7a_100000259978_200000210301 [0,2,0,0,0,0|2,0,0]=4 21430 B18R2.3606 ClC[C@@H](OCc1ccccc1)c2ccccc2 34a_100011933945_100015291786 [0,2,0,0,0,0|0,0,0]=2 21431 B18R2.3606 ClC[C@@H](OCc1ccccc1)c2ccccc2 7a_100011933945_100000211182 [0,2,0,0,0,0|0,0,0]=2 21432 B18R2.3606 ClC[C@@H](OCc1ccccn1)c2ccccc2 34a_100011933945_100000721315 [0,2,0,0,0,0|1,0,0]=3 21433 B18R2.3606 ClC[C@@H](OCc1ccccn1)c2ccccc2 7a_100011933945_100000721315 [0,2,0,0,0,0|1,0,0]=3 21434 B18R2.3606 ClC[C@@H](OCc1cccnc1)c2ccccc2 34a_100011933945_100000733263 [0,2,0,0,0,0|1,0,0]=3 21435 B18R2.3606 ClC[C@@H](OCc1cccnc1)c2ccccc2 7a_100011933945_100000741622 [0,2,0,0,0,0|1,0,0]=3 21436 B18R2.3606 ClC[C@@H](OCc1cccnn1)c2ccccc2 34a_100011933945_100016990269 [0,2,0,0,0,0|2,0,0]=4 21437 B18R2.3606 ClC[C@@H](OCc1cccnn1)c2ccccc2 7a_100011933945_100016990269 [0,2,0,0,0,0|2,0,0]=4 21438 B18R2.3606 ClC[C@@H](OCc1ccncc1)c2ccccc2 7a_100011933945_100015193705 [0,2,0,0,0,0|1,0,0]=3 21439 B18R2.3606 ClC[C@@H](OCc1cnccn1)c2ccccc2 34a_100011933945_100016995436 [0,2,0,0,0,0|2,0,0]=4 21440 B18R2.3606 ClC[C@@H](OCc1cnccn1)c2ccccc2 7a_100011933945_100016995436 [0,2,0,0,0,0|2,0,0]=4 21441 B18R2.3606 ClC[C@@H](OCc1cncnc1)c2ccccc2 34a_100011933945_100015196519 [0,2,0,0,0,0|2,0,0]=4 21442 B18R2.3606 ClC[C@@H](OCc1cncnc1)c2ccccc2 7a_100011933945_100015196519 [0,2,0,0,0,0|2,0,0]=4 21443 B18R2.3606 ClC[C@@H](OCc1ncccn1)c2ccccc2 34a_100011933945_100000703007 [0,2,0,0,0,0|2,0,0]=4 21444 B18R2.3606 ClC[C@@H](OCc1ncccn1)c2ccccc2 7a_100011933945_100000703007 [0,2,0,0,0,0|2,0,0]=4 21445 B18R2.3606 N#CC(OCc1ccccc1)c2ccccc2 7a_100011217353_100000211182 [0,2,0,0,0,0|0,0,0]=2 21446 B18R2.3606 N#CC(OCc1ccccn1)c2ccccc2 7a_100011217353_100000721315 [0,2,0,0,0,0|1,0,0]=3 21447 B18R2.3606 N#CC(OCc1cccnc1)c2ccccc2 7a_100011217353_100000741622 [0,2,0,0,0,0|1,0,0]=3 21448 B18R2.3606 N#CC(OCc1cccnn1)c2ccccc2 7a_100011217353_100016990269 [0,2,0,0,0,0|2,0,0]=4 21449 B18R2.3606 N#CC(OCc1ccncc1)c2ccccc2 7a_100011217353_100015193705 [0,2,0,0,0,0|1,0,0]=3 21450 B18R2.3606 N#CC(OCc1cnccn1)c2ccccc2 7a_100011217353_100016995436 [0,2,0,0,0,0|2,0,0]=4 21451 B18R2.3606 N#CC(OCc1cncnc1)c2ccccc2 7a_100011217353_100015196519 [0,2,0,0,0,0|2,0,0]=4 21452 B18R2.3606 N#CC(OCc1ncccn1)c2ccccc2 7a_100011217353_100000703007 [0,2,0,0,0,0|2,0,0]=4 21453 B18R2.3606 NCC(OCc1ccccc1)c2ccccc2 34a_100000210709_100015291786 [0,2,0,0,0,0|0,0,0]=2 21454 B18R2.3606 NCC(OCc1ccccn1)c2ccccc2 34a_100000210709_100000721315 [0,2,0,0,0,0|1,0,0]=3 21455 B18R2.3606 NCC(OCc1cccnc1)c2ccccc2 34a_100000210709_100000733263 [0,2,0,0,0,0|1,0,0]=3 21456 B18R2.3606 NCC(OCc1cccnn1)c2ccccc2 34a_100000210709_100016990269 [0,2,0,0,0,0|2,0,0]=4 21457 B18R2.3606 NCC(OCc1cnccn1)c2ccccc2 34a_100000210709_100016995436 [0,2,0,0,0,0|2,0,0]=4 21458 B18R2.3606 NCC(OCc1cncnc1)c2ccccc2 34a_100000210709_100015196519 [0,2,0,0,0,0|2,0,0]=4 21459 B18R2.3606 NCC(OCc1ncccn1)c2ccccc2 34a_100000210709_100000703007 [0,2,0,0,0,0|2,0,0]=4 21460 B18R2.3606 OCC(NCc1ccccc1)c2ccccn2 207a_100015196888_100015611070 [0,2,0,0,0,0|2,0,0]=4 21461 B18R2.3606 OCC(NCc1ccccc1)c2ccccn2 2230a_100015196888_100015291786 [0,2,0,0,0,0|2,0,0]=4 21462 B18R2.3606 OCC(NCc1ccccc1)c2ccccn2 270004a_100015196888_100015611070 [0,2,0,0,0,0|2,0,0]=4 21463 B18R2.3606 OC[C@@H](NCc1ccccc1)c2ccccc2 207a_100000751927_100015611070 [0,2,0,0,0,0|1,0,0]=3 21464 B18R2.3606 OC[C@@H](NCc1ccccc1)c2ccccc2 2230a_100000751927_100015291786 [0,2,0,0,0,0|1,0,0]=3 21465 B18R2.3606 OC[C@@H](NCc1ccccc1)c2ccccc2 270004a_100000751927_100015611070 [0,2,0,0,0,0|1,0,0]=3 21466 B18R2.3606 OC[C@@H](NCc1ccccc1)c2ccccc2 34a_100000751927_100015291786 [0,2,0,0,0,0|1,0,0]=3 21467 B18R2.3606 OC[C@@H](NCc1ccccc1)c2ccncc2 207a_100138412524_100015611070 [0,2,0,0,0,0|2,0,0]=4 21468 B18R2.3606 OC[C@@H](NCc1ccccc1)c2ccncc2 2230a_100138412524_100015291786 [0,2,0,0,0,0|2,0,0]=4 21469 B18R2.3606 OC[C@@H](NCc1ccccc1)c2ccncc2 270004a_100138412524_100015611070 [0,2,0,0,0,0|2,0,0]=4 21470 B18R2.3606 OC[C@@H](NCc1ccccn1)c2ccccc2 207a_100000751927_100000209966 [0,2,0,0,0,0|2,0,0]=4 21471 B18R2.3606 OC[C@@H](NCc1ccccn1)c2ccccc2 2230a_100000751927_100000721315 [0,2,0,0,0,0|2,0,0]=4 21472 B18R2.3606 OC[C@@H](NCc1ccccn1)c2ccccc2 270004a_100000751927_100000209966 [0,2,0,0,0,0|2,0,0]=4 21473 B18R2.3606 OC[C@@H](NCc1ccccn1)c2ccccc2 34a_100000751927_100000721315 [0,2,0,0,0,0|2,0,0]=4 21474 B18R2.3606 OC[C@@H](NCc1cccnc1)c2ccccc2 207a_100000751927_100000209961 [0,2,0,0,0,0|2,0,0]=4 21475 B18R2.3606 OC[C@@H](NCc1cccnc1)c2ccccc2 2230a_100000751927_100000741622 [0,2,0,0,0,0|2,0,0]=4 21476 B18R2.3606 OC[C@@H](NCc1cccnc1)c2ccccc2 270004a_100000751927_100000209961 [0,2,0,0,0,0|2,0,0]=4 21477 B18R2.3606 OC[C@@H](NCc1cccnc1)c2ccccc2 34a_100000751927_100000733263 [0,2,0,0,0,0|2,0,0]=4 21478 B18R2.3606 OC[C@@H](NCc1ccncc1)c2ccccc2 207a_100000751927_100000186114 [0,2,0,0,0,0|2,0,0]=4 21479 B18R2.3606 OC[C@@H](NCc1ccncc1)c2ccccc2 2230a_100000751927_100015193705 [0,2,0,0,0,0|2,0,0]=4 21480 B18R2.3606 [13CH3]NC(CCc1ccccc1)c2ccccc2 2230a_100000741669_200025704644 [0,2,0,0,0,0|1,0,0]=3 21481 B18R2.3606 [13CH3]NC(CCc1ccccc1)c2ccccc2 34a_100000741669_200025704644 [0,2,0,0,0,0|1,0,0]=3 21482 B18R2.3606 [13CH3]OC(/C=C/c1ccccc1)c2ccccc2 34a_100000043163_200025704644 [0,2,0,0,0,0|1,0,1]=4 21483 B18R2.3606 [13CH3]OC(/C=C/c1ccccc1)c2ccccc2 7a_100000043163_200025704644 [0,2,0,0,0,0|1,0,1]=4 21484 B18R2.3606 [13CH3]OC(C#Cc1ccccc1)c2ccccc2 34a_200000068236_200025704644 [0,2,0,0,0,0|1,0,1]=4 21485 B18R2.3606 [13CH3]OC(C#Cc1ccccc1)c2ccccc2 7a_200000068236_200025704644 [0,2,0,0,0,0|1,0,1]=4 21486 B18R2.3606 [13CH3]OC(CCc1ccccc1)c2ccccc2 34a_200000373236_200025704644 [0,2,0,0,0,0|1,0,0]=3 21487 B18R2.3606 [13CH3]OC(CCc1ccccc1)c2ccccc2 7a_200000373236_200025704644 [0,2,0,0,0,0|1,0,0]=3 21488 B18R2.3606 [13CH3]OC(COc1ccccc1)c2ccccc2 34a_100000259978_200025704644 [0,2,0,0,0,0|2,0,0]=4 21489 B18R2.3606 [13CH3]OC(COc1ccccc1)c2ccccc2 7a_100000259978_200025704644 [0,2,0,0,0,0|2,0,0]=4 21490 B18R2.3634 CC(CC(=O)c1ccccc1)c2ccccc2 1458a_100000185807_100000756946 [0,2,0,0,0,0|1,0,1]=4 21491 B18R2.3634 CC(CN(C)c1ccccc1)c2ccccc2 2230a_100000210012_100000756946 [0,2,0,0,0,0|2,0,0]=4 21492 B18R2.3634 CC(CN(C)c1ccccc1)c2ccccc2 269982a_100000210012_100000756946 [0,2,0,0,0,0|2,0,0]=4 21493 B18R2.3634 CC(CN(C)c1ccccc1)c2ccccc2 34a_100000210012_100000756946 [0,2,0,0,0,0|2,0,0]=4 21494 B18R2.3634 CC(NC(C)c1ccccn1)c2ccccc2 2230a_100000181244_100000230085 [0,2,0,0,0,0|2,0,0]=4 21495 B18R2.3634 CC(NC(C)c1ccccn1)c2ccccc2 269862a_100000181244_100000185851 [0,2,0,0,0,0|2,0,0]=4 21496 B18R2.3634 CC(NC(C)c1cccnc1)c2ccccc2 2230a_100000195435_100000230085 [0,2,0,0,0,0|2,0,0]=4 21497 B18R2.3634 CC(NC(C)c1cccnc1)c2ccccc2 269862a_100000195435_100000185851 [0,2,0,0,0,0|2,0,0]=4 21498 B18R2.3634 CC(NC(C)c1ccncc1)c2ccccc2 2230a_100000181269_100000230085 [0,2,0,0,0,0|2,0,0]=4 21499 B18R2.3634 CC(NC(C)c1ccncc1)c2ccccc2 269862a_100000181269_100000185851 [0,2,0,0,0,0|2,0,0]=4 21500 B18R2.3634 CC(N[C@H](C)c1ccccc1)c2ccccc2 2230a_100000751104_100000230085 [0,2,0,0,0,0|1,0,0]=3 21501 B18R2.3634 CC(N[C@H](C)c1ccccc1)c2ccccc2 269862a_100000751104_100000185851 [0,2,0,0,0,0|1,0,0]=3 21502 B18R2.3634 CC(N[C@H](C)c1ccccc1)c2ccccn2 269862a_100000751104_100000210467 [0,2,0,0,0,0|2,0,0]=4 21503 B18R2.3634 CC(N[C@H](C)c1ccccc1)c2cccnc2 269862a_100000751104_100000210468 [0,2,0,0,0,0|2,0,0]=4 21504 B18R2.3634 CC(N[C@H](C)c1ccccc1)c2ccncc2 269862a_100000751104_100000185792 [0,2,0,0,0,0|2,0,0]=4 21505 B18R2.3634 CC(O[C@H](C)c1ccccc1)c2ccccc2 34a_100000761318_100000211855 [0,2,0,0,0,0|0,0,0]=2 21506 B18R2.3634 CC(O[C@H](C)c1ccccc1)c2ccccc2 7a_100000761318_100000230085 [0,2,0,0,0,0|0,0,0]=2 21507 B18R2.3634 CC(O[C@H](C)c1ccccc1)c2cnccn2 7a_100000761318_200000703233 [0,2,0,0,0,0|2,0,0]=4 21508 B18R2.3634 CC(SC(C)c1ccccc1)c2ccccc2 62a_100000230085_100000230085 [0,2,0,0,0,0|0,1,0]=3 21509 B18R2.3634 CN(CC(O)c1ccccc1)c2ccccc2 2230a_100000210012_100000185958 [0,2,0,0,0,0|2,0,0]=4 21510 B18R2.3634 CN(CC(O)c1ccccc1)c2ccccc2 34a_100000210012_100000185958 [0,2,0,0,0,0|2,0,0]=4 21511 B18R2.3634 CN(C[C@@H](O)c1ccccc1)c2ccccc2 2230a_100000210012_100011933945 [0,2,0,0,0,0|2,0,0]=4 21512 B18R2.3634 CN(C[C@@H](O)c1ccccc1)c2ccccc2 34a_100000210012_100011933945 [0,2,0,0,0,0|2,0,0]=4 21513 B18R2.3634 C[C@@H](NC(=O)c1ccccc1)c2ccccc2 11a_100000751104_100000185807 [0,2,0,0,0,0|1,0,1]=4 21514 B18R2.3634 C[C@@H](NC(=O)c1ccccc1)c2ccccc2 1626a_100000751104_100000185807 [0,2,0,0,0,0|1,0,1]=4 21515 B18R2.3634 C[C@@H](NC(=O)c1ccccc1)c2ccccc2 240690a_100000751104_100000185807 [0,2,0,0,0,0|1,0,1]=4 21516 B18R2.3634 C[C@@H](NC(=O)c1ccccc1)c2ccccc2 527a_100000751104_100000185807 [0,2,0,0,0,0|1,0,1]=4 21517 B18R2.3634 O=C(CC(O)c1ccccc1)c2ccccc2 1458a_100000185807_100000185958 [0,2,0,0,0,0|1,0,1]=4 21518 B18R2.3634 O=C(C[C@@H](O)c1ccccc1)c2ccccc2 1458a_100000185807_100011933945 [0,2,0,0,0,0|1,0,1]=4 21519 B18R2.3990 CC(CNc1ccccc1Br)c2ccccc2 34a_100000210017_100000756946 [0,2,0,0,0,0|2,0,0]=4 21520 B18R2.3990 CC(CNc1ccccc1Cl)c2ccccc2 34a_100000185783_100000756946 [0,2,0,0,0,0|2,0,0]=4 21521 B18R2.3990 CC(CNc1ccccc1F)c2ccccc2 34a_100000210422_100000756946 [0,2,0,0,0,0|2,0,0]=4 21522 B18R2.3990 CC(CNc1ccccc1I)c2ccccc2 34a_100000210053_100000756946 [0,2,0,0,0,0|2,0,0]=4 21523 B18R2.3990 CC(CNc1ccccc1O)c2ccccc2 34a_100000185747_100000756946 [0,2,0,0,0,0|2,0,0]=4 21524 B18R2.3990 CC(COc1ccccc1Br)c2ccccc2 34a_100000181306_100000756946 [0,2,0,0,0,0|2,0,0]=4 21525 B18R2.3990 CC(COc1ccccc1Br)c2ccccc2 7a_100000181306_100000756946 [0,2,0,0,0,0|2,0,0]=4 21526 B18R2.3990 CC(COc1ccccc1Cl)c2ccccc2 34a_100000210172_100000756946 [0,2,0,0,0,0|2,0,0]=4 21527 B18R2.3990 CC(COc1ccccc1Cl)c2ccccc2 7a_100000210172_100000756946 [0,2,0,0,0,0|2,0,0]=4 21528 B18R2.3990 CC(COc1ccccc1F)c2ccccc2 34a_100000210171_100000756946 [0,2,0,0,0,0|2,0,0]=4 21529 B18R2.3990 CC(COc1ccccc1F)c2ccccc2 7a_100000210171_100000756946 [0,2,0,0,0,0|2,0,0]=4 21530 B18R2.3990 CC(COc1ccccc1I)c2ccccc2 34a_100000739446_100000756946 [0,2,0,0,0,0|2,0,0]=4 21531 B18R2.3990 CC(COc1ccccc1I)c2ccccc2 7a_100000739446_100000756946 [0,2,0,0,0,0|2,0,0]=4 21532 B18R2.3990 CC(COc1ccccc1N)c2ccccc2 34a_100000185747_100000756946 [0,2,0,0,0,0|2,0,0]=4 21533 B18R2.3990 CC(COc1ccccc1N)c2ccccc2 7a_100000185747_100000756946 [0,2,0,0,0,0|2,0,0]=4 21534 B18R2.3990 CC(CSc1ccccc1Br)c2ccccc2 62a_100000695589_100000756946 [0,2,0,0,0,0|2,0,0]=4 21535 B18R2.3990 CC(CSc1ccccc1Br)c2ccccc2 62a_100000756946_100000695589 [0,2,0,0,0,0|2,0,0]=4 21536 B18R2.3990 CC(CSc1ccccc1Cl)c2ccccc2 62a_100000756946_100000764095 [0,2,0,0,0,0|2,0,0]=4 21537 B18R2.3990 CC(CSc1ccccc1Cl)c2ccccc2 62a_100000764095_100000756946 [0,2,0,0,0,0|2,0,0]=4 21538 B18R2.3990 CC(CSc1ccccc1F)c2ccccc2 62a_100000756946_100011215700 [0,2,0,0,0,0|2,0,0]=4 21539 B18R2.3990 CC(CSc1ccccc1F)c2ccccc2 62a_100011215700_100000756946 [0,2,0,0,0,0|2,0,0]=4 21540 B18R2.3990 CC(CSc1ccccc1N)c2ccccc2 62a_100000210017_100000756946 [0,2,0,0,0,0|2,0,0]=4 21541 B18R2.3990 CC(CSc1ccccc1N)c2ccccc2 62a_100000756946_100000210017 [0,2,0,0,0,0|2,0,0]=4 21542 B18R2.3990 CC(CSc1ccccc1O)c2ccccc2 62a_100000739446_100000756946 [0,2,0,0,0,0|2,0,0]=4 21543 B18R2.3990 CC(CSc1ccccc1O)c2ccccc2 62a_100000756946_100000739446 [0,2,0,0,0,0|2,0,0]=4 21544 B18R2.3990 CC(NCc1ccccc1Br)c2ccccc2 2230a_100000689332_100000230085 [0,2,0,0,0,0|1,0,0]=3 21545 B18R2.3990 CC(NCc1ccccc1Br)c2ccccc2 269862a_100000689332_100000185851 [0,2,0,0,0,0|1,0,0]=3 21546 B18R2.3990 CC(NCc1ccccc1Br)c2ccccc2 34a_100000689332_100000211855 [0,2,0,0,0,0|1,0,0]=3 21547 B18R2.3990 CC(NCc1ccccc1Br)c2ccccn2 207a_100000181244_100000211189 [0,2,0,0,0,0|2,0,0]=4 21548 B18R2.3990 CC(NCc1ccccc1Br)c2ccccn2 2230a_100000181244_100000184730 [0,2,0,0,0,0|2,0,0]=4 21549 B18R2.3990 CC(NCc1ccccc1Br)c2ccccn2 269862a_100000689332_100000210467 [0,2,0,0,0,0|2,0,0]=4 21550 B18R2.3990 CC(NCc1ccccc1Br)c2ccccn2 270004a_100000181244_100000211189 [0,2,0,0,0,0|2,0,0]=4 21551 B18R2.3990 CC(NCc1ccccc1Br)c2cccnc2 207a_100000195435_100000211189 [0,2,0,0,0,0|2,0,0]=4 21552 B18R2.3990 CC(NCc1ccccc1Br)c2cccnc2 2230a_100000195435_100000184730 [0,2,0,0,0,0|2,0,0]=4 21553 B18R2.3990 CC(NCc1ccccc1Br)c2cccnc2 269862a_100000689332_100000210468 [0,2,0,0,0,0|2,0,0]=4 21554 B18R2.3990 CC(NCc1ccccc1Br)c2cccnc2 270004a_100000195435_100000211189 [0,2,0,0,0,0|2,0,0]=4 21555 B18R2.3990 CC(NCc1ccccc1Br)c2ccncc2 207a_100000181269_100000211189 [0,2,0,0,0,0|2,0,0]=4 21556 B18R2.3990 CC(NCc1ccccc1Br)c2ccncc2 2230a_100000181269_100000184730 [0,2,0,0,0,0|2,0,0]=4 21557 B18R2.3990 CC(NCc1ccccc1Br)c2ccncc2 269862a_100000689332_100000185792 [0,2,0,0,0,0|2,0,0]=4 21558 B18R2.3990 CC(NCc1ccccc1Br)c2ccncc2 270004a_100000181269_100000211189 [0,2,0,0,0,0|2,0,0]=4 21559 B18R2.3990 CC(NCc1ccccc1Cl)c2ccccc2 2230a_100000174879_100000230085 [0,2,0,0,0,0|1,0,0]=3 21560 B18R2.3990 CC(NCc1ccccc1Cl)c2ccccc2 269862a_100000174879_100000185851 [0,2,0,0,0,0|1,0,0]=3 21561 B18R2.3990 CC(NCc1ccccc1Cl)c2ccccc2 34a_100000174879_100000211855 [0,2,0,0,0,0|1,0,0]=3 21562 B18R2.3990 CC(NCc1ccccc1Cl)c2ccccn2 207a_100000181244_100000210073 [0,2,0,0,0,0|2,0,0]=4 21563 B18R2.3990 CC(NCc1ccccc1Cl)c2ccccn2 2230a_100000181244_100000187162 [0,2,0,0,0,0|2,0,0]=4 21564 B18R2.3990 CC(NCc1ccccc1Cl)c2ccccn2 269862a_100000174879_100000210467 [0,2,0,0,0,0|2,0,0]=4 21565 B18R2.3990 CC(NCc1ccccc1Cl)c2ccccn2 270004a_100000181244_100000210073 [0,2,0,0,0,0|2,0,0]=4 21566 B18R2.3990 CC(NCc1ccccc1Cl)c2cccnc2 207a_100000195435_100000210073 [0,2,0,0,0,0|2,0,0]=4 21567 B18R2.3990 CC(NCc1ccccc1Cl)c2cccnc2 2230a_100000195435_100000187162 [0,2,0,0,0,0|2,0,0]=4 21568 B18R2.3990 CC(NCc1ccccc1Cl)c2cccnc2 269862a_100000174879_100000210468 [0,2,0,0,0,0|2,0,0]=4 21569 B18R2.3990 CC(NCc1ccccc1Cl)c2cccnc2 270004a_100000195435_100000210073 [0,2,0,0,0,0|2,0,0]=4 21570 B18R2.3990 CC(NCc1ccccc1Cl)c2ccncc2 207a_100000181269_100000210073 [0,2,0,0,0,0|2,0,0]=4 21571 B18R2.3990 CC(NCc1ccccc1Cl)c2ccncc2 2230a_100000181269_100000187162 [0,2,0,0,0,0|2,0,0]=4 21572 B18R2.3990 CC(NCc1ccccc1Cl)c2ccncc2 269862a_100000174879_100000185792 [0,2,0,0,0,0|2,0,0]=4 21573 B18R2.3990 CC(NCc1ccccc1Cl)c2ccncc2 270004a_100000181269_100000210073 [0,2,0,0,0,0|2,0,0]=4 21574 B18R2.3990 CC(NCc1ccccc1F)c2ccccc2 269862a_100000174869_100000185851 [0,2,0,0,0,0|1,0,0]=3 21575 B18R2.3990 CC(NCc1ccccc1F)c2ccccc2 34a_100000174869_100000211855 [0,2,0,0,0,0|1,0,0]=3 21576 B18R2.3990 CC(NCc1ccccc1F)c2ccccn2 207a_100000181244_100000210811 [0,2,0,0,0,0|2,0,0]=4 21577 B18R2.3990 CC(NCc1ccccc1F)c2ccccn2 2230a_100000181244_100000211605 [0,2,0,0,0,0|2,0,0]=4 21578 B18R2.3990 CC(NCc1ccccc1F)c2ccccn2 269862a_100000174869_100000210467 [0,2,0,0,0,0|2,0,0]=4 21579 B18R2.3990 CC(NCc1ccccc1F)c2ccccn2 270004a_100000181244_100000210811 [0,2,0,0,0,0|2,0,0]=4 21580 B18R2.3990 CC(NCc1ccccc1F)c2cccnc2 207a_100000195435_100000210811 [0,2,0,0,0,0|2,0,0]=4 21581 B18R2.3990 CC(NCc1ccccc1F)c2cccnc2 2230a_100000195435_100000211605 [0,2,0,0,0,0|2,0,0]=4 21582 B18R2.3990 CC(NCc1ccccc1F)c2cccnc2 269862a_100000174869_100000210468 [0,2,0,0,0,0|2,0,0]=4 21583 B18R2.3990 CC(NCc1ccccc1F)c2cccnc2 270004a_100000195435_100000210811 [0,2,0,0,0,0|2,0,0]=4 21584 B18R2.3990 CC(NCc1ccccc1F)c2ccncc2 207a_100000181269_100000210811 [0,2,0,0,0,0|2,0,0]=4 21585 B18R2.3990 CC(NCc1ccccc1F)c2ccncc2 2230a_100000181269_100000211605 [0,2,0,0,0,0|2,0,0]=4 21586 B18R2.3990 CC(NCc1ccccc1F)c2ccncc2 269862a_100000174869_100000185792 [0,2,0,0,0,0|2,0,0]=4 21587 B18R2.3990 CC(NCc1ccccc1F)c2ccncc2 270004a_100000181269_100000210811 [0,2,0,0,0,0|2,0,0]=4 21588 B18R2.3990 CC(NCc1ccccc1I)c2ccccc2 269862a_100015347259_100000185851 [0,2,0,0,0,0|1,0,0]=3 21589 B18R2.3990 CC(NCc1ccccc1I)c2ccccn2 207a_100000181244_100000010305 [0,2,0,0,0,0|2,0,0]=4 21590 B18R2.3990 CC(NCc1ccccc1I)c2ccccn2 2230a_100000181244_100011215278 [0,2,0,0,0,0|2,0,0]=4 21591 B18R2.3990 CC(NCc1ccccc1I)c2ccccn2 269862a_100015347259_100000210467 [0,2,0,0,0,0|2,0,0]=4 21592 B18R2.3990 CC(NCc1ccccc1I)c2ccccn2 270004a_100000181244_100000010305 [0,2,0,0,0,0|2,0,0]=4 21593 B18R2.3990 CC(NCc1ccccc1I)c2cccnc2 207a_100000195435_100000010305 [0,2,0,0,0,0|2,0,0]=4 21594 B18R2.3990 CC(NCc1ccccc1I)c2cccnc2 2230a_100000195435_100011215278 [0,2,0,0,0,0|2,0,0]=4 21595 B18R2.3990 CC(NCc1ccccc1I)c2cccnc2 269862a_100015347259_100000210468 [0,2,0,0,0,0|2,0,0]=4 21596 B18R2.3990 CC(NCc1ccccc1I)c2cccnc2 270004a_100000195435_100000010305 [0,2,0,0,0,0|2,0,0]=4 21597 B18R2.3990 CC(NCc1ccccc1I)c2ccncc2 207a_100000181269_100000010305 [0,2,0,0,0,0|2,0,0]=4 21598 B18R2.3990 CC(NCc1ccccc1I)c2ccncc2 2230a_100000181269_100011215278 [0,2,0,0,0,0|2,0,0]=4 21599 B18R2.3990 CC(NCc1ccccc1I)c2ccncc2 269862a_100015347259_100000185792 [0,2,0,0,0,0|2,0,0]=4 21600 B18R2.3990 CC(NCc1ccccc1I)c2ccncc2 270004a_100000181269_100000010305 [0,2,0,0,0,0|2,0,0]=4 21601 B18R2.3990 CC(NCc1ccccc1O)c2ccccc2 269862a_100000185550_100000185851 [0,2,0,0,0,0|1,0,0]=3 21602 B18R2.3990 CC(NCc1ccccc1O)c2ccccc2 34a_100000185550_100000211855 [0,2,0,0,0,0|1,0,0]=3 21603 B18R2.3990 CC(NCc1ccccc1O)c2ccccn2 269862a_100000185550_100000210467 [0,2,0,0,0,0|2,0,0]=4 21604 B18R2.3990 CC(NCc1ccccc1O)c2cccnc2 269862a_100000185550_100000210468 [0,2,0,0,0,0|2,0,0]=4 21605 B18R2.3990 CC(NCc1ccccc1O)c2ccncc2 269862a_100000185550_100000185792 [0,2,0,0,0,0|2,0,0]=4 21606 B18R2.3990 CC(NCc1cccnc1Br)c2ccccc2 2230a_100009818023_100000230085 [0,2,0,0,0,0|2,0,0]=4 21607 B18R2.3990 CC(NCc1cccnc1Br)c2ccccc2 269862a_100009818023_100000185851 [0,2,0,0,0,0|2,0,0]=4 21608 B18R2.3990 CC(NCc1cccnc1Br)c2ccccc2 34a_100009818023_100000211855 [0,2,0,0,0,0|2,0,0]=4 21609 B18R2.3990 CC(NCc1cccnc1Cl)c2ccccc2 2230a_100015189234_100000230085 [0,2,0,0,0,0|2,0,0]=4 21610 B18R2.3990 CC(NCc1cccnc1Cl)c2ccccc2 269862a_100015189234_100000185851 [0,2,0,0,0,0|2,0,0]=4 21611 B18R2.3990 CC(NCc1cccnc1Cl)c2ccccc2 34a_100015189234_100000211855 [0,2,0,0,0,0|2,0,0]=4 21612 B18R2.3990 CC(NCc1cccnc1F)c2ccccc2 269862a_100000724633_100000185851 [0,2,0,0,0,0|2,0,0]=4 21613 B18R2.3990 CC(NCc1cccnc1F)c2ccccc2 34a_100000724633_100000211855 [0,2,0,0,0,0|2,0,0]=4 21614 B18R2.3990 CC(NCc1ccncc1Br)c2ccccc2 269862a_100020640021_100000185851 [0,2,0,0,0,0|2,0,0]=4 21615 B18R2.3990 CC(NCc1ccncc1F)c2ccccc2 269862a_100011935246_100000185851 [0,2,0,0,0,0|2,0,0]=4 21616 B18R2.3990 CC(NCc1ccncc1F)c2ccccc2 34a_100011935246_100000211855 [0,2,0,0,0,0|2,0,0]=4 21617 B18R2.3990 CC(NCc1ncccc1Cl)c2ccccc2 2230a_100015189233_100000230085 [0,2,0,0,0,0|2,0,0]=4 21618 B18R2.3990 CC(NCc1ncccc1F)c2ccccc2 34a_100000690088_100000211855 [0,2,0,0,0,0|2,0,0]=4 21619 B18R2.3990 CC(OCc1ccccc1Br)c2ccccc2 34a_100000756307_100000211855 [0,2,0,0,0,0|0,0,0]=2 21620 B18R2.3990 CC(OCc1ccccc1Br)c2ccccc2 7a_100000756307_100000230085 [0,2,0,0,0,0|0,0,0]=2 21621 B18R2.3990 CC(OCc1ccccc1Br)c2cnccn2 7a_100000756307_200000703233 [0,2,0,0,0,0|2,0,0]=4 21622 B18R2.3990 CC(OCc1ccccc1Cl)c2ccccc2 34a_100000210847_100000211855 [0,2,0,0,0,0|0,0,0]=2 21623 B18R2.3990 CC(OCc1ccccc1Cl)c2ccccc2 7a_100000210847_100000230085 [0,2,0,0,0,0|0,0,0]=2 21624 B18R2.3990 CC(OCc1ccccc1Cl)c2cnccn2 7a_100000210847_200000703233 [0,2,0,0,0,0|2,0,0]=4 21625 B18R2.3990 CC(OCc1ccccc1F)c2ccccc2 34a_100000211962_100000211855 [0,2,0,0,0,0|0,0,0]=2 21626 B18R2.3990 CC(OCc1ccccc1F)c2ccccc2 7a_100000211962_100000230085 [0,2,0,0,0,0|0,0,0]=2 21627 B18R2.3990 CC(OCc1ccccc1F)c2cnccn2 7a_100000211962_200000703233 [0,2,0,0,0,0|2,0,0]=4 21628 B18R2.3990 CC(OCc1ccccc1I)c2ccccc2 34a_100000187465_100000211855 [0,2,0,0,0,0|0,0,0]=2 21629 B18R2.3990 CC(OCc1ccccc1I)c2ccccc2 7a_100000187465_100000230085 [0,2,0,0,0,0|0,0,0]=2 21630 B18R2.3990 CC(OCc1ccccc1I)c2cnccn2 7a_100000187465_200000703233 [0,2,0,0,0,0|2,0,0]=4 21631 B18R2.3990 CC(OCc1ccccc1N)c2ccccc2 34a_100000212039_100000211855 [0,2,0,0,0,0|0,0,0]=2 21632 B18R2.3990 CC(OCc1cccnc1Br)c2ccccc2 34a_100000719692_100000211855 [0,2,0,0,0,0|1,0,0]=3 21633 B18R2.3990 CC(OCc1cccnc1Br)c2ccccc2 7a_100000719692_100000230085 [0,2,0,0,0,0|1,0,0]=3 21634 B18R2.3990 CC(OCc1cccnc1Cl)c2ccccc2 34a_100000748726_100000211855 [0,2,0,0,0,0|1,0,0]=3 21635 B18R2.3990 CC(OCc1cccnc1Cl)c2ccccc2 7a_100000748726_100000230085 [0,2,0,0,0,0|1,0,0]=3 21636 B18R2.3990 CC(OCc1cccnc1F)c2ccccc2 34a_100000079888_100000211855 [0,2,0,0,0,0|1,0,0]=3 21637 B18R2.3990 CC(OCc1cccnc1F)c2ccccc2 7a_100000079888_100000230085 [0,2,0,0,0,0|1,0,0]=3 21638 B18R2.3990 CC(OCc1ccncc1F)c2ccccc2 34a_100012172863_100000211855 [0,2,0,0,0,0|1,0,0]=3 21639 B18R2.3990 CC(OCc1cnccc1Cl)c2ccccc2 34a_100000117392_100000211855 [0,2,0,0,0,0|1,0,0]=3 21640 B18R2.3990 CC(OCc1ncccc1Br)c2ccccc2 34a_100011996772_100000211855 [0,2,0,0,0,0|1,0,0]=3 21641 B18R2.3990 CC(OCc1ncccc1Cl)c2ccccc2 34a_100012002383_100000211855 [0,2,0,0,0,0|1,0,0]=3 21642 B18R2.3990 CC(OCc1ncccc1F)c2ccccc2 34a_100011934865_100000211855 [0,2,0,0,0,0|1,0,0]=3 21643 B18R2.3990 CC(OCc1ncccc1N)c2ccccc2 34a_114873767017_100000211855 [0,2,0,0,0,0|1,0,0]=3 21644 B18R2.3990 CC(OCc1nccnc1Cl)c2ccccc2 34a_100000057004_100000211855 [0,2,0,0,0,0|2,0,0]=4 21645 B18R2.3990 CC(SCc1ccccc1Br)c2ccccc2 62a_100000184730_100000230085 [0,2,0,0,0,0|0,1,0]=3 21646 B18R2.3990 CC(SCc1ccccc1Br)c2ccccc2 62a_100000230085_100000184730 [0,2,0,0,0,0|0,1,0]=3 21647 B18R2.3990 CC(SCc1ccccc1Cl)c2ccccc2 62a_100000187162_100000230085 [0,2,0,0,0,0|0,1,0]=3 21648 B18R2.3990 CC(SCc1ccccc1Cl)c2ccccc2 62a_100000230085_100000187162 [0,2,0,0,0,0|0,1,0]=3 21649 B18R2.3990 CC(SCc1ccccc1F)c2ccccc2 62a_100000211605_100000230085 [0,2,0,0,0,0|0,1,0]=3 21650 B18R2.3990 CC(SCc1ccccc1F)c2ccccc2 62a_100000230085_100000211605 [0,2,0,0,0,0|0,1,0]=3 21651 B18R2.3990 CC(SCc1ccccc1I)c2ccccc2 62a_100000230085_100011216222 [0,2,0,0,0,0|0,1,0]=3 21652 B18R2.3990 CC(SCc1ccccc1I)c2ccccc2 62a_100011216222_100000230085 [0,2,0,0,0,0|0,1,0]=3 21653 B18R2.3990 CC(SCc1cccnc1Br)c2ccccc2 62a_100000230085_100010140945 [0,2,0,0,0,0|1,1,0]=4 21654 B18R2.3990 CC(SCc1cccnc1Br)c2ccccc2 62a_100010140945_100000230085 [0,2,0,0,0,0|1,1,0]=4 21655 B18R2.3990 CC(SCc1cccnc1Cl)c2ccccc2 62a_100000045678_100000230085 [0,2,0,0,0,0|1,1,0]=4 21656 B18R2.3990 CC(SCc1cccnc1Cl)c2ccccc2 62a_100000230085_100000045678 [0,2,0,0,0,0|1,1,0]=4 21657 B18R2.3990 CC(SCc1cccnc1F)c2ccccc2 62a_100000099810_100000230085 [0,2,0,0,0,0|1,1,0]=4 21658 B18R2.3990 CC(SCc1cccnc1F)c2ccccc2 62a_100000230085_100000099810 [0,2,0,0,0,0|1,1,0]=4 21659 B18R2.3990 CC(SCc1ccncc1Cl)c2ccccc2 62a_100000230085_100000763264 [0,2,0,0,0,0|1,1,0]=4 21660 B18R2.3990 CC(SCc1ccncc1Cl)c2ccccc2 62a_100000763264_100000230085 [0,2,0,0,0,0|1,1,0]=4 21661 B18R2.3990 CC(SCc1ncccc1Br)c2ccccc2 62a_100000230085_100025702911 [0,2,0,0,0,0|1,1,0]=4 21662 B18R2.3990 CC(SCc1ncccc1Br)c2ccccc2 62a_100025702911_100000230085 [0,2,0,0,0,0|1,1,0]=4 21663 B18R2.3990 CC(SCc1ncccc1Cl)c2ccccc2 62a_100000099807_100000230085 [0,2,0,0,0,0|1,1,0]=4 21664 B18R2.3990 CC(SCc1ncccc1Cl)c2ccccc2 62a_100000230085_100000099807 [0,2,0,0,0,0|1,1,0]=4 21665 B18R2.3990 CC(SCc1ncccc1F)c2ccccc2 62a_100000104219_100000230085 [0,2,0,0,0,0|1,1,0]=4 21666 B18R2.3990 CC(SCc1ncccc1F)c2ccccc2 62a_100000230085_100000104219 [0,2,0,0,0,0|1,1,0]=4 21667 B18R2.3990 CC(SCc1ncccc1O)c2ccccc2 62a_100000230085_200020655725 [0,2,0,0,0,0|1,1,0]=4 21668 B18R2.3990 CC(SCc1ncccc1O)c2ccccc2 62a_200020655725_100000230085 [0,2,0,0,0,0|1,1,0]=4 21669 B18R2.3990 CN(CCc1ccccc1Br)c2ccccc2 2230a_100000210012_100012161201 [0,2,0,0,0,0|2,0,0]=4 21670 B18R2.3990 CN(CCc1ccccc1Br)c2ccccc2 269982a_100000210012_100012161201 [0,2,0,0,0,0|2,0,0]=4 21671 B18R2.3990 CN(CCc1ccccc1Br)c2ccccc2 34a_100000210012_100012161201 [0,2,0,0,0,0|2,0,0]=4 21672 B18R2.3990 CN(CCc1ccccc1Cl)c2ccccc2 2230a_100000210012_100011713703 [0,2,0,0,0,0|2,0,0]=4 21673 B18R2.3990 CN(CCc1ccccc1Cl)c2ccccc2 269982a_100000210012_100011713703 [0,2,0,0,0,0|2,0,0]=4 21674 B18R2.3990 CN(CCc1ccccc1Cl)c2ccccc2 34a_100000210012_100011713703 [0,2,0,0,0,0|2,0,0]=4 21675 B18R2.3990 CN(CCc1ccccc1F)c2ccccc2 2230a_100000210012_100011713696 [0,2,0,0,0,0|2,0,0]=4 21676 B18R2.3990 CN(CCc1ccccc1F)c2ccccc2 269982a_100000210012_100011713696 [0,2,0,0,0,0|2,0,0]=4 21677 B18R2.3990 CN(CCc1ccccc1F)c2ccccc2 34a_100000210012_100000720011 [0,2,0,0,0,0|2,0,0]=4 21678 B18R2.3990 CN(CCc1ccccc1O)c2ccccc2 269982a_100000210012_100000722297 [0,2,0,0,0,0|2,0,0]=4 21679 B18R2.3990 CN(CCc1ccccc1O)c2ccccc2 34a_100000210012_100000722297 [0,2,0,0,0,0|2,0,0]=4 21680 B18R2.3990 C[C@@H](NCc1ccccc1Br)c2ccccc2 207a_100000751104_100000211189 [0,2,0,0,0,0|1,0,0]=3 21681 B18R2.3990 C[C@@H](NCc1ccccc1Br)c2ccccc2 2230a_100000751104_100000184730 [0,2,0,0,0,0|1,0,0]=3 21682 B18R2.3990 C[C@@H](NCc1ccccc1Br)c2ccccc2 270004a_100000751104_100000211189 [0,2,0,0,0,0|1,0,0]=3 21683 B18R2.3990 C[C@@H](NCc1ccccc1Cl)c2ccccc2 207a_100000751104_100000210073 [0,2,0,0,0,0|1,0,0]=3 21684 B18R2.3990 C[C@@H](NCc1ccccc1Cl)c2ccccc2 2230a_100000751104_100000187162 [0,2,0,0,0,0|1,0,0]=3 21685 B18R2.3990 C[C@@H](NCc1ccccc1Cl)c2ccccc2 270004a_100000751104_100000210073 [0,2,0,0,0,0|1,0,0]=3 21686 B18R2.3990 C[C@@H](NCc1ccccc1F)c2ccccc2 207a_100000751104_100000210811 [0,2,0,0,0,0|1,0,0]=3 21687 B18R2.3990 C[C@@H](NCc1ccccc1F)c2ccccc2 2230a_100000751104_100000211605 [0,2,0,0,0,0|1,0,0]=3 21688 B18R2.3990 C[C@@H](NCc1ccccc1F)c2ccccc2 270004a_100000751104_100000210811 [0,2,0,0,0,0|1,0,0]=3 21689 B18R2.3990 C[C@@H](NCc1ccccc1I)c2ccccc2 207a_100000751104_100000010305 [0,2,0,0,0,0|1,0,0]=3 21690 B18R2.3990 C[C@@H](NCc1ccccc1I)c2ccccc2 2230a_100000751104_100011215278 [0,2,0,0,0,0|1,0,0]=3 21691 B18R2.3990 C[C@@H](NCc1ccccc1I)c2ccccc2 270004a_100000751104_100000010305 [0,2,0,0,0,0|1,0,0]=3 21692 B18R2.3990 C[C@@H](NCc1cccnc1Br)c2ccccc2 2230a_100000751104_100010140945 [0,2,0,0,0,0|2,0,0]=4 21693 B18R2.3990 C[C@@H](NCc1cccnc1Cl)c2ccccc2 2230a_100000751104_100000045678 [0,2,0,0,0,0|2,0,0]=4 21694 B18R2.3990 C[C@@H](NCc1cccnc1F)c2ccccc2 2230a_100000751104_100000099810 [0,2,0,0,0,0|2,0,0]=4 21695 B18R2.3990 C[C@@H](NCc1cccnc1O)c2ccccc2 207a_100000751104_100011998315 [0,2,0,0,0,0|2,0,0]=4 21696 B18R2.3990 C[C@@H](NCc1cccnc1O)c2ccccc2 270004a_100000751104_100011998315 [0,2,0,0,0,0|2,0,0]=4 21697 B18R2.3990 C[C@@H](NCc1ccncc1Br)c2ccccc2 270004a_100000751104_100000755692 [0,2,0,0,0,0|2,0,0]=4 21698 B18R2.3990 C[C@@H](NCc1ccncc1Cl)c2ccccc2 207a_100000751104_100011934409 [0,2,0,0,0,0|2,0,0]=4 21699 B18R2.3990 C[C@@H](NCc1ccncc1Cl)c2ccccc2 2230a_100000751104_100000763264 [0,2,0,0,0,0|2,0,0]=4 21700 B18R2.3990 C[C@@H](NCc1ccncc1Cl)c2ccccc2 270004a_100000751104_100011934409 [0,2,0,0,0,0|2,0,0]=4 21701 B18R2.3990 C[C@@H](NCc1cnccc1Br)c2ccccc2 270004a_100000751104_100009816821 [0,2,0,0,0,0|2,0,0]=4 21702 B18R2.3990 C[C@@H](NCc1cnccc1Cl)c2ccccc2 270004a_100000751104_100000050567 [0,2,0,0,0,0|2,0,0]=4 21703 B18R2.3990 C[C@@H](NCc1ncccc1Br)c2ccccc2 207a_100000751104_100011934733 [0,2,0,0,0,0|2,0,0]=4 21704 B18R2.3990 C[C@@H](NCc1ncccc1Br)c2ccccc2 2230a_100000751104_100025702911 [0,2,0,0,0,0|2,0,0]=4 21705 B18R2.3990 C[C@@H](NCc1ncccc1Br)c2ccccc2 270004a_100000751104_100011934733 [0,2,0,0,0,0|2,0,0]=4 21706 B18R2.3990 C[C@@H](NCc1ncccc1Cl)c2ccccc2 207a_100000751104_100012001307 [0,2,0,0,0,0|2,0,0]=4 21707 B18R2.3990 C[C@@H](NCc1ncccc1Cl)c2ccccc2 2230a_100000751104_100000099807 [0,2,0,0,0,0|2,0,0]=4 21708 B18R2.3990 C[C@@H](NCc1ncccc1Cl)c2ccccc2 270004a_100000751104_100012001307 [0,2,0,0,0,0|2,0,0]=4 21709 B18R2.3990 C[C@@H](NCc1ncccc1F)c2ccccc2 207a_100000751104_100011934734 [0,2,0,0,0,0|2,0,0]=4 21710 B18R2.3990 C[C@@H](NCc1ncccc1F)c2ccccc2 2230a_100000751104_100000104219 [0,2,0,0,0,0|2,0,0]=4 21711 B18R2.3990 C[C@@H](NCc1ncccc1F)c2ccccc2 270004a_100000751104_100011934734 [0,2,0,0,0,0|2,0,0]=4 21712 B18R2.3990 C[C@@H](OCc1ccccc1Br)c2ccccc2 34a_100000761318_100000184730 [0,2,0,0,0,0|0,0,0]=2 21713 B18R2.3990 C[C@@H](OCc1ccccc1Br)c2ccccc2 7a_100000761318_100000184730 [0,2,0,0,0,0|0,0,0]=2 21714 B18R2.3990 C[C@@H](OCc1ccccc1Cl)c2ccccc2 34a_100000761318_100000187162 [0,2,0,0,0,0|0,0,0]=2 21715 B18R2.3990 C[C@@H](OCc1ccccc1Cl)c2ccccc2 7a_100000761318_100000187162 [0,2,0,0,0,0|0,0,0]=2 21716 B18R2.3990 C[C@@H](OCc1ccccc1F)c2ccccc2 34a_100000761318_100000211605 [0,2,0,0,0,0|0,0,0]=2 21717 B18R2.3990 C[C@@H](OCc1ccccc1F)c2ccccc2 7a_100000761318_100000211605 [0,2,0,0,0,0|0,0,0]=2 21718 B18R2.3990 C[C@@H](OCc1ccccc1I)c2ccccc2 34a_100000761318_100011215278 [0,2,0,0,0,0|0,0,0]=2 21719 B18R2.3990 C[C@@H](OCc1ccccc1I)c2ccccc2 7a_100000761318_100011215278 [0,2,0,0,0,0|0,0,0]=2 21720 B18R2.3990 C[C@@H](OCc1cccnc1Br)c2ccccc2 34a_100000761318_100010140945 [0,2,0,0,0,0|1,0,0]=3 21721 B18R2.3990 C[C@@H](OCc1cccnc1Br)c2ccccc2 7a_100000761318_100010140945 [0,2,0,0,0,0|1,0,0]=3 21722 B18R2.3990 C[C@@H](OCc1cccnc1Cl)c2ccccc2 34a_100000761318_100000045678 [0,2,0,0,0,0|1,0,0]=3 21723 B18R2.3990 C[C@@H](OCc1cccnc1Cl)c2ccccc2 7a_100000761318_100000045678 [0,2,0,0,0,0|1,0,0]=3 21724 B18R2.3990 C[C@@H](OCc1cccnc1F)c2ccccc2 34a_100000761318_100000099810 [0,2,0,0,0,0|1,0,0]=3 21725 B18R2.3990 C[C@@H](OCc1cccnc1F)c2ccccc2 7a_100000761318_100000099810 [0,2,0,0,0,0|1,0,0]=3 21726 B18R2.3990 C[C@@H](OCc1ccncc1Cl)c2ccccc2 7a_100000761318_100000763264 [0,2,0,0,0,0|1,0,0]=3 21727 B18R2.3990 C[C@@H](OCc1ncccc1Br)c2ccccc2 34a_100000761318_100025702911 [0,2,0,0,0,0|1,0,0]=3 21728 B18R2.3990 C[C@@H](OCc1ncccc1Br)c2ccccc2 7a_100000761318_100025702911 [0,2,0,0,0,0|1,0,0]=3 21729 B18R2.3990 C[C@@H](OCc1ncccc1Cl)c2ccccc2 7a_100000761318_100000099807 [0,2,0,0,0,0|1,0,0]=3 21730 B18R2.3990 C[C@@H](OCc1ncccc1F)c2ccccc2 34a_100000761318_100000104219 [0,2,0,0,0,0|1,0,0]=3 21731 B18R2.3990 C[C@@H](OCc1ncccc1F)c2ccccc2 7a_100000761318_100000104219 [0,2,0,0,0,0|1,0,0]=3 21732 B18R2.3990 C[C@@H](OCc1ncccc1O)c2ccccc2 34a_100000761318_200020655725 [0,2,0,0,0,0|1,0,0]=3 21733 B18R2.3990 C[C@@H](OCc1ncccc1O)c2ccccc2 7a_100000761318_200020655725 [0,2,0,0,0,0|1,0,0]=3 21734 B18R2.3990 Cc1ccccc1CCC(=O)c2ccccc2 1458a_100000185807_100011713688 [0,2,0,0,0,0|1,0,1]=4 21735 B18R2.3990 Cc1ccccc1CCN(C)c2ccccc2 2230a_100000210012_100011713688 [0,2,0,0,0,0|2,0,0]=4 21736 B18R2.3990 Cc1ccccc1CCN(C)c2ccccc2 269982a_100000210012_100011713688 [0,2,0,0,0,0|2,0,0]=4 21737 B18R2.3990 Cc1ccccc1CCN(C)c2ccccc2 34a_100000210012_100011713688 [0,2,0,0,0,0|2,0,0]=4 21738 B18R2.3990 Cc1ccccc1CNC(=O)c2ccccc2 11a_100000174972_100000185807 [0,2,0,0,0,0|1,0,1]=4 21739 B18R2.3990 Cc1ccccc1CNC(=O)c2ccccc2 1626a_100000174972_100000185807 [0,2,0,0,0,0|1,0,1]=4 21740 B18R2.3990 Cc1ccccc1CNC(=O)c2ccccc2 240690a_100000174972_100000185807 [0,2,0,0,0,0|1,0,1]=4 21741 B18R2.3990 Cc1ccccc1CNC(=O)c2ccccc2 527a_100000174972_100000185807 [0,2,0,0,0,0|1,0,1]=4 21742 B18R2.3990 Cc1ccccc1CNC(C)c2ccccc2 269862a_100000174972_100000185851 [0,2,0,0,0,0|1,0,0]=3 21743 B18R2.3990 Cc1ccccc1CNC(C)c2ccccc2 34a_100000174972_100000211855 [0,2,0,0,0,0|1,0,0]=3 21744 B18R2.3990 Cc1ccccc1CNC(C)c2ccccn2 207a_100000181244_100000211143 [0,2,0,0,0,0|2,0,0]=4 21745 B18R2.3990 Cc1ccccc1CNC(C)c2ccccn2 2230a_100000181244_100000211839 [0,2,0,0,0,0|2,0,0]=4 21746 B18R2.3990 Cc1ccccc1CNC(C)c2ccccn2 269862a_100000174972_100000210467 [0,2,0,0,0,0|2,0,0]=4 21747 B18R2.3990 Cc1ccccc1CNC(C)c2ccccn2 270004a_100000181244_100000211143 [0,2,0,0,0,0|2,0,0]=4 21748 B18R2.3990 Cc1ccccc1CNC(C)c2cccnc2 207a_100000195435_100000211143 [0,2,0,0,0,0|2,0,0]=4 21749 B18R2.3990 Cc1ccccc1CNC(C)c2cccnc2 2230a_100000195435_100000211839 [0,2,0,0,0,0|2,0,0]=4 21750 B18R2.3990 Cc1ccccc1CNC(C)c2cccnc2 269862a_100000174972_100000210468 [0,2,0,0,0,0|2,0,0]=4 21751 B18R2.3990 Cc1ccccc1CNC(C)c2cccnc2 270004a_100000195435_100000211143 [0,2,0,0,0,0|2,0,0]=4 21752 B18R2.3990 Cc1ccccc1CNC(C)c2ccncc2 207a_100000181269_100000211143 [0,2,0,0,0,0|2,0,0]=4 21753 B18R2.3990 Cc1ccccc1CNC(C)c2ccncc2 2230a_100000181269_100000211839 [0,2,0,0,0,0|2,0,0]=4 21754 B18R2.3990 Cc1ccccc1CNC(C)c2ccncc2 269862a_100000174972_100000185792 [0,2,0,0,0,0|2,0,0]=4 21755 B18R2.3990 Cc1ccccc1CNC(C)c2ccncc2 270004a_100000181269_100000211143 [0,2,0,0,0,0|2,0,0]=4 21756 B18R2.3990 Cc1ccccc1CN[C@H](C)c2ccccc2 207a_100000751104_100000211143 [0,2,0,0,0,0|1,0,0]=3 21757 B18R2.3990 Cc1ccccc1CN[C@H](C)c2ccccc2 2230a_100000751104_100000211839 [0,2,0,0,0,0|1,0,0]=3 21758 B18R2.3990 Cc1ccccc1CN[C@H](C)c2ccccc2 270004a_100000751104_100000211143 [0,2,0,0,0,0|1,0,0]=3 21759 B18R2.3990 Cc1ccccc1COC(C)c2ccccc2 34a_100000698903_100000211855 [0,2,0,0,0,0|0,0,0]=2 21760 B18R2.3990 Cc1ccccc1COC(C)c2ccccc2 7a_100000698903_100000230085 [0,2,0,0,0,0|0,0,0]=2 21761 B18R2.3990 Cc1ccccc1COC(C)c2cnccn2 7a_100000698903_200000703233 [0,2,0,0,0,0|2,0,0]=4 21762 B18R2.3990 Cc1ccccc1CO[C@H](C)c2ccccc2 34a_100000761318_100000211839 [0,2,0,0,0,0|0,0,0]=2 21763 B18R2.3990 Cc1ccccc1CO[C@H](C)c2ccccc2 7a_100000761318_100000211839 [0,2,0,0,0,0|0,0,0]=2 21764 B18R2.3990 Cc1ccccc1CSC(C)c2ccccc2 62a_100000211839_100000230085 [0,2,0,0,0,0|0,1,0]=3 21765 B18R2.3990 Cc1ccccc1CSC(C)c2ccccc2 62a_100000230085_100000211839 [0,2,0,0,0,0|0,1,0]=3 21766 B18R2.3990 Cc1ccccc1NCC(C)c2ccccc2 34a_100015192222_100000756946 [0,2,0,0,0,0|2,0,0]=4 21767 B18R2.3990 Cc1ccccc1NCC(O)c2ccccc2 34a_100015192222_100000185958 [0,2,0,0,0,0|2,0,0]=4 21768 B18R2.3990 Cc1ccccc1NC[C@@H](O)c2ccccc2 34a_100015192222_100011933945 [0,2,0,0,0,0|2,0,0]=4 21769 B18R2.3990 Cc1ccccc1OCC(C)c2ccccc2 34a_100000210338_100000756946 [0,2,0,0,0,0|2,0,0]=4 21770 B18R2.3990 Cc1ccccc1OCC(C)c2ccccc2 7a_100000210338_100000756946 [0,2,0,0,0,0|2,0,0]=4 21771 B18R2.3990 Cc1ccccc1OCC(O)c2ccccc2 34a_100000210338_100000185958 [0,2,0,0,0,0|2,0,0]=4 21772 B18R2.3990 Cc1ccccc1OCC(O)c2ccccc2 7a_100000210338_100000185958 [0,2,0,0,0,0|2,0,0]=4 21773 B18R2.3990 Cc1ccccc1OC[C@@H](O)c2ccccc2 34a_100000210338_100011933945 [0,2,0,0,0,0|2,0,0]=4 21774 B18R2.3990 Cc1ccccc1OC[C@@H](O)c2ccccc2 7a_100000210338_100011933945 [0,2,0,0,0,0|2,0,0]=4 21775 B18R2.3990 Cc1ccccc1SCC(C)c2ccccc2 62a_100000210755_100000756946 [0,2,0,0,0,0|2,0,0]=4 21776 B18R2.3990 Cc1ccccc1SCC(C)c2ccccc2 62a_100000756946_100000210755 [0,2,0,0,0,0|2,0,0]=4 21777 B18R2.3990 Cc1ccccc1SCC(O)c2ccccc2 62a_100000185958_100000210755 [0,2,0,0,0,0|2,0,0]=4 21778 B18R2.3990 Cc1ccccc1SCC(O)c2ccccc2 62a_100000210755_100000185958 [0,2,0,0,0,0|2,0,0]=4 21779 B18R2.3990 Cc1ccccc1SC[C@@H](O)c2ccccc2 62a_100000210755_100011933945 [0,2,0,0,0,0|2,0,0]=4 21780 B18R2.3990 Cc1ccccc1SC[C@@H](O)c2ccccc2 62a_100011933945_100000210755 [0,2,0,0,0,0|2,0,0]=4 21781 B18R2.3990 Cc1cccnc1CNC(C)c2ccccc2 34a_100011223789_100000211855 [0,2,0,0,0,0|2,0,0]=4 21782 B18R2.3990 Cc1cccnc1CN[C@H](C)c2ccccc2 207a_100000751104_100000698913 [0,2,0,0,0,0|2,0,0]=4 21783 B18R2.3990 Cc1cccnc1CN[C@H](C)c2ccccc2 2230a_100000751104_100000696600 [0,2,0,0,0,0|2,0,0]=4 21784 B18R2.3990 Cc1cccnc1CN[C@H](C)c2ccccc2 270004a_100000751104_100000698913 [0,2,0,0,0,0|2,0,0]=4 21785 B18R2.3990 Cc1cccnc1COC(C)c2ccccc2 34a_100000698912_100000211855 [0,2,0,0,0,0|1,0,0]=3 21786 B18R2.3990 Cc1cccnc1CO[C@H](C)c2ccccc2 34a_100000761318_100000696600 [0,2,0,0,0,0|1,0,0]=3 21787 B18R2.3990 Cc1cccnc1CO[C@H](C)c2ccccc2 7a_100000761318_100000696600 [0,2,0,0,0,0|1,0,0]=3 21788 B18R2.3990 Cc1cccnc1CSC(C)c2ccccc2 62a_100000230085_100000696600 [0,2,0,0,0,0|1,1,0]=4 21789 B18R2.3990 Cc1cccnc1CSC(C)c2ccccc2 62a_100000696600_100000230085 [0,2,0,0,0,0|1,1,0]=4 21790 B18R2.3990 Cc1ccncc1CNC(C)c2ccccc2 269862a_100011997553_100000185851 [0,2,0,0,0,0|2,0,0]=4 21791 B18R2.3990 Cc1ccncc1CN[C@H](C)c2ccccc2 207a_100000751104_100000685662 [0,2,0,0,0,0|2,0,0]=4 21792 B18R2.3990 Cc1ccncc1CN[C@H](C)c2ccccc2 2230a_100000751104_100000690890 [0,2,0,0,0,0|2,0,0]=4 21793 B18R2.3990 Cc1ccncc1CN[C@H](C)c2ccccc2 270004a_100000751104_100000685662 [0,2,0,0,0,0|2,0,0]=4 21794 B18R2.3990 Cc1ccncc1COC(C)c2ccccc2 34a_100011996381_100000211855 [0,2,0,0,0,0|1,0,0]=3 21795 B18R2.3990 Cc1ccncc1CO[C@H](C)c2ccccc2 34a_100000761318_100000690890 [0,2,0,0,0,0|1,0,0]=3 21796 B18R2.3990 Cc1ccncc1CO[C@H](C)c2ccccc2 7a_100000761318_100000690890 [0,2,0,0,0,0|1,0,0]=3 21797 B18R2.3990 Cc1ccncc1CSC(C)c2ccccc2 62a_100000230085_100000690890 [0,2,0,0,0,0|1,1,0]=4 21798 B18R2.3990 Cc1ccncc1CSC(C)c2ccccc2 62a_100000690890_100000230085 [0,2,0,0,0,0|1,1,0]=4 21799 B18R2.3990 Cc1cnccc1CNC(C)c2ccccc2 269862a_100000708811_100000185851 [0,2,0,0,0,0|2,0,0]=4 21800 B18R2.3990 Cc1cnccc1CN[C@H](C)c2ccccc2 2230a_100000751104_100020672808 [0,2,0,0,0,0|2,0,0]=4 21801 B18R2.3990 Cc1cnccc1COC(C)c2ccccc2 34a_100011997032_100000211855 [0,2,0,0,0,0|1,0,0]=3 21802 B18R2.3990 Cc1cnccc1CO[C@H](C)c2ccccc2 34a_100000761318_100020672809 [0,2,0,0,0,0|1,0,0]=3 21803 B18R2.3990 Cc1cnccc1CO[C@H](C)c2ccccc2 7a_100000761318_100020672808 [0,2,0,0,0,0|1,0,0]=3 21804 B18R2.3990 Cc1cnccc1CSC(C)c2ccccc2 62a_100000230085_100020672808 [0,2,0,0,0,0|1,1,0]=4 21805 B18R2.3990 Cc1cnccc1CSC(C)c2ccccc2 62a_100020672808_100000230085 [0,2,0,0,0,0|1,1,0]=4 21806 B18R2.3990 Cc1ncccc1CN[C@H](C)c2ccccc2 207a_100000751104_100000751968 [0,2,0,0,0,0|2,0,0]=4 21807 B18R2.3990 Cc1ncccc1CN[C@H](C)c2ccccc2 2230a_100000751104_100000732876 [0,2,0,0,0,0|2,0,0]=4 21808 B18R2.3990 Cc1ncccc1CN[C@H](C)c2ccccc2 270004a_100000751104_100000751968 [0,2,0,0,0,0|2,0,0]=4 21809 B18R2.3990 Cc1ncccc1COC(C)c2ccccc2 34a_100000729262_100000211855 [0,2,0,0,0,0|1,0,0]=3 21810 B18R2.3990 Cc1ncccc1COC(C)c2ccccc2 7a_100000729262_100000230085 [0,2,0,0,0,0|1,0,0]=3 21811 B18R2.3990 Cc1ncccc1CO[C@H](C)c2ccccc2 34a_100000761318_100000732876 [0,2,0,0,0,0|1,0,0]=3 21812 B18R2.3990 Cc1ncccc1CO[C@H](C)c2ccccc2 7a_100000761318_100000732876 [0,2,0,0,0,0|1,0,0]=3 21813 B18R2.3990 Cc1ncccc1CSC(C)c2ccccc2 62a_100000230085_100000732876 [0,2,0,0,0,0|1,1,0]=4 21814 B18R2.3990 Cc1ncccc1CSC(C)c2ccccc2 62a_100000732876_100000230085 [0,2,0,0,0,0|1,1,0]=4 21815 B18R2.3990 Nc1ccccc1OCC(O)c2ccccc2 34a_100000185747_100000185958 [0,2,0,0,0,0|2,0,0]=4 21816 B18R2.3990 Nc1ccccc1OCC(O)c2ccccc2 7a_100000185747_100000185958 [0,2,0,0,0,0|2,0,0]=4 21817 B18R2.3990 Nc1ccccc1OC[C@@H](O)c2ccccc2 34a_100000185747_100011933945 [0,2,0,0,0,0|2,0,0]=4 21818 B18R2.3990 Nc1ccccc1OC[C@@H](O)c2ccccc2 7a_100000185747_100011933945 [0,2,0,0,0,0|2,0,0]=4 21819 B18R2.3990 Nc1ccccc1SCC(O)c2ccccc2 62a_100000185958_100000210017 [0,2,0,0,0,0|2,0,0]=4 21820 B18R2.3990 Nc1ccccc1SCC(O)c2ccccc2 62a_100000210017_100000185958 [0,2,0,0,0,0|2,0,0]=4 21821 B18R2.3990 Nc1ccccc1SC[C@@H](O)c2ccccc2 62a_100000210017_100011933945 [0,2,0,0,0,0|2,0,0]=4 21822 B18R2.3990 Nc1ccccc1SC[C@@H](O)c2ccccc2 62a_100011933945_100000210017 [0,2,0,0,0,0|2,0,0]=4 21823 B18R2.3990 O=C(CCc1ccccc1Br)c2ccccc2 1458a_100000185807_100012161201 [0,2,0,0,0,0|1,0,1]=4 21824 B18R2.3990 O=C(CCc1ccccc1Cl)c2ccccc2 1458a_100000185807_100011713703 [0,2,0,0,0,0|1,0,1]=4 21825 B18R2.3990 O=C(CCc1ccccc1F)c2ccccc2 1458a_100000185807_100000720011 [0,2,0,0,0,0|1,0,1]=4 21826 B18R2.3990 O=C(CCc1ccccc1O)c2ccccc2 1458a_100000185807_100000722297 [0,2,0,0,0,0|1,0,1]=4 21827 B18R2.3990 O=C(NCc1ccccc1Br)c2ccccc2 11a_100000689332_100000185807 [0,2,0,0,0,0|1,0,1]=4 21828 B18R2.3990 O=C(NCc1ccccc1Br)c2ccccc2 1626a_100000689332_100000185807 [0,2,0,0,0,0|1,0,1]=4 21829 B18R2.3990 O=C(NCc1ccccc1Br)c2ccccc2 240690a_100000689332_100000185807 [0,2,0,0,0,0|1,0,1]=4 21830 B18R2.3990 O=C(NCc1ccccc1Br)c2ccccc2 527a_100000689332_100000185807 [0,2,0,0,0,0|1,0,1]=4 21831 B18R2.3990 O=C(NCc1ccccc1Cl)c2ccccc2 11a_100000174879_100000185807 [0,2,0,0,0,0|1,0,1]=4 21832 B18R2.3990 O=C(NCc1ccccc1Cl)c2ccccc2 1626a_100000174879_100000185807 [0,2,0,0,0,0|1,0,1]=4 21833 B18R2.3990 O=C(NCc1ccccc1Cl)c2ccccc2 240690a_100000174879_100000185807 [0,2,0,0,0,0|1,0,1]=4 21834 B18R2.3990 O=C(NCc1ccccc1Cl)c2ccccc2 527a_100000174879_100000185807 [0,2,0,0,0,0|1,0,1]=4 21835 B18R2.3990 O=C(NCc1ccccc1F)c2ccccc2 11a_100000174869_100000185807 [0,2,0,0,0,0|1,0,1]=4 21836 B18R2.3990 O=C(NCc1ccccc1F)c2ccccc2 1626a_100000174869_100000185807 [0,2,0,0,0,0|1,0,1]=4 21837 B18R2.3990 O=C(NCc1ccccc1F)c2ccccc2 240690a_100000174869_100000185807 [0,2,0,0,0,0|1,0,1]=4 21838 B18R2.3990 O=C(NCc1ccccc1F)c2ccccc2 527a_100000174869_100000185807 [0,2,0,0,0,0|1,0,1]=4 21839 B18R2.3990 O=C(NCc1ccccc1I)c2ccccc2 11a_100015347259_100000185807 [0,2,0,0,0,0|1,0,1]=4 21840 B18R2.3990 O=C(NCc1ccccc1I)c2ccccc2 1626a_100015347259_100000185807 [0,2,0,0,0,0|1,0,1]=4 21841 B18R2.3990 O=C(NCc1ccccc1I)c2ccccc2 240690a_100015347259_100000185807 [0,2,0,0,0,0|1,0,1]=4 21842 B18R2.3990 O=C(NCc1ccccc1I)c2ccccc2 527a_100015347259_100000185807 [0,2,0,0,0,0|1,0,1]=4 21843 B18R2.3990 O=C(NCc1ccccc1O)c2ccccc2 240690a_100000185550_100000185807 [0,2,0,0,0,0|1,0,1]=4 21844 B18R2.3990 O=C(NCc1ccccc1O)c2ccccc2 527a_100000185550_100000185807 [0,2,0,0,0,0|1,0,1]=4 21845 B18R2.3990 OC(CNc1ccccc1Br)c2ccccc2 34a_100000210017_100000185958 [0,2,0,0,0,0|2,0,0]=4 21846 B18R2.3990 OC(CNc1ccccc1Cl)c2ccccc2 34a_100000185783_100000185958 [0,2,0,0,0,0|2,0,0]=4 21847 B18R2.3990 OC(CNc1ccccc1F)c2ccccc2 34a_100000210422_100000185958 [0,2,0,0,0,0|2,0,0]=4 21848 B18R2.3990 OC(CNc1ccccc1I)c2ccccc2 34a_100000210053_100000185958 [0,2,0,0,0,0|2,0,0]=4 21849 B18R2.3990 OC(COc1ccccc1Br)c2ccccc2 34a_100000181306_100000185958 [0,2,0,0,0,0|2,0,0]=4 21850 B18R2.3990 OC(COc1ccccc1Br)c2ccccc2 7a_100000181306_100000185958 [0,2,0,0,0,0|2,0,0]=4 21851 B18R2.3990 OC(COc1ccccc1Cl)c2ccccc2 34a_100000210172_100000185958 [0,2,0,0,0,0|2,0,0]=4 21852 B18R2.3990 OC(COc1ccccc1Cl)c2ccccc2 7a_100000210172_100000185958 [0,2,0,0,0,0|2,0,0]=4 21853 B18R2.3990 OC(COc1ccccc1F)c2ccccc2 34a_100000210171_100000185958 [0,2,0,0,0,0|2,0,0]=4 21854 B18R2.3990 OC(COc1ccccc1F)c2ccccc2 7a_100000210171_100000185958 [0,2,0,0,0,0|2,0,0]=4 21855 B18R2.3990 OC(COc1ccccc1I)c2ccccc2 34a_100000739446_100000185958 [0,2,0,0,0,0|2,0,0]=4 21856 B18R2.3990 OC(COc1ccccc1I)c2ccccc2 7a_100000739446_100000185958 [0,2,0,0,0,0|2,0,0]=4 21857 B18R2.3990 OC(CSc1ccccc1Br)c2ccccc2 62a_100000185958_100000695589 [0,2,0,0,0,0|2,0,0]=4 21858 B18R2.3990 OC(CSc1ccccc1Br)c2ccccc2 62a_100000695589_100000185958 [0,2,0,0,0,0|2,0,0]=4 21859 B18R2.3990 OC(CSc1ccccc1Cl)c2ccccc2 62a_100000185958_100000764095 [0,2,0,0,0,0|2,0,0]=4 21860 B18R2.3990 OC(CSc1ccccc1Cl)c2ccccc2 62a_100000764095_100000185958 [0,2,0,0,0,0|2,0,0]=4 21861 B18R2.3990 OC(CSc1ccccc1F)c2ccccc2 62a_100000185958_100011215700 [0,2,0,0,0,0|2,0,0]=4 21862 B18R2.3990 OC(CSc1ccccc1F)c2ccccc2 62a_100011215700_100000185958 [0,2,0,0,0,0|2,0,0]=4 21863 B18R2.3990 O[C@H](CNc1ccccc1Br)c2ccccc2 34a_100000210017_100011933945 [0,2,0,0,0,0|2,0,0]=4 21864 B18R2.3990 O[C@H](CNc1ccccc1Cl)c2ccccc2 34a_100000185783_100011933945 [0,2,0,0,0,0|2,0,0]=4 21865 B18R2.3990 O[C@H](CNc1ccccc1F)c2ccccc2 34a_100000210422_100011933945 [0,2,0,0,0,0|2,0,0]=4 21866 B18R2.3990 O[C@H](CNc1ccccc1I)c2ccccc2 34a_100000210053_100011933945 [0,2,0,0,0,0|2,0,0]=4 21867 B18R2.3990 O[C@H](COc1ccccc1Br)c2ccccc2 34a_100000181306_100011933945 [0,2,0,0,0,0|2,0,0]=4 21868 B18R2.3990 O[C@H](COc1ccccc1Br)c2ccccc2 7a_100000181306_100011933945 [0,2,0,0,0,0|2,0,0]=4 21869 B18R2.3990 O[C@H](COc1ccccc1Cl)c2ccccc2 34a_100000210172_100011933945 [0,2,0,0,0,0|2,0,0]=4 21870 B18R2.3990 O[C@H](COc1ccccc1Cl)c2ccccc2 7a_100000210172_100011933945 [0,2,0,0,0,0|2,0,0]=4 21871 B18R2.3990 O[C@H](COc1ccccc1F)c2ccccc2 34a_100000210171_100011933945 [0,2,0,0,0,0|2,0,0]=4 21872 B18R2.3990 O[C@H](COc1ccccc1F)c2ccccc2 7a_100000210171_100011933945 [0,2,0,0,0,0|2,0,0]=4 21873 B18R2.3990 O[C@H](COc1ccccc1I)c2ccccc2 34a_100000739446_100011933945 [0,2,0,0,0,0|2,0,0]=4 21874 B18R2.3990 O[C@H](COc1ccccc1I)c2ccccc2 7a_100000739446_100011933945 [0,2,0,0,0,0|2,0,0]=4 21875 B18R2.3990 O[C@H](CSc1ccccc1Br)c2ccccc2 62a_100000695589_100011933945 [0,2,0,0,0,0|2,0,0]=4 21876 B18R2.3990 O[C@H](CSc1ccccc1Br)c2ccccc2 62a_100011933945_100000695589 [0,2,0,0,0,0|2,0,0]=4 21877 B18R2.3990 O[C@H](CSc1ccccc1Cl)c2ccccc2 62a_100000764095_100011933945 [0,2,0,0,0,0|2,0,0]=4 21878 B18R2.3990 O[C@H](CSc1ccccc1Cl)c2ccccc2 62a_100011933945_100000764095 [0,2,0,0,0,0|2,0,0]=4 21879 B18R2.3990 O[C@H](CSc1ccccc1F)c2ccccc2 62a_100011215700_100011933945 [0,2,0,0,0,0|2,0,0]=4 21880 B18R2.3990 O[C@H](CSc1ccccc1F)c2ccccc2 62a_100011933945_100011215700 [0,2,0,0,0,0|2,0,0]=4 21881 B18R2.3990 Oc1ccccc1NCC(O)c2ccccc2 34a_100000185747_100000185958 [0,2,0,0,0,0|2,0,0]=4 21882 B18R2.3990 Oc1ccccc1NC[C@@H](O)c2ccccc2 34a_100000185747_100011933945 [0,2,0,0,0,0|2,0,0]=4 21883 B18R2.3990 Oc1ccccc1SCC(O)c2ccccc2 62a_100000185958_100000739446 [0,2,0,0,0,0|2,0,0]=4 21884 B18R2.3990 Oc1ccccc1SCC(O)c2ccccc2 62a_100000739446_100000185958 [0,2,0,0,0,0|2,0,0]=4 21885 B18R2.3990 Oc1ccccc1SC[C@@H](O)c2ccccc2 62a_100000739446_100011933945 [0,2,0,0,0,0|2,0,0]=4 21886 B18R2.3990 Oc1ccccc1SC[C@@H](O)c2ccccc2 62a_100011933945_100000739446 [0,2,0,0,0,0|2,0,0]=4 21887 B18R2.4001 CC(NCc1ccccc1)c2ccccc2Br 207a_100000181357_100015611070 [0,2,0,0,0,0|1,0,0]=3 21888 B18R2.4001 CC(NCc1ccccc1)c2ccccc2Br 2230a_100000181357_100015291786 [0,2,0,0,0,0|1,0,0]=3 21889 B18R2.4001 CC(NCc1ccccc1)c2ccccc2Br 269862a_100015324214_100000187085 [0,2,0,0,0,0|1,0,0]=3 21890 B18R2.4001 CC(NCc1ccccc1)c2ccccc2Br 270004a_100000181357_100015611070 [0,2,0,0,0,0|1,0,0]=3 21891 B18R2.4001 CC(NCc1ccccc1)c2ccccc2Cl 207a_100000174978_100015611070 [0,2,0,0,0,0|1,0,0]=3 21892 B18R2.4001 CC(NCc1ccccc1)c2ccccc2Cl 2230a_100000174978_100015291786 [0,2,0,0,0,0|1,0,0]=3 21893 B18R2.4001 CC(NCc1ccccc1)c2ccccc2Cl 2230a_100015324214_100000181259 [0,2,0,0,0,0|1,0,0]=3 21894 B18R2.4001 CC(NCc1ccccc1)c2ccccc2Cl 269862a_100015324214_100000210134 [0,2,0,0,0,0|1,0,0]=3 21895 B18R2.4001 CC(NCc1ccccc1)c2ccccc2Cl 270004a_100000174978_100015611070 [0,2,0,0,0,0|1,0,0]=3 21896 B18R2.4001 CC(NCc1ccccc1)c2ccccc2Cl 34a_100000174978_100015291786 [0,2,0,0,0,0|1,0,0]=3 21897 B18R2.4001 CC(NCc1ccccc1)c2ccccc2F 207a_100000181408_100015611070 [0,2,0,0,0,0|1,0,0]=3 21898 B18R2.4001 CC(NCc1ccccc1)c2ccccc2F 2230a_100000181408_100015291786 [0,2,0,0,0,0|1,0,0]=3 21899 B18R2.4001 CC(NCc1ccccc1)c2ccccc2F 2230a_100015324214_200000741388 [0,2,0,0,0,0|1,0,0]=3 21900 B18R2.4001 CC(NCc1ccccc1)c2ccccc2F 269862a_100015324214_100000210632 [0,2,0,0,0,0|1,0,0]=3 21901 B18R2.4001 CC(NCc1ccccc1)c2ccccc2F 270004a_100000181408_100015611070 [0,2,0,0,0,0|1,0,0]=3 21902 B18R2.4001 CC(NCc1ccccc1)c2ccccc2F 34a_100000181408_100015291786 [0,2,0,0,0,0|1,0,0]=3 21903 B18R2.4001 CC(NCc1ccccc1)c2ccccc2F 34a_100015324214_200000741388 [0,2,0,0,0,0|1,0,0]=3 21904 B18R2.4001 CC(NCc1ccccc1)c2ccccc2I 269862a_100015324214_100000751169 [0,2,0,0,0,0|1,0,0]=3 21905 B18R2.4001 CC(NCc1ccccc1)c2cccnc2O 2230a_100159269580_100015291786 [0,2,0,0,0,0|2,0,0]=4 21906 B18R2.4001 CC(NCc1ccccc1)c2ccncc2Br 269862a_100015324214_100009993184 [0,2,0,0,0,0|2,0,0]=4 21907 B18R2.4001 CC(NCc1ccccc1)c2ccncc2Cl 269862a_100015324214_100012001414 [0,2,0,0,0,0|2,0,0]=4 21908 B18R2.4001 CC(NCc1ccccc1)c2ccncc2F 269862a_100015324214_100000727669 [0,2,0,0,0,0|2,0,0]=4 21909 B18R2.4001 CC(NCc1ccccc1)c2cnccc2Cl 269862a_100015324214_100160469449 [0,2,0,0,0,0|2,0,0]=4 21910 B18R2.4001 CC(NCc1ccccc1)c2ncccc2Br 207a_100159271932_100015611070 [0,2,0,0,0,0|2,0,0]=4 21911 B18R2.4001 CC(NCc1ccccc1)c2ncccc2Br 2230a_100159271932_100015291786 [0,2,0,0,0,0|2,0,0]=4 21912 B18R2.4001 CC(NCc1ccccc1)c2ncccc2Br 269862a_100015324214_100012348690 [0,2,0,0,0,0|2,0,0]=4 21913 B18R2.4001 CC(NCc1ccccc1)c2ncccc2Br 270004a_100159271932_100015611070 [0,2,0,0,0,0|2,0,0]=4 21914 B18R2.4001 CC(NCc1ccccc1)c2ncccc2Cl 269862a_100015324214_100015267551 [0,2,0,0,0,0|2,0,0]=4 21915 B18R2.4001 CC(NCc1ccccc1)c2ncccc2F 269862a_100015324214_100011997767 [0,2,0,0,0,0|2,0,0]=4 21916 B18R2.4001 CC(NCc1ccccc1)c2ncccc2I 269862a_100015324214_200015599370 [0,2,0,0,0,0|2,0,0]=4 21917 B18R2.4001 CC(NCc1ccccn1)c2ccccc2Br 207a_100000181357_100000209966 [0,2,0,0,0,0|2,0,0]=4 21918 B18R2.4001 CC(NCc1ccccn1)c2ccccc2Br 2230a_100000181357_100000721315 [0,2,0,0,0,0|2,0,0]=4 21919 B18R2.4001 CC(NCc1ccccn1)c2ccccc2Br 270004a_100000181357_100000209966 [0,2,0,0,0,0|2,0,0]=4 21920 B18R2.4001 CC(NCc1ccccn1)c2ccccc2Cl 207a_100000174978_100000209966 [0,2,0,0,0,0|2,0,0]=4 21921 B18R2.4001 CC(NCc1ccccn1)c2ccccc2Cl 2230a_100000174978_100000721315 [0,2,0,0,0,0|2,0,0]=4 21922 B18R2.4001 CC(NCc1ccccn1)c2ccccc2Cl 270004a_100000174978_100000209966 [0,2,0,0,0,0|2,0,0]=4 21923 B18R2.4001 CC(NCc1ccccn1)c2ccccc2Cl 34a_100000174978_100000721315 [0,2,0,0,0,0|2,0,0]=4 21924 B18R2.4001 CC(NCc1ccccn1)c2ccccc2F 207a_100000181408_100000209966 [0,2,0,0,0,0|2,0,0]=4 21925 B18R2.4001 CC(NCc1ccccn1)c2ccccc2F 2230a_100000181408_100000721315 [0,2,0,0,0,0|2,0,0]=4 21926 B18R2.4001 CC(NCc1ccccn1)c2ccccc2F 270004a_100000181408_100000209966 [0,2,0,0,0,0|2,0,0]=4 21927 B18R2.4001 CC(NCc1ccccn1)c2ccccc2F 34a_100000181408_100000721315 [0,2,0,0,0,0|2,0,0]=4 21928 B18R2.4001 CC(NCc1cccnc1)c2ccccc2Br 207a_100000181357_100000209961 [0,2,0,0,0,0|2,0,0]=4 21929 B18R2.4001 CC(NCc1cccnc1)c2ccccc2Br 2230a_100000181357_100000741622 [0,2,0,0,0,0|2,0,0]=4 21930 B18R2.4001 CC(NCc1cccnc1)c2ccccc2Br 269862a_100000210453_100000187085 [0,2,0,0,0,0|2,0,0]=4 21931 B18R2.4001 CC(NCc1cccnc1)c2ccccc2Br 270004a_100000181357_100000209961 [0,2,0,0,0,0|2,0,0]=4 21932 B18R2.4001 CC(NCc1cccnc1)c2ccccc2Cl 207a_100000174978_100000209961 [0,2,0,0,0,0|2,0,0]=4 21933 B18R2.4001 CC(NCc1cccnc1)c2ccccc2Cl 2230a_100000174978_100000741622 [0,2,0,0,0,0|2,0,0]=4 21934 B18R2.4001 CC(NCc1cccnc1)c2ccccc2Cl 269862a_100000210453_100000210134 [0,2,0,0,0,0|2,0,0]=4 21935 B18R2.4001 CC(NCc1cccnc1)c2ccccc2Cl 270004a_100000174978_100000209961 [0,2,0,0,0,0|2,0,0]=4 21936 B18R2.4001 CC(NCc1cccnc1)c2ccccc2Cl 34a_100000174978_100000733263 [0,2,0,0,0,0|2,0,0]=4 21937 B18R2.4001 CC(NCc1cccnc1)c2ccccc2F 207a_100000181408_100000209961 [0,2,0,0,0,0|2,0,0]=4 21938 B18R2.4001 CC(NCc1cccnc1)c2ccccc2F 2230a_100000181408_100000741622 [0,2,0,0,0,0|2,0,0]=4 21939 B18R2.4001 CC(NCc1cccnc1)c2ccccc2F 269862a_100000210453_100000210632 [0,2,0,0,0,0|2,0,0]=4 21940 B18R2.4001 CC(NCc1cccnc1)c2ccccc2F 270004a_100000181408_100000209961 [0,2,0,0,0,0|2,0,0]=4 21941 B18R2.4001 CC(NCc1cccnc1)c2ccccc2F 34a_100000181408_100000733263 [0,2,0,0,0,0|2,0,0]=4 21942 B18R2.4001 CC(NCc1cccnc1)c2ccccc2I 269862a_100000210453_100000751169 [0,2,0,0,0,0|2,0,0]=4 21943 B18R2.4001 CC(NCc1ccncc1)c2ccccc2Br 207a_100000181357_100000186114 [0,2,0,0,0,0|2,0,0]=4 21944 B18R2.4001 CC(NCc1ccncc1)c2ccccc2Br 2230a_100000181357_100015193705 [0,2,0,0,0,0|2,0,0]=4 21945 B18R2.4001 CC(NCc1ccncc1)c2ccccc2Br 269862a_100000210450_100000187085 [0,2,0,0,0,0|2,0,0]=4 21946 B18R2.4001 CC(NCc1ccncc1)c2ccccc2Cl 207a_100000174978_100000186114 [0,2,0,0,0,0|2,0,0]=4 21947 B18R2.4001 CC(NCc1ccncc1)c2ccccc2Cl 2230a_100000174978_100015193705 [0,2,0,0,0,0|2,0,0]=4 21948 B18R2.4001 CC(NCc1ccncc1)c2ccccc2Cl 269862a_100000210450_100000210134 [0,2,0,0,0,0|2,0,0]=4 21949 B18R2.4001 CC(NCc1ccncc1)c2ccccc2F 207a_100000181408_100000186114 [0,2,0,0,0,0|2,0,0]=4 21950 B18R2.4001 CC(NCc1ccncc1)c2ccccc2F 2230a_100000181408_100015193705 [0,2,0,0,0,0|2,0,0]=4 21951 B18R2.4001 CC(NCc1ccncc1)c2ccccc2F 269862a_100000210450_100000210632 [0,2,0,0,0,0|2,0,0]=4 21952 B18R2.4001 CC(NCc1ccncc1)c2ccccc2I 269862a_100000210450_100000751169 [0,2,0,0,0,0|2,0,0]=4 21953 B18R2.4001 CC(OCc1ccccc1)c2ccccc2Br 34a_100000702211_100015291786 [0,2,0,0,0,0|0,0,0]=2 21954 B18R2.4001 CC(OCc1ccccc1)c2ccccc2Br 7a_100000702211_100000211182 [0,2,0,0,0,0|0,0,0]=2 21955 B18R2.4001 CC(OCc1ccccc1)c2ccccc2Cl 34a_100000740796_100015291786 [0,2,0,0,0,0|0,0,0]=2 21956 B18R2.4001 CC(OCc1ccccc1)c2ccccc2Cl 7a_100000210790_100000181259 [0,2,0,0,0,0|0,0,0]=2 21957 B18R2.4001 CC(OCc1ccccc1)c2ccccc2Cl 7a_100000740796_100000211182 [0,2,0,0,0,0|0,0,0]=2 21958 B18R2.4001 CC(OCc1ccccc1)c2ccccc2F 34a_100000210790_200000741388 [0,2,0,0,0,0|0,0,0]=2 21959 B18R2.4001 CC(OCc1ccccc1)c2ccccc2F 34a_100000697922_100015291786 [0,2,0,0,0,0|0,0,0]=2 21960 B18R2.4001 CC(OCc1ccccc1)c2ccccc2F 7a_100000210790_200000741388 [0,2,0,0,0,0|0,0,0]=2 21961 B18R2.4001 CC(OCc1ccccc1)c2ccccc2F 7a_100000697922_100000211182 [0,2,0,0,0,0|0,0,0]=2 21962 B18R2.4001 CC(OCc1ccccc1)c2ccccc2N 7a_100011405641_100000211182 [0,2,0,0,0,0|0,0,0]=2 21963 B18R2.4001 CC(OCc1ccccc1)c2cccnc2Cl 34a_100009865335_100015291786 [0,2,0,0,0,0|1,0,0]=3 21964 B18R2.4001 CC(OCc1ccccc1)c2cccnc2Cl 7a_100009865335_100000211182 [0,2,0,0,0,0|1,0,0]=3 21965 B18R2.4001 CC(OCc1ccccc1)c2ccncc2F 34a_100012180158_100015291786 [0,2,0,0,0,0|1,0,0]=3 21966 B18R2.4001 CC(OCc1ccccn1)c2ccccc2Br 34a_100000702211_100000721315 [0,2,0,0,0,0|1,0,0]=3 21967 B18R2.4001 CC(OCc1ccccn1)c2ccccc2Br 7a_100000702211_100000721315 [0,2,0,0,0,0|1,0,0]=3 21968 B18R2.4001 CC(OCc1ccccn1)c2ccccc2Cl 34a_100000740796_100000721315 [0,2,0,0,0,0|1,0,0]=3 21969 B18R2.4001 CC(OCc1ccccn1)c2ccccc2Cl 7a_100000740796_100000721315 [0,2,0,0,0,0|1,0,0]=3 21970 B18R2.4001 CC(OCc1ccccn1)c2ccccc2F 34a_100000697922_100000721315 [0,2,0,0,0,0|1,0,0]=3 21971 B18R2.4001 CC(OCc1ccccn1)c2ccccc2F 7a_100000697922_100000721315 [0,2,0,0,0,0|1,0,0]=3 21972 B18R2.4001 CC(OCc1ccccn1)c2ccccc2N 7a_100011405641_100000721315 [0,2,0,0,0,0|1,0,0]=3 21973 B18R2.4001 CC(OCc1ccccn1)c2cccnc2Cl 34a_100009865335_100000721315 [0,2,0,0,0,0|2,0,0]=4 21974 B18R2.4001 CC(OCc1ccccn1)c2cccnc2Cl 7a_100009865335_100000721315 [0,2,0,0,0,0|2,0,0]=4 21975 B18R2.4001 CC(OCc1ccccn1)c2ccncc2F 34a_100012180158_100000721315 [0,2,0,0,0,0|2,0,0]=4 21976 B18R2.4001 CC(OCc1cccnc1)c2ccccc2Br 34a_100000702211_100000733263 [0,2,0,0,0,0|1,0,0]=3 21977 B18R2.4001 CC(OCc1cccnc1)c2ccccc2Br 7a_100000702211_100000741622 [0,2,0,0,0,0|1,0,0]=3 21978 B18R2.4001 CC(OCc1cccnc1)c2ccccc2Cl 34a_100000740796_100000733263 [0,2,0,0,0,0|1,0,0]=3 21979 B18R2.4001 CC(OCc1cccnc1)c2ccccc2Cl 7a_100000740796_100000741622 [0,2,0,0,0,0|1,0,0]=3 21980 B18R2.4001 CC(OCc1cccnc1)c2ccccc2F 34a_100000697922_100000733263 [0,2,0,0,0,0|1,0,0]=3 21981 B18R2.4001 CC(OCc1cccnc1)c2ccccc2F 7a_100000697922_100000741622 [0,2,0,0,0,0|1,0,0]=3 21982 B18R2.4001 CC(OCc1cccnc1)c2ccccc2N 7a_100011405641_100000741622 [0,2,0,0,0,0|1,0,0]=3 21983 B18R2.4001 CC(OCc1cccnc1)c2cccnc2Cl 34a_100009865335_100000733263 [0,2,0,0,0,0|2,0,0]=4 21984 B18R2.4001 CC(OCc1cccnc1)c2cccnc2Cl 7a_100009865335_100000741622 [0,2,0,0,0,0|2,0,0]=4 21985 B18R2.4001 CC(OCc1cccnc1)c2ccncc2F 34a_100012180158_100000733263 [0,2,0,0,0,0|2,0,0]=4 21986 B18R2.4001 CC(OCc1cccnn1)c2ccccc2Br 34a_100000702211_100016990269 [0,2,0,0,0,0|2,0,0]=4 21987 B18R2.4001 CC(OCc1cccnn1)c2ccccc2Br 7a_100000702211_100016990269 [0,2,0,0,0,0|2,0,0]=4 21988 B18R2.4001 CC(OCc1cccnn1)c2ccccc2Cl 34a_100000740796_100016990269 [0,2,0,0,0,0|2,0,0]=4 21989 B18R2.4001 CC(OCc1cccnn1)c2ccccc2Cl 7a_100000740796_100016990269 [0,2,0,0,0,0|2,0,0]=4 21990 B18R2.4001 CC(OCc1cccnn1)c2ccccc2F 34a_100000697922_100016990269 [0,2,0,0,0,0|2,0,0]=4 21991 B18R2.4001 CC(OCc1cccnn1)c2ccccc2F 7a_100000697922_100016990269 [0,2,0,0,0,0|2,0,0]=4 21992 B18R2.4001 CC(OCc1cccnn1)c2ccccc2N 7a_100011405641_100016990269 [0,2,0,0,0,0|2,0,0]=4 21993 B18R2.4001 CC(OCc1ccncc1)c2ccccc2Br 7a_100000702211_100015193705 [0,2,0,0,0,0|1,0,0]=3 21994 B18R2.4001 CC(OCc1ccncc1)c2ccccc2Cl 7a_100000740796_100015193705 [0,2,0,0,0,0|1,0,0]=3 21995 B18R2.4001 CC(OCc1ccncc1)c2ccccc2F 7a_100000697922_100015193705 [0,2,0,0,0,0|1,0,0]=3 21996 B18R2.4001 CC(OCc1ccncc1)c2ccccc2N 7a_100011405641_100015193705 [0,2,0,0,0,0|1,0,0]=3 21997 B18R2.4001 CC(OCc1ccncc1)c2cccnc2Cl 7a_100009865335_100015193705 [0,2,0,0,0,0|2,0,0]=4 21998 B18R2.4001 CC(OCc1cnccn1)c2ccccc2Br 34a_100000702211_100016995436 [0,2,0,0,0,0|2,0,0]=4 21999 B18R2.4001 CC(OCc1cnccn1)c2ccccc2Br 7a_100000702211_100016995436 [0,2,0,0,0,0|2,0,0]=4 22000 B18R2.4001 CC(OCc1cnccn1)c2ccccc2Cl 34a_100000740796_100016995436 [0,2,0,0,0,0|2,0,0]=4 22001 B18R2.4001 CC(OCc1cnccn1)c2ccccc2Cl 7a_100000740796_100016995436 [0,2,0,0,0,0|2,0,0]=4 22002 B18R2.4001 CC(OCc1cnccn1)c2ccccc2F 34a_100000697922_100016995436 [0,2,0,0,0,0|2,0,0]=4 22003 B18R2.4001 CC(OCc1cnccn1)c2ccccc2F 7a_100000697922_100016995436 [0,2,0,0,0,0|2,0,0]=4 22004 B18R2.4001 CC(OCc1cnccn1)c2ccccc2N 7a_100011405641_100016995436 [0,2,0,0,0,0|2,0,0]=4 22005 B18R2.4001 CC(OCc1cncnc1)c2ccccc2Br 34a_100000702211_100015196519 [0,2,0,0,0,0|2,0,0]=4 22006 B18R2.4001 CC(OCc1cncnc1)c2ccccc2Br 7a_100000702211_100015196519 [0,2,0,0,0,0|2,0,0]=4 22007 B18R2.4001 CC(OCc1cncnc1)c2ccccc2Cl 34a_100000740796_100015196519 [0,2,0,0,0,0|2,0,0]=4 22008 B18R2.4001 CC(OCc1cncnc1)c2ccccc2Cl 7a_100000740796_100015196519 [0,2,0,0,0,0|2,0,0]=4 22009 B18R2.4001 CC(OCc1cncnc1)c2ccccc2F 34a_100000697922_100015196519 [0,2,0,0,0,0|2,0,0]=4 22010 B18R2.4001 CC(OCc1cncnc1)c2ccccc2F 7a_100000697922_100015196519 [0,2,0,0,0,0|2,0,0]=4 22011 B18R2.4001 CC(OCc1cncnc1)c2ccccc2N 7a_100011405641_100015196519 [0,2,0,0,0,0|2,0,0]=4 22012 B18R2.4001 CC(OCc1ncccn1)c2ccccc2Br 34a_100000702211_100000703007 [0,2,0,0,0,0|2,0,0]=4 22013 B18R2.4001 CC(OCc1ncccn1)c2ccccc2Br 7a_100000702211_100000703007 [0,2,0,0,0,0|2,0,0]=4 22014 B18R2.4001 CC(OCc1ncccn1)c2ccccc2Cl 34a_100000740796_100000703007 [0,2,0,0,0,0|2,0,0]=4 22015 B18R2.4001 CC(OCc1ncccn1)c2ccccc2Cl 7a_100000740796_100000703007 [0,2,0,0,0,0|2,0,0]=4 22016 B18R2.4001 CC(OCc1ncccn1)c2ccccc2F 34a_100000697922_100000703007 [0,2,0,0,0,0|2,0,0]=4 22017 B18R2.4001 CC(OCc1ncccn1)c2ccccc2F 7a_100000697922_100000703007 [0,2,0,0,0,0|2,0,0]=4 22018 B18R2.4001 CC(OCc1ncccn1)c2ccccc2N 7a_100011405641_100000703007 [0,2,0,0,0,0|2,0,0]=4 22019 B18R2.4001 CC(SCc1ccccc1)c2ccccc2Cl 62a_100000181259_100015291786 [0,2,0,0,0,0|0,1,0]=3 22020 B18R2.4001 CC(SCc1ccccc1)c2ccccc2Cl 62a_100000211182_100000181259 [0,2,0,0,0,0|0,1,0]=3 22021 B18R2.4001 CC(SCc1ccccc1)c2ccccc2F 62a_100000211182_200000741388 [0,2,0,0,0,0|0,1,0]=3 22022 B18R2.4001 CC(SCc1ccccc1)c2ccccc2F 62a_200000741388_100015291786 [0,2,0,0,0,0|0,1,0]=3 22023 B18R2.4001 CC(SCc1ccccn1)c2ccccc2Cl 62a_100000181259_100000721315 [0,2,0,0,0,0|1,1,0]=4 22024 B18R2.4001 CC(SCc1ccccn1)c2ccccc2Cl 62a_100000721315_100000181259 [0,2,0,0,0,0|1,1,0]=4 22025 B18R2.4001 CC(SCc1ccccn1)c2ccccc2F 62a_100000721315_200000741388 [0,2,0,0,0,0|1,1,0]=4 22026 B18R2.4001 CC(SCc1ccccn1)c2ccccc2F 62a_200000741388_100000721315 [0,2,0,0,0,0|1,1,0]=4 22027 B18R2.4001 CC(SCc1cccnc1)c2ccccc2Cl 62a_100000181259_100000741622 [0,2,0,0,0,0|1,1,0]=4 22028 B18R2.4001 CC(SCc1cccnc1)c2ccccc2Cl 62a_100000741622_100000181259 [0,2,0,0,0,0|1,1,0]=4 22029 B18R2.4001 CC(SCc1cccnc1)c2ccccc2F 62a_100000741622_200000741388 [0,2,0,0,0,0|1,1,0]=4 22030 B18R2.4001 CC(SCc1cccnc1)c2ccccc2F 62a_200000741388_100000741622 [0,2,0,0,0,0|1,1,0]=4 22031 B18R2.4001 CC(SCc1ccncc1)c2ccccc2Cl 62a_100000181259_100015193705 [0,2,0,0,0,0|1,1,0]=4 22032 B18R2.4001 CC(SCc1ccncc1)c2ccccc2Cl 62a_100015193705_100000181259 [0,2,0,0,0,0|1,1,0]=4 22033 B18R2.4001 CC(SCc1ccncc1)c2ccccc2F 62a_100015193705_200000741388 [0,2,0,0,0,0|1,1,0]=4 22034 B18R2.4001 CC(SCc1ccncc1)c2ccccc2F 62a_200000741388_100015193705 [0,2,0,0,0,0|1,1,0]=4 22035 B18R2.4001 CN(CCc1ccccc1)c2ccccc2Br 2230a_100020606079_100000765856 [0,2,0,0,0,0|2,0,0]=4 22036 B18R2.4001 CN(CCc1ccccc1)c2ccccc2Br 269982a_100020606079_100000765856 [0,2,0,0,0,0|2,0,0]=4 22037 B18R2.4001 CN(CCc1ccccc1)c2ccccc2Br 34a_100020606079_100000765856 [0,2,0,0,0,0|2,0,0]=4 22038 B18R2.4001 CN(CCc1ccccc1)c2ccccc2Cl 2230a_100000219374_100000765856 [0,2,0,0,0,0|2,0,0]=4 22039 B18R2.4001 CN(CCc1ccccc1)c2ccccc2Cl 269982a_100000219374_100000765856 [0,2,0,0,0,0|2,0,0]=4 22040 B18R2.4001 CN(CCc1ccccc1)c2ccccc2Cl 34a_100000219374_100000765856 [0,2,0,0,0,0|2,0,0]=4 22041 B18R2.4001 CN(CCc1ccccc1)c2ccccc2F 2230a_100000220357_100000765856 [0,2,0,0,0,0|2,0,0]=4 22042 B18R2.4001 CN(CCc1ccccc1)c2ccccc2F 269982a_100000220357_100000765856 [0,2,0,0,0,0|2,0,0]=4 22043 B18R2.4001 CN(CCc1ccccc1)c2ccccc2F 34a_100000220357_100000765856 [0,2,0,0,0,0|2,0,0]=4 22044 B18R2.4001 CN(CCc1ccccc1)c2ccccc2F 38a_100000220357_100000765856 [0,2,0,0,0,0|2,0,0]=4 22045 B18R2.4001 CN(CCc1ccccc1)c2ccccc2O 269982a_100000033821_100000765856 [0,2,0,0,0,0|2,0,0]=4 22046 B18R2.4001 C[C@@H](NCc1ccccc1)c2ccccc2O 2230a_100025703389_100015291786 [0,2,0,0,0,0|1,0,0]=3 22047 B18R2.4001 C[C@@H](NCc1ccccc1)c2ccccc2O 270004a_100025703389_100015611070 [0,2,0,0,0,0|1,0,0]=3 22048 B18R2.4001 C[C@@H](NCc1ccccn1)c2ccccc2O 2230a_100025703389_100000721315 [0,2,0,0,0,0|2,0,0]=4 22049 B18R2.4001 C[C@@H](NCc1ccccn1)c2ccccc2O 270004a_100025703389_100000209966 [0,2,0,0,0,0|2,0,0]=4 22050 B18R2.4001 C[C@@H](NCc1cccnc1)c2ccccc2O 2230a_100025703389_100000741622 [0,2,0,0,0,0|2,0,0]=4 22051 B18R2.4001 C[C@@H](NCc1cccnc1)c2ccccc2O 270004a_100025703389_100000209961 [0,2,0,0,0,0|2,0,0]=4 22052 B18R2.4001 C[C@@H](NCc1ccncc1)c2ccccc2O 2230a_100025703389_100015193705 [0,2,0,0,0,0|2,0,0]=4 22053 B18R2.4001 C[C@H](OCc1ccccc1)c2ncccc2Br 7a_100013325542_100000211182 [0,2,0,0,0,0|1,0,0]=3 22054 B18R2.4001 C[C@H](OCc1ccccn1)c2ncccc2Br 7a_100013325542_100000721315 [0,2,0,0,0,0|2,0,0]=4 22055 B18R2.4001 C[C@H](OCc1cccnc1)c2ncccc2Br 7a_100013325542_100000741622 [0,2,0,0,0,0|2,0,0]=4 22056 B18R2.4001 C[C@H](OCc1ccncc1)c2ncccc2Br 7a_100013325542_100015193705 [0,2,0,0,0,0|2,0,0]=4 22057 B18R2.4001 Cc1ccccc1C(=O)CCc2ccccc2 1458a_100000212026_100000765856 [0,2,0,0,0,0|1,0,1]=4 22058 B18R2.4001 Cc1ccccc1C(=O)NCc2ccccc2 11a_100015324214_100000212026 [0,2,0,0,0,0|1,0,1]=4 22059 B18R2.4001 Cc1ccccc1C(=O)NCc2ccccc2 1626a_100015324214_100000212026 [0,2,0,0,0,0|1,0,1]=4 22060 B18R2.4001 Cc1ccccc1C(=O)NCc2ccccc2 240690a_100015324214_100000212026 [0,2,0,0,0,0|1,0,1]=4 22061 B18R2.4001 Cc1ccccc1C(=O)NCc2ccccc2 527a_100015324214_100000212026 [0,2,0,0,0,0|1,0,1]=4 22062 B18R2.4001 Cc1ccccc1C(C)NCc2ccccc2 207a_100000181355_100015611070 [0,2,0,0,0,0|1,0,0]=3 22063 B18R2.4001 Cc1ccccc1C(C)NCc2ccccc2 2230a_100000181355_100015291786 [0,2,0,0,0,0|1,0,0]=3 22064 B18R2.4001 Cc1ccccc1C(C)NCc2ccccc2 269862a_100015324214_100000211656 [0,2,0,0,0,0|1,0,0]=3 22065 B18R2.4001 Cc1ccccc1C(C)NCc2ccccc2 270004a_100000181355_100015611070 [0,2,0,0,0,0|1,0,0]=3 22066 B18R2.4001 Cc1ccccc1C(C)NCc2ccccc2 34a_100000181355_100015291786 [0,2,0,0,0,0|1,0,0]=3 22067 B18R2.4001 Cc1ccccc1C(C)NCc2ccccn2 207a_100000181355_100000209966 [0,2,0,0,0,0|2,0,0]=4 22068 B18R2.4001 Cc1ccccc1C(C)NCc2ccccn2 2230a_100000181355_100000721315 [0,2,0,0,0,0|2,0,0]=4 22069 B18R2.4001 Cc1ccccc1C(C)NCc2ccccn2 270004a_100000181355_100000209966 [0,2,0,0,0,0|2,0,0]=4 22070 B18R2.4001 Cc1ccccc1C(C)NCc2ccccn2 34a_100000181355_100000721315 [0,2,0,0,0,0|2,0,0]=4 22071 B18R2.4001 Cc1ccccc1C(C)NCc2cccnc2 207a_100000181355_100000209961 [0,2,0,0,0,0|2,0,0]=4 22072 B18R2.4001 Cc1ccccc1C(C)NCc2cccnc2 2230a_100000181355_100000741622 [0,2,0,0,0,0|2,0,0]=4 22073 B18R2.4001 Cc1ccccc1C(C)NCc2cccnc2 269862a_100000210453_100000211656 [0,2,0,0,0,0|2,0,0]=4 22074 B18R2.4001 Cc1ccccc1C(C)NCc2cccnc2 270004a_100000181355_100000209961 [0,2,0,0,0,0|2,0,0]=4 22075 B18R2.4001 Cc1ccccc1C(C)NCc2cccnc2 34a_100000181355_100000733263 [0,2,0,0,0,0|2,0,0]=4 22076 B18R2.4001 Cc1ccccc1C(C)NCc2ccncc2 207a_100000181355_100000186114 [0,2,0,0,0,0|2,0,0]=4 22077 B18R2.4001 Cc1ccccc1C(C)NCc2ccncc2 2230a_100000181355_100015193705 [0,2,0,0,0,0|2,0,0]=4 22078 B18R2.4001 Cc1ccccc1C(C)NCc2ccncc2 269862a_100000210450_100000211656 [0,2,0,0,0,0|2,0,0]=4 22079 B18R2.4001 Cc1ccccc1C(C)OCc2ccccc2 34a_100000742021_100015291786 [0,2,0,0,0,0|0,0,0]=2 22080 B18R2.4001 Cc1ccccc1C(C)OCc2ccccc2 7a_100000742021_100000211182 [0,2,0,0,0,0|0,0,0]=2 22081 B18R2.4001 Cc1ccccc1C(C)OCc2ccccn2 34a_100000742021_100000721315 [0,2,0,0,0,0|1,0,0]=3 22082 B18R2.4001 Cc1ccccc1C(C)OCc2ccccn2 7a_100000742021_100000721315 [0,2,0,0,0,0|1,0,0]=3 22083 B18R2.4001 Cc1ccccc1C(C)OCc2cccnc2 34a_100000742021_100000733263 [0,2,0,0,0,0|1,0,0]=3 22084 B18R2.4001 Cc1ccccc1C(C)OCc2cccnc2 7a_100000742021_100000741622 [0,2,0,0,0,0|1,0,0]=3 22085 B18R2.4001 Cc1ccccc1C(C)OCc2cccnn2 34a_100000742021_100016990269 [0,2,0,0,0,0|2,0,0]=4 22086 B18R2.4001 Cc1ccccc1C(C)OCc2cccnn2 7a_100000742021_100016990269 [0,2,0,0,0,0|2,0,0]=4 22087 B18R2.4001 Cc1ccccc1C(C)OCc2ccncc2 7a_100000742021_100015193705 [0,2,0,0,0,0|1,0,0]=3 22088 B18R2.4001 Cc1ccccc1C(C)OCc2cnccn2 34a_100000742021_100016995436 [0,2,0,0,0,0|2,0,0]=4 22089 B18R2.4001 Cc1ccccc1C(C)OCc2cnccn2 7a_100000742021_100016995436 [0,2,0,0,0,0|2,0,0]=4 22090 B18R2.4001 Cc1ccccc1C(C)OCc2cncnc2 34a_100000742021_100015196519 [0,2,0,0,0,0|2,0,0]=4 22091 B18R2.4001 Cc1ccccc1C(C)OCc2cncnc2 7a_100000742021_100015196519 [0,2,0,0,0,0|2,0,0]=4 22092 B18R2.4001 Cc1ccccc1C(C)OCc2ncccn2 34a_100000742021_100000703007 [0,2,0,0,0,0|2,0,0]=4 22093 B18R2.4001 Cc1ccccc1C(C)OCc2ncccn2 7a_100000742021_100000703007 [0,2,0,0,0,0|2,0,0]=4 22094 B18R2.4001 Cc1ccccc1N(C)CCc2ccccc2 2230a_100000219699_100000765856 [0,2,0,0,0,0|2,0,0]=4 22095 B18R2.4001 Cc1ccccc1N(C)CCc2ccccc2 269982a_100000219699_100000765856 [0,2,0,0,0,0|2,0,0]=4 22096 B18R2.4001 Cc1ccccc1N(C)CCc2ccccc2 34a_100000219699_100000765856 [0,2,0,0,0,0|2,0,0]=4 22097 B18R2.4001 Cc1cccnc1C(C)NCc2ccccc2 207a_100011536111_100015611070 [0,2,0,0,0,0|2,0,0]=4 22098 B18R2.4001 Cc1cccnc1C(C)NCc2ccccc2 2230a_100011536111_100015291786 [0,2,0,0,0,0|2,0,0]=4 22099 B18R2.4001 Cc1cccnc1C(C)NCc2ccccc2 269862a_100015324214_100011536074 [0,2,0,0,0,0|2,0,0]=4 22100 B18R2.4001 Cc1cccnc1C(C)NCc2ccccc2 270004a_100011536111_100015611070 [0,2,0,0,0,0|2,0,0]=4 22101 B18R2.4001 Cc1ccncc1C(C)NCc2ccccc2 269862a_100015324214_100000693228 [0,2,0,0,0,0|2,0,0]=4 22102 B18R2.4001 Cc1ncccc1C(C)NCc2ccccc2 269862a_100015324214_100011995960 [0,2,0,0,0,0|2,0,0]=4 22103 B18R2.4001 O=C(CCc1ccccc1)c2ccccc2Br 1458a_100000188424_100000765856 [0,2,0,0,0,0|1,0,1]=4 22104 B18R2.4001 O=C(CCc1ccccc1)c2ccccc2Cl 1458a_100000185844_100000765856 [0,2,0,0,0,0|1,0,1]=4 22105 B18R2.4001 O=C(CCc1ccccc1)c2ccccc2F 1458a_100000188656_100000765856 [0,2,0,0,0,0|1,0,1]=4 22106 B18R2.4001 O=C(CCc1ccccc1)c2ccccc2I 1458a_100000187884_100000765856 [0,2,0,0,0,0|1,0,1]=4 22107 B18R2.4001 O=C(CCc1ccccc1)c2ccccc2O 1458a_100015234032_100000765856 [0,2,0,0,0,0|1,0,1]=4 22108 B18R2.4001 O=C(CCc1ccccc1)c2ccccc2[O-] 1458a_100009911694_100000765856 [0,2,0,0,0,0|1,0,1]=4 22109 B18R2.4001 O=C(NCc1ccccc1)c2ccccc2Br 11a_100015324214_100000188424 [0,2,0,0,0,0|1,0,1]=4 22110 B18R2.4001 O=C(NCc1ccccc1)c2ccccc2Br 1626a_100015324214_100000188424 [0,2,0,0,0,0|1,0,1]=4 22111 B18R2.4001 O=C(NCc1ccccc1)c2ccccc2Br 240690a_100015324214_100000188424 [0,2,0,0,0,0|1,0,1]=4 22112 B18R2.4001 O=C(NCc1ccccc1)c2ccccc2Br 527a_100015324214_100000188424 [0,2,0,0,0,0|1,0,1]=4 22113 B18R2.4001 O=C(NCc1ccccc1)c2ccccc2Cl 11a_100015324214_100000185844 [0,2,0,0,0,0|1,0,1]=4 22114 B18R2.4001 O=C(NCc1ccccc1)c2ccccc2Cl 1626a_100015324214_100000185844 [0,2,0,0,0,0|1,0,1]=4 22115 B18R2.4001 O=C(NCc1ccccc1)c2ccccc2Cl 240690a_100015324214_100000185844 [0,2,0,0,0,0|1,0,1]=4 22116 B18R2.4001 O=C(NCc1ccccc1)c2ccccc2Cl 527a_100015324214_100000185844 [0,2,0,0,0,0|1,0,1]=4 22117 B18R2.4001 O=C(NCc1ccccc1)c2ccccc2F 11a_100015324214_100000188656 [0,2,0,0,0,0|1,0,1]=4 22118 B18R2.4001 O=C(NCc1ccccc1)c2ccccc2F 1626a_100015324214_100000188656 [0,2,0,0,0,0|1,0,1]=4 22119 B18R2.4001 O=C(NCc1ccccc1)c2ccccc2F 240690a_100015324214_100000188656 [0,2,0,0,0,0|1,0,1]=4 22120 B18R2.4001 O=C(NCc1ccccc1)c2ccccc2F 527a_100015324214_100000188656 [0,2,0,0,0,0|1,0,1]=4 22121 B18R2.4001 O=C(NCc1ccccc1)c2ccccc2I 11a_100015324214_100000187884 [0,2,0,0,0,0|1,0,1]=4 22122 B18R2.4001 O=C(NCc1ccccc1)c2ccccc2I 1626a_100015324214_100000187884 [0,2,0,0,0,0|1,0,1]=4 22123 B18R2.4001 O=C(NCc1ccccc1)c2ccccc2I 240690a_100015324214_100000187884 [0,2,0,0,0,0|1,0,1]=4 22124 B18R2.4001 O=C(NCc1ccccc1)c2ccccc2I 527a_100015324214_100000187884 [0,2,0,0,0,0|1,0,1]=4 22125 B18R2.4001 O=C(NCc1ccccc1)c2ccccc2O 240690a_100015324214_100015234032 [0,2,0,0,0,0|1,0,1]=4 22126 B18R2.4001 O=C(NCc1ccccc1)c2ccccc2O 271570a_203496583355_200000153116 [0,2,0,0,0,0|1,0,1]=4 22127 B18R2.4001 O=C(NCc1ccccc1)c2ccccc2[O-] 1626a_100015324214_100009911694 [0,2,0,0,0,0|1,0,1]=4 22128 B18R2.4001 O=C(NCc1ccccc1)c2ccccc2[O-] 240690a_100015324214_100009911694 [0,2,0,0,0,0|1,0,1]=4 22129 B18R2.4001 O=C(NCc1ccccc1)c2ccccc2[O-] 527a_100015324214_100009911694 [0,2,0,0,0,0|1,0,1]=4 22130 B18R2.6463 CC(NCc1ccccc1)c2cc(ccn2)Br 269862a_100015324214_100000709912 [0,2,0,0,0,0|2,0,0]=4 22131 B18R2.6463 CC(NCc1ccccc1)c2cc(ccn2)Br 270004a_100015324214_100000709912 [0,2,0,0,0,0|2,0,0]=4 22132 B18R2.6463 CC(NCc1ccccc1)c2cc(ccn2)Cl 269862a_100015324214_100000099826 [0,2,0,0,0,0|2,0,0]=4 22133 B18R2.6463 CC(NCc1ccccc1)c2cc(ccn2)Cl 270004a_100015324214_100000099826 [0,2,0,0,0,0|2,0,0]=4 22134 B18R2.6463 CC(NCc1ccccc1)c2cccc(c2)Br 207a_100020642005_100015611070 [0,2,0,0,0,0|1,0,0]=3 22135 B18R2.6463 CC(NCc1ccccc1)c2cccc(c2)Br 2230a_100020642005_100015291786 [0,2,0,0,0,0|1,0,0]=3 22136 B18R2.6463 CC(NCc1ccccc1)c2cccc(c2)Br 269862a_100015324214_100000210093 [0,2,0,0,0,0|1,0,0]=3 22137 B18R2.6463 CC(NCc1ccccc1)c2cccc(c2)Br 270004a_100020642005_100015611070 [0,2,0,0,0,0|1,0,0]=3 22138 B18R2.6463 CC(NCc1ccccc1)c2cccc(c2)Cl 207a_100102723534_100015611070 [0,2,0,0,0,0|1,0,0]=3 22139 B18R2.6463 CC(NCc1ccccc1)c2cccc(c2)Cl 2230a_100102723534_100015291786 [0,2,0,0,0,0|1,0,0]=3 22140 B18R2.6463 CC(NCc1ccccc1)c2cccc(c2)Cl 269862a_100015324214_200000210964 [0,2,0,0,0,0|1,0,0]=3 22141 B18R2.6463 CC(NCc1ccccc1)c2cccc(c2)Cl 270004a_100102723534_100015611070 [0,2,0,0,0,0|1,0,0]=3 22142 B18R2.6463 CC(NCc1ccccc1)c2cccc(c2)Cl 34a_100102723534_100015291786 [0,2,0,0,0,0|1,0,0]=3 22143 B18R2.6463 CC(NCc1ccccc1)c2cccc(c2)F 269862a_100015324214_100000187083 [0,2,0,0,0,0|1,0,0]=3 22144 B18R2.6463 CC(NCc1ccccc1)c2cccc(c2)I 269862a_100015324214_100011356966 [0,2,0,0,0,0|1,0,0]=3 22145 B18R2.6463 CC(NCc1ccccc1)c2cccc(c2)O 207a_100000740644_100015611070 [0,2,0,0,0,0|1,0,0]=3 22146 B18R2.6463 CC(NCc1ccccc1)c2cccc(c2)O 2230a_100000740644_100015291786 [0,2,0,0,0,0|1,0,0]=3 22147 B18R2.6463 CC(NCc1ccccc1)c2cccc(c2)O 269862a_100015324214_100000211620 [0,2,0,0,0,0|1,0,0]=3 22148 B18R2.6463 CC(NCc1ccccc1)c2cccc(c2)O 270004a_100000740644_100015611070 [0,2,0,0,0,0|1,0,0]=3 22149 B18R2.6463 CC(NCc1ccccc1)c2cccc(n2)Br 2230a_200010173468_100015291786 [0,2,0,0,0,0|2,0,0]=4 22150 B18R2.6463 CC(NCc1ccccc1)c2cccc(n2)Br 269862a_100015324214_100009816502 [0,2,0,0,0,0|2,0,0]=4 22151 B18R2.6463 CC(NCc1ccccc1)c2cccc(n2)Br 270004a_200010173468_100015611070 [0,2,0,0,0,0|2,0,0]=4 22152 B18R2.6463 CC(NCc1ccccc1)c2cccc(n2)Cl 269862a_100015324214_100000085735 [0,2,0,0,0,0|2,0,0]=4 22153 B18R2.6463 CC(NCc1ccccc1)c2cccc(n2)F 269862a_100015324214_100000092306 [0,2,0,0,0,0|2,0,0]=4 22154 B18R2.6463 CC(NCc1ccccc1)c2ccnc(c2)Br 269862a_100015324214_100010177706 [0,2,0,0,0,0|2,0,0]=4 22155 B18R2.6463 CC(NCc1ccccc1)c2ccnc(c2)Cl 269862a_100015324214_100000685609 [0,2,0,0,0,0|2,0,0]=4 22156 B18R2.6463 CC(NCc1ccccc1)c2cncc(c2)Br 269862a_100015324214_100011216243 [0,2,0,0,0,0|2,0,0]=4 22157 B18R2.6463 CC(NCc1ccccc1)c2cncc(c2)F 269862a_100015324214_100000758212 [0,2,0,0,0,0|2,0,0]=4 22158 B18R2.6463 CC(NCc1ccccn1)c2cccc(c2)Br 207a_100020642005_100000209966 [0,2,0,0,0,0|2,0,0]=4 22159 B18R2.6463 CC(NCc1ccccn1)c2cccc(c2)Br 2230a_100020642005_100000721315 [0,2,0,0,0,0|2,0,0]=4 22160 B18R2.6463 CC(NCc1ccccn1)c2cccc(c2)Br 270004a_100020642005_100000209966 [0,2,0,0,0,0|2,0,0]=4 22161 B18R2.6463 CC(NCc1ccccn1)c2cccc(c2)Cl 207a_100102723534_100000209966 [0,2,0,0,0,0|2,0,0]=4 22162 B18R2.6463 CC(NCc1ccccn1)c2cccc(c2)Cl 2230a_100102723534_100000721315 [0,2,0,0,0,0|2,0,0]=4 22163 B18R2.6463 CC(NCc1ccccn1)c2cccc(c2)Cl 270004a_100102723534_100000209966 [0,2,0,0,0,0|2,0,0]=4 22164 B18R2.6463 CC(NCc1ccccn1)c2cccc(c2)Cl 34a_100102723534_100000721315 [0,2,0,0,0,0|2,0,0]=4 22165 B18R2.6463 CC(NCc1ccccn1)c2cccc(c2)O 207a_100000740644_100000209966 [0,2,0,0,0,0|2,0,0]=4 22166 B18R2.6463 CC(NCc1ccccn1)c2cccc(c2)O 2230a_100000740644_100000721315 [0,2,0,0,0,0|2,0,0]=4 22167 B18R2.6463 CC(NCc1ccccn1)c2cccc(c2)O 270004a_100000740644_100000209966 [0,2,0,0,0,0|2,0,0]=4 22168 B18R2.6463 CC(NCc1cccnc1)c2cccc(c2)Br 207a_100020642005_100000209961 [0,2,0,0,0,0|2,0,0]=4 22169 B18R2.6463 CC(NCc1cccnc1)c2cccc(c2)Br 2230a_100020642005_100000741622 [0,2,0,0,0,0|2,0,0]=4 22170 B18R2.6463 CC(NCc1cccnc1)c2cccc(c2)Br 269862a_100000210453_100000210093 [0,2,0,0,0,0|2,0,0]=4 22171 B18R2.6463 CC(NCc1cccnc1)c2cccc(c2)Br 270004a_100020642005_100000209961 [0,2,0,0,0,0|2,0,0]=4 22172 B18R2.6463 CC(NCc1cccnc1)c2cccc(c2)Cl 207a_100102723534_100000209961 [0,2,0,0,0,0|2,0,0]=4 22173 B18R2.6463 CC(NCc1cccnc1)c2cccc(c2)Cl 2230a_100102723534_100000741622 [0,2,0,0,0,0|2,0,0]=4 22174 B18R2.6463 CC(NCc1cccnc1)c2cccc(c2)Cl 269862a_100000210453_200000210964 [0,2,0,0,0,0|2,0,0]=4 22175 B18R2.6463 CC(NCc1cccnc1)c2cccc(c2)Cl 270004a_100102723534_100000209961 [0,2,0,0,0,0|2,0,0]=4 22176 B18R2.6463 CC(NCc1cccnc1)c2cccc(c2)Cl 34a_100102723534_100000733263 [0,2,0,0,0,0|2,0,0]=4 22177 B18R2.6463 CC(NCc1cccnc1)c2cccc(c2)F 269862a_100000210453_100000187083 [0,2,0,0,0,0|2,0,0]=4 22178 B18R2.6463 CC(NCc1cccnc1)c2cccc(c2)I 269862a_100000210453_100011356966 [0,2,0,0,0,0|2,0,0]=4 22179 B18R2.6463 CC(NCc1cccnc1)c2cccc(c2)O 207a_100000740644_100000209961 [0,2,0,0,0,0|2,0,0]=4 22180 B18R2.6463 CC(NCc1cccnc1)c2cccc(c2)O 2230a_100000740644_100000741622 [0,2,0,0,0,0|2,0,0]=4 22181 B18R2.6463 CC(NCc1cccnc1)c2cccc(c2)O 269862a_100000210453_100000211620 [0,2,0,0,0,0|2,0,0]=4 22182 B18R2.6463 CC(NCc1cccnc1)c2cccc(c2)O 270004a_100000740644_100000209961 [0,2,0,0,0,0|2,0,0]=4 22183 B18R2.6463 CC(NCc1ccncc1)c2cccc(c2)Br 207a_100020642005_100000186114 [0,2,0,0,0,0|2,0,0]=4 22184 B18R2.6463 CC(NCc1ccncc1)c2cccc(c2)Br 2230a_100020642005_100015193705 [0,2,0,0,0,0|2,0,0]=4 22185 B18R2.6463 CC(NCc1ccncc1)c2cccc(c2)Br 269862a_100000210450_100000210093 [0,2,0,0,0,0|2,0,0]=4 22186 B18R2.6463 CC(NCc1ccncc1)c2cccc(c2)Cl 207a_100102723534_100000186114 [0,2,0,0,0,0|2,0,0]=4 22187 B18R2.6463 CC(NCc1ccncc1)c2cccc(c2)Cl 2230a_100102723534_100015193705 [0,2,0,0,0,0|2,0,0]=4 22188 B18R2.6463 CC(NCc1ccncc1)c2cccc(c2)Cl 269862a_100000210450_200000210964 [0,2,0,0,0,0|2,0,0]=4 22189 B18R2.6463 CC(NCc1ccncc1)c2cccc(c2)F 269862a_100000210450_100000187083 [0,2,0,0,0,0|2,0,0]=4 22190 B18R2.6463 CC(NCc1ccncc1)c2cccc(c2)I 269862a_100000210450_100011356966 [0,2,0,0,0,0|2,0,0]=4 22191 B18R2.6463 CC(NCc1ccncc1)c2cccc(c2)O 207a_100000740644_100000186114 [0,2,0,0,0,0|2,0,0]=4 22192 B18R2.6463 CC(NCc1ccncc1)c2cccc(c2)O 2230a_100000740644_100015193705 [0,2,0,0,0,0|2,0,0]=4 22193 B18R2.6463 CC(NCc1ccncc1)c2cccc(c2)O 269862a_100000210450_100000211620 [0,2,0,0,0,0|2,0,0]=4 22194 B18R2.6463 CC(OCc1ccccc1)c2cc(ccn2)Cl 7a_100000144657_100000211182 [0,2,0,0,0,0|1,0,0]=3 22195 B18R2.6463 CC(OCc1ccccc1)c2cccc(c2)Br 34a_100000246457_100015291786 [0,2,0,0,0,0|0,0,0]=2 22196 B18R2.6463 CC(OCc1ccccc1)c2cccc(c2)Br 7a_100000246457_100000211182 [0,2,0,0,0,0|0,0,0]=2 22197 B18R2.6463 CC(OCc1ccccc1)c2cccc(c2)F 34a_100000744526_100015291786 [0,2,0,0,0,0|0,0,0]=2 22198 B18R2.6463 CC(OCc1ccccc1)c2cccc(c2)F 7a_100000744526_100000211182 [0,2,0,0,0,0|0,0,0]=2 22199 B18R2.6463 CC(OCc1ccccc1)c2cccc(c2)I 34a_100013085317_100015291786 [0,2,0,0,0,0|0,0,0]=2 22200 B18R2.6463 CC(OCc1ccccc1)c2cccc(c2)I 7a_100013085317_100000211182 [0,2,0,0,0,0|0,0,0]=2 22201 B18R2.6463 CC(OCc1ccccc1)c2cccc(c2)N 34a_100011217120_100015291786 [0,2,0,0,0,0|0,0,0]=2 22202 B18R2.6463 CC(OCc1ccccc1)c2cccc(c2)N 7a_100011217120_100000211182 [0,2,0,0,0,0|0,0,0]=2 22203 B18R2.6463 CC(OCc1ccccc1)c2cccc(n2)Br 7a_100009820884_100000211182 [0,2,0,0,0,0|1,0,0]=3 22204 B18R2.6463 CC(OCc1ccccc1)c2cncc(c2)Br 34a_100012351597_100015291786 [0,2,0,0,0,0|1,0,0]=3 22205 B18R2.6463 CC(OCc1ccccc1)c2cncc(c2)Br 7a_100012351597_100000211182 [0,2,0,0,0,0|1,0,0]=3 22206 B18R2.6463 CC(OCc1ccccn1)c2cc(ccn2)Cl 7a_100000144657_100000721315 [0,2,0,0,0,0|2,0,0]=4 22207 B18R2.6463 CC(OCc1ccccn1)c2cccc(c2)Br 34a_100000246457_100000721315 [0,2,0,0,0,0|1,0,0]=3 22208 B18R2.6463 CC(OCc1ccccn1)c2cccc(c2)Br 7a_100000246457_100000721315 [0,2,0,0,0,0|1,0,0]=3 22209 B18R2.6463 CC(OCc1ccccn1)c2cccc(c2)F 34a_100000744526_100000721315 [0,2,0,0,0,0|1,0,0]=3 22210 B18R2.6463 CC(OCc1ccccn1)c2cccc(c2)F 7a_100000744526_100000721315 [0,2,0,0,0,0|1,0,0]=3 22211 B18R2.6463 CC(OCc1ccccn1)c2cccc(c2)I 34a_100013085317_100000721315 [0,2,0,0,0,0|1,0,0]=3 22212 B18R2.6463 CC(OCc1ccccn1)c2cccc(c2)I 7a_100013085317_100000721315 [0,2,0,0,0,0|1,0,0]=3 22213 B18R2.6463 CC(OCc1ccccn1)c2cccc(c2)N 34a_100011217120_100000721315 [0,2,0,0,0,0|1,0,0]=3 22214 B18R2.6463 CC(OCc1ccccn1)c2cccc(c2)N 7a_100011217120_100000721315 [0,2,0,0,0,0|1,0,0]=3 22215 B18R2.6463 CC(OCc1ccccn1)c2cccc(n2)Br 7a_100009820884_100000721315 [0,2,0,0,0,0|2,0,0]=4 22216 B18R2.6463 CC(OCc1ccccn1)c2cncc(c2)Br 34a_100012351597_100000721315 [0,2,0,0,0,0|2,0,0]=4 22217 B18R2.6463 CC(OCc1ccccn1)c2cncc(c2)Br 7a_100012351597_100000721315 [0,2,0,0,0,0|2,0,0]=4 22218 B18R2.6463 CC(OCc1cccnc1)c2cc(ccn2)Cl 7a_100000144657_100000741622 [0,2,0,0,0,0|2,0,0]=4 22219 B18R2.6463 CC(OCc1cccnc1)c2cccc(c2)Br 34a_100000246457_100000733263 [0,2,0,0,0,0|1,0,0]=3 22220 B18R2.6463 CC(OCc1cccnc1)c2cccc(c2)Br 7a_100000246457_100000741622 [0,2,0,0,0,0|1,0,0]=3 22221 B18R2.6463 CC(OCc1cccnc1)c2cccc(c2)F 34a_100000744526_100000733263 [0,2,0,0,0,0|1,0,0]=3 22222 B18R2.6463 CC(OCc1cccnc1)c2cccc(c2)F 7a_100000744526_100000741622 [0,2,0,0,0,0|1,0,0]=3 22223 B18R2.6463 CC(OCc1cccnc1)c2cccc(c2)I 34a_100013085317_100000733263 [0,2,0,0,0,0|1,0,0]=3 22224 B18R2.6463 CC(OCc1cccnc1)c2cccc(c2)I 7a_100013085317_100000741622 [0,2,0,0,0,0|1,0,0]=3 22225 B18R2.6463 CC(OCc1cccnc1)c2cccc(c2)N 34a_100011217120_100000733263 [0,2,0,0,0,0|1,0,0]=3 22226 B18R2.6463 CC(OCc1cccnc1)c2cccc(c2)N 7a_100011217120_100000741622 [0,2,0,0,0,0|1,0,0]=3 22227 B18R2.6463 CC(OCc1cccnc1)c2cccc(n2)Br 7a_100009820884_100000741622 [0,2,0,0,0,0|2,0,0]=4 22228 B18R2.6463 CC(OCc1cccnc1)c2cncc(c2)Br 34a_100012351597_100000733263 [0,2,0,0,0,0|2,0,0]=4 22229 B18R2.6463 CC(OCc1cccnc1)c2cncc(c2)Br 7a_100012351597_100000741622 [0,2,0,0,0,0|2,0,0]=4 22230 B18R2.6463 CC(OCc1cccnn1)c2cccc(c2)Br 34a_100000246457_100016990269 [0,2,0,0,0,0|2,0,0]=4 22231 B18R2.6463 CC(OCc1cccnn1)c2cccc(c2)Br 7a_100000246457_100016990269 [0,2,0,0,0,0|2,0,0]=4 22232 B18R2.6463 CC(OCc1cccnn1)c2cccc(c2)F 34a_100000744526_100016990269 [0,2,0,0,0,0|2,0,0]=4 22233 B18R2.6463 CC(OCc1cccnn1)c2cccc(c2)F 7a_100000744526_100016990269 [0,2,0,0,0,0|2,0,0]=4 22234 B18R2.6463 CC(OCc1cccnn1)c2cccc(c2)I 34a_100013085317_100016990269 [0,2,0,0,0,0|2,0,0]=4 22235 B18R2.6463 CC(OCc1cccnn1)c2cccc(c2)I 7a_100013085317_100016990269 [0,2,0,0,0,0|2,0,0]=4 22236 B18R2.6463 CC(OCc1cccnn1)c2cccc(c2)N 34a_100011217120_100016990269 [0,2,0,0,0,0|2,0,0]=4 22237 B18R2.6463 CC(OCc1cccnn1)c2cccc(c2)N 7a_100011217120_100016990269 [0,2,0,0,0,0|2,0,0]=4 22238 B18R2.6463 CC(OCc1ccncc1)c2cc(ccn2)Cl 7a_100000144657_100015193705 [0,2,0,0,0,0|2,0,0]=4 22239 B18R2.6463 CC(OCc1ccncc1)c2cccc(c2)Br 7a_100000246457_100015193705 [0,2,0,0,0,0|1,0,0]=3 22240 B18R2.6463 CC(OCc1ccncc1)c2cccc(c2)F 7a_100000744526_100015193705 [0,2,0,0,0,0|1,0,0]=3 22241 B18R2.6463 CC(OCc1ccncc1)c2cccc(c2)I 7a_100013085317_100015193705 [0,2,0,0,0,0|1,0,0]=3 22242 B18R2.6463 CC(OCc1ccncc1)c2cccc(c2)N 7a_100011217120_100015193705 [0,2,0,0,0,0|1,0,0]=3 22243 B18R2.6463 CC(OCc1ccncc1)c2cccc(n2)Br 7a_100009820884_100015193705 [0,2,0,0,0,0|2,0,0]=4 22244 B18R2.6463 CC(OCc1ccncc1)c2cncc(c2)Br 7a_100012351597_100015193705 [0,2,0,0,0,0|2,0,0]=4 22245 B18R2.6463 CC(OCc1cnccn1)c2cccc(c2)Br 34a_100000246457_100016995436 [0,2,0,0,0,0|2,0,0]=4 22246 B18R2.6463 CC(OCc1cnccn1)c2cccc(c2)Br 7a_100000246457_100016995436 [0,2,0,0,0,0|2,0,0]=4 22247 B18R2.6463 CC(OCc1cnccn1)c2cccc(c2)F 34a_100000744526_100016995436 [0,2,0,0,0,0|2,0,0]=4 22248 B18R2.6463 CC(OCc1cnccn1)c2cccc(c2)F 7a_100000744526_100016995436 [0,2,0,0,0,0|2,0,0]=4 22249 B18R2.6463 CC(OCc1cnccn1)c2cccc(c2)I 34a_100013085317_100016995436 [0,2,0,0,0,0|2,0,0]=4 22250 B18R2.6463 CC(OCc1cnccn1)c2cccc(c2)I 7a_100013085317_100016995436 [0,2,0,0,0,0|2,0,0]=4 22251 B18R2.6463 CC(OCc1cnccn1)c2cccc(c2)N 34a_100011217120_100016995436 [0,2,0,0,0,0|2,0,0]=4 22252 B18R2.6463 CC(OCc1cnccn1)c2cccc(c2)N 7a_100011217120_100016995436 [0,2,0,0,0,0|2,0,0]=4 22253 B18R2.6463 CC(OCc1cncnc1)c2cccc(c2)Br 34a_100000246457_100015196519 [0,2,0,0,0,0|2,0,0]=4 22254 B18R2.6463 CC(OCc1cncnc1)c2cccc(c2)Br 7a_100000246457_100015196519 [0,2,0,0,0,0|2,0,0]=4 22255 B18R2.6463 CC(OCc1cncnc1)c2cccc(c2)F 34a_100000744526_100015196519 [0,2,0,0,0,0|2,0,0]=4 22256 B18R2.6463 CC(OCc1cncnc1)c2cccc(c2)F 7a_100000744526_100015196519 [0,2,0,0,0,0|2,0,0]=4 22257 B18R2.6463 CC(OCc1cncnc1)c2cccc(c2)I 34a_100013085317_100015196519 [0,2,0,0,0,0|2,0,0]=4 22258 B18R2.6463 CC(OCc1cncnc1)c2cccc(c2)I 7a_100013085317_100015196519 [0,2,0,0,0,0|2,0,0]=4 22259 B18R2.6463 CC(OCc1cncnc1)c2cccc(c2)N 34a_100011217120_100015196519 [0,2,0,0,0,0|2,0,0]=4 22260 B18R2.6463 CC(OCc1cncnc1)c2cccc(c2)N 7a_100011217120_100015196519 [0,2,0,0,0,0|2,0,0]=4 22261 B18R2.6463 CC(OCc1ncccn1)c2cccc(c2)Br 34a_100000246457_100000703007 [0,2,0,0,0,0|2,0,0]=4 22262 B18R2.6463 CC(OCc1ncccn1)c2cccc(c2)Br 7a_100000246457_100000703007 [0,2,0,0,0,0|2,0,0]=4 22263 B18R2.6463 CC(OCc1ncccn1)c2cccc(c2)F 34a_100000744526_100000703007 [0,2,0,0,0,0|2,0,0]=4 22264 B18R2.6463 CC(OCc1ncccn1)c2cccc(c2)F 7a_100000744526_100000703007 [0,2,0,0,0,0|2,0,0]=4 22265 B18R2.6463 CC(OCc1ncccn1)c2cccc(c2)I 34a_100013085317_100000703007 [0,2,0,0,0,0|2,0,0]=4 22266 B18R2.6463 CC(OCc1ncccn1)c2cccc(c2)I 7a_100013085317_100000703007 [0,2,0,0,0,0|2,0,0]=4 22267 B18R2.6463 CC(OCc1ncccn1)c2cccc(c2)N 34a_100011217120_100000703007 [0,2,0,0,0,0|2,0,0]=4 22268 B18R2.6463 CC(OCc1ncccn1)c2cccc(c2)N 7a_100011217120_100000703007 [0,2,0,0,0,0|2,0,0]=4 22269 B18R2.6463 CN(CCc1ccccc1)c2cccc(c2)Br 2230a_100000219648_100000765856 [0,2,0,0,0,0|2,0,0]=4 22270 B18R2.6463 CN(CCc1ccccc1)c2cccc(c2)Br 269982a_100000219648_100000765856 [0,2,0,0,0,0|2,0,0]=4 22271 B18R2.6463 CN(CCc1ccccc1)c2cccc(c2)Br 34a_100000219648_100000765856 [0,2,0,0,0,0|2,0,0]=4 22272 B18R2.6463 CN(CCc1ccccc1)c2cccc(c2)Cl 2230a_100000220044_100000765856 [0,2,0,0,0,0|2,0,0]=4 22273 B18R2.6463 CN(CCc1ccccc1)c2cccc(c2)Cl 269982a_100000220044_100000765856 [0,2,0,0,0,0|2,0,0]=4 22274 B18R2.6463 CN(CCc1ccccc1)c2cccc(c2)Cl 34a_100000220044_100000765856 [0,2,0,0,0,0|2,0,0]=4 22275 B18R2.6463 CN(CCc1ccccc1)c2cccc(c2)F 2230a_100020633736_100000765856 [0,2,0,0,0,0|2,0,0]=4 22276 B18R2.6463 CN(CCc1ccccc1)c2cccc(c2)F 269982a_100020633736_100000765856 [0,2,0,0,0,0|2,0,0]=4 22277 B18R2.6463 CN(CCc1ccccc1)c2cccc(c2)F 34a_100020633736_100000765856 [0,2,0,0,0,0|2,0,0]=4 22278 B18R2.6463 CN(CCc1ccccc1)c2cccc(c2)I 2230a_100000221217_100000765856 [0,2,0,0,0,0|2,0,0]=4 22279 B18R2.6463 CN(CCc1ccccc1)c2cccc(c2)I 269982a_100000221217_100000765856 [0,2,0,0,0,0|2,0,0]=4 22280 B18R2.6463 CN(CCc1ccccc1)c2cccc(c2)I 34a_100000221217_100000765856 [0,2,0,0,0,0|2,0,0]=4 22281 B18R2.6463 CN(CCc1ccccc1)c2cccc(c2)O 2230a_100000756613_100000765856 [0,2,0,0,0,0|2,0,0]=4 22282 B18R2.6463 CN(CCc1ccccc1)c2cccc(c2)O 269982a_100000756613_100000765856 [0,2,0,0,0,0|2,0,0]=4 22283 B18R2.6463 CN(CCc1ccccc1)c2cccc(c2)O 34a_100000756613_100000765856 [0,2,0,0,0,0|2,0,0]=4 22284 B18R2.6463 C[C@@H](NCc1ccccc1)c2cccc(c2)F 207a_100015193778_100015611070 [0,2,0,0,0,0|1,0,0]=3 22285 B18R2.6463 C[C@@H](NCc1ccccc1)c2cccc(c2)F 2230a_100015193778_100015291786 [0,2,0,0,0,0|1,0,0]=3 22286 B18R2.6463 C[C@@H](NCc1ccccc1)c2cccc(c2)F 270004a_100015193778_100015611070 [0,2,0,0,0,0|1,0,0]=3 22287 B18R2.6463 C[C@@H](NCc1ccccc1)c2cccc(c2)F 34a_100015193778_100015291786 [0,2,0,0,0,0|1,0,0]=3 22288 B18R2.6463 C[C@@H](NCc1ccccc1)c2cncc(c2)Br 207a_100012350620_100015611070 [0,2,0,0,0,0|2,0,0]=4 22289 B18R2.6463 C[C@@H](NCc1ccccc1)c2cncc(c2)Br 2230a_100012350620_100015291786 [0,2,0,0,0,0|2,0,0]=4 22290 B18R2.6463 C[C@@H](NCc1ccccc1)c2cncc(c2)Br 270004a_100012350620_100015611070 [0,2,0,0,0,0|2,0,0]=4 22291 B18R2.6463 C[C@@H](NCc1ccccn1)c2cccc(c2)F 207a_100015193778_100000209966 [0,2,0,0,0,0|2,0,0]=4 22292 B18R2.6463 C[C@@H](NCc1ccccn1)c2cccc(c2)F 2230a_100015193778_100000721315 [0,2,0,0,0,0|2,0,0]=4 22293 B18R2.6463 C[C@@H](NCc1ccccn1)c2cccc(c2)F 270004a_100015193778_100000209966 [0,2,0,0,0,0|2,0,0]=4 22294 B18R2.6463 C[C@@H](NCc1ccccn1)c2cccc(c2)F 34a_100015193778_100000721315 [0,2,0,0,0,0|2,0,0]=4 22295 B18R2.6463 C[C@@H](NCc1cccnc1)c2cccc(c2)F 207a_100015193778_100000209961 [0,2,0,0,0,0|2,0,0]=4 22296 B18R2.6463 C[C@@H](NCc1cccnc1)c2cccc(c2)F 2230a_100015193778_100000741622 [0,2,0,0,0,0|2,0,0]=4 22297 B18R2.6463 C[C@@H](NCc1cccnc1)c2cccc(c2)F 270004a_100015193778_100000209961 [0,2,0,0,0,0|2,0,0]=4 22298 B18R2.6463 C[C@@H](NCc1cccnc1)c2cccc(c2)F 34a_100015193778_100000733263 [0,2,0,0,0,0|2,0,0]=4 22299 B18R2.6463 C[C@@H](NCc1ccncc1)c2cccc(c2)F 207a_100015193778_100000186114 [0,2,0,0,0,0|2,0,0]=4 22300 B18R2.6463 C[C@@H](NCc1ccncc1)c2cccc(c2)F 2230a_100015193778_100015193705 [0,2,0,0,0,0|2,0,0]=4 22301 B18R2.6463 C[C@@H](OCc1ccccc1)c2cccc(c2)Cl 34a_100000747380_100015291786 [0,2,0,0,0,0|0,0,0]=2 22302 B18R2.6463 C[C@@H](OCc1ccccc1)c2cccc(c2)Cl 7a_100000747380_100000211182 [0,2,0,0,0,0|0,0,0]=2 22303 B18R2.6463 C[C@@H](OCc1ccccn1)c2cccc(c2)Cl 34a_100000747380_100000721315 [0,2,0,0,0,0|1,0,0]=3 22304 B18R2.6463 C[C@@H](OCc1ccccn1)c2cccc(c2)Cl 7a_100000747380_100000721315 [0,2,0,0,0,0|1,0,0]=3 22305 B18R2.6463 C[C@@H](OCc1cccnc1)c2cccc(c2)Cl 34a_100000747380_100000733263 [0,2,0,0,0,0|1,0,0]=3 22306 B18R2.6463 C[C@@H](OCc1cccnc1)c2cccc(c2)Cl 7a_100000747380_100000741622 [0,2,0,0,0,0|1,0,0]=3 22307 B18R2.6463 C[C@@H](OCc1cccnn1)c2cccc(c2)Cl 34a_100000747380_100016990269 [0,2,0,0,0,0|2,0,0]=4 22308 B18R2.6463 C[C@@H](OCc1cccnn1)c2cccc(c2)Cl 7a_100000747380_100016990269 [0,2,0,0,0,0|2,0,0]=4 22309 B18R2.6463 C[C@@H](OCc1ccncc1)c2cccc(c2)Cl 7a_100000747380_100015193705 [0,2,0,0,0,0|1,0,0]=3 22310 B18R2.6463 C[C@@H](OCc1cnccn1)c2cccc(c2)Cl 34a_100000747380_100016995436 [0,2,0,0,0,0|2,0,0]=4 22311 B18R2.6463 C[C@@H](OCc1cnccn1)c2cccc(c2)Cl 7a_100000747380_100016995436 [0,2,0,0,0,0|2,0,0]=4 22312 B18R2.6463 C[C@@H](OCc1cncnc1)c2cccc(c2)Cl 34a_100000747380_100015196519 [0,2,0,0,0,0|2,0,0]=4 22313 B18R2.6463 C[C@@H](OCc1cncnc1)c2cccc(c2)Cl 7a_100000747380_100015196519 [0,2,0,0,0,0|2,0,0]=4 22314 B18R2.6463 C[C@@H](OCc1ncccn1)c2cccc(c2)Cl 34a_100000747380_100000703007 [0,2,0,0,0,0|2,0,0]=4 22315 B18R2.6463 C[C@@H](OCc1ncccn1)c2cccc(c2)Cl 7a_100000747380_100000703007 [0,2,0,0,0,0|2,0,0]=4 22316 B18R2.6463 C[C@H](NCc1ccccc1)c2cccc(n2)F 2230a_100025709760_100015291786 [0,2,0,0,0,0|2,0,0]=4 22317 B18R2.6463 C[C@H](NCc1ccccc1)c2cccc(n2)F 270004a_100025709760_100015611070 [0,2,0,0,0,0|2,0,0]=4 22318 B18R2.6463 C[C@H](NCc1ccccc1)c2cccc(n2)F 34a_100025709760_100015291786 [0,2,0,0,0,0|2,0,0]=4 22319 B18R2.6463 Cc1cc(ccn1)C(C)NCc2ccccc2 269862a_100015324214_100011998260 [0,2,0,0,0,0|2,0,0]=4 22320 B18R2.6463 Cc1cccc(c1)C(=O)CCc2ccccc2 1458a_100000189346_100000765856 [0,2,0,0,0,0|1,0,1]=4 22321 B18R2.6463 Cc1cccc(c1)C(=O)NCc2ccccc2 11a_100015324214_100000189346 [0,2,0,0,0,0|1,0,1]=4 22322 B18R2.6463 Cc1cccc(c1)C(=O)NCc2ccccc2 1626a_100015324214_100000189346 [0,2,0,0,0,0|1,0,1]=4 22323 B18R2.6463 Cc1cccc(c1)C(=O)NCc2ccccc2 240690a_100015324214_100000189346 [0,2,0,0,0,0|1,0,1]=4 22324 B18R2.6463 Cc1cccc(c1)C(=O)NCc2ccccc2 527a_100015324214_100000189346 [0,2,0,0,0,0|1,0,1]=4 22325 B18R2.6463 Cc1cccc(c1)C(C)NCc2ccccc2 269862a_100015324214_100000211476 [0,2,0,0,0,0|1,0,0]=3 22326 B18R2.6463 Cc1cccc(c1)C(C)NCc2cccnc2 269862a_100000210453_100000211476 [0,2,0,0,0,0|2,0,0]=4 22327 B18R2.6463 Cc1cccc(c1)C(C)NCc2ccncc2 269862a_100000210450_100000211476 [0,2,0,0,0,0|2,0,0]=4 22328 B18R2.6463 Cc1cccc(c1)C(C)OCc2ccccc2 34a_100000757818_100015291786 [0,2,0,0,0,0|0,0,0]=2 22329 B18R2.6463 Cc1cccc(c1)C(C)OCc2ccccc2 7a_100000757818_100000211182 [0,2,0,0,0,0|0,0,0]=2 22330 B18R2.6463 Cc1cccc(c1)C(C)OCc2ccccn2 34a_100000757818_100000721315 [0,2,0,0,0,0|1,0,0]=3 22331 B18R2.6463 Cc1cccc(c1)C(C)OCc2ccccn2 7a_100000757818_100000721315 [0,2,0,0,0,0|1,0,0]=3 22332 B18R2.6463 Cc1cccc(c1)C(C)OCc2cccnc2 34a_100000757818_100000733263 [0,2,0,0,0,0|1,0,0]=3 22333 B18R2.6463 Cc1cccc(c1)C(C)OCc2cccnc2 7a_100000757818_100000741622 [0,2,0,0,0,0|1,0,0]=3 22334 B18R2.6463 Cc1cccc(c1)C(C)OCc2cccnn2 34a_100000757818_100016990269 [0,2,0,0,0,0|2,0,0]=4 22335 B18R2.6463 Cc1cccc(c1)C(C)OCc2cccnn2 7a_100000757818_100016990269 [0,2,0,0,0,0|2,0,0]=4 22336 B18R2.6463 Cc1cccc(c1)C(C)OCc2ccncc2 7a_100000757818_100015193705 [0,2,0,0,0,0|1,0,0]=3 22337 B18R2.6463 Cc1cccc(c1)C(C)OCc2cnccn2 34a_100000757818_100016995436 [0,2,0,0,0,0|2,0,0]=4 22338 B18R2.6463 Cc1cccc(c1)C(C)OCc2cnccn2 7a_100000757818_100016995436 [0,2,0,0,0,0|2,0,0]=4 22339 B18R2.6463 Cc1cccc(c1)C(C)OCc2cncnc2 34a_100000757818_100015196519 [0,2,0,0,0,0|2,0,0]=4 22340 B18R2.6463 Cc1cccc(c1)C(C)OCc2cncnc2 7a_100000757818_100015196519 [0,2,0,0,0,0|2,0,0]=4 22341 B18R2.6463 Cc1cccc(c1)C(C)OCc2ncccn2 34a_100000757818_100000703007 [0,2,0,0,0,0|2,0,0]=4 22342 B18R2.6463 Cc1cccc(c1)C(C)OCc2ncccn2 7a_100000757818_100000703007 [0,2,0,0,0,0|2,0,0]=4 22343 B18R2.6463 Cc1cccc(c1)N(C)CCc2ccccc2 2230a_100000219674_100000765856 [0,2,0,0,0,0|2,0,0]=4 22344 B18R2.6463 Cc1cccc(c1)N(C)CCc2ccccc2 269982a_100000219674_100000765856 [0,2,0,0,0,0|2,0,0]=4 22345 B18R2.6463 Cc1cccc(c1)N(C)CCc2ccccc2 34a_100000219674_100000765856 [0,2,0,0,0,0|2,0,0]=4 22346 B18R2.6463 Cc1cccc(c1)[C@@H](C)NCc2ccccc2 207a_100000698126_100015611070 [0,2,0,0,0,0|1,0,0]=3 22347 B18R2.6463 Cc1cccc(c1)[C@@H](C)NCc2ccccc2 2230a_100000698126_100015291786 [0,2,0,0,0,0|1,0,0]=3 22348 B18R2.6463 Cc1cccc(c1)[C@@H](C)NCc2ccccc2 270004a_100000698126_100015611070 [0,2,0,0,0,0|1,0,0]=3 22349 B18R2.6463 Cc1cccc(c1)[C@@H](C)NCc2ccccc2 34a_100000698126_100015291786 [0,2,0,0,0,0|1,0,0]=3 22350 B18R2.6463 Cc1cccc(c1)[C@@H](C)NCc2ccccn2 207a_100000698126_100000209966 [0,2,0,0,0,0|2,0,0]=4 22351 B18R2.6463 Cc1cccc(c1)[C@@H](C)NCc2ccccn2 2230a_100000698126_100000721315 [0,2,0,0,0,0|2,0,0]=4 22352 B18R2.6463 Cc1cccc(c1)[C@@H](C)NCc2ccccn2 270004a_100000698126_100000209966 [0,2,0,0,0,0|2,0,0]=4 22353 B18R2.6463 Cc1cccc(c1)[C@@H](C)NCc2ccccn2 34a_100000698126_100000721315 [0,2,0,0,0,0|2,0,0]=4 22354 B18R2.6463 Cc1cccc(c1)[C@@H](C)NCc2cccnc2 207a_100000698126_100000209961 [0,2,0,0,0,0|2,0,0]=4 22355 B18R2.6463 Cc1cccc(c1)[C@@H](C)NCc2cccnc2 2230a_100000698126_100000741622 [0,2,0,0,0,0|2,0,0]=4 22356 B18R2.6463 Cc1cccc(c1)[C@@H](C)NCc2cccnc2 270004a_100000698126_100000209961 [0,2,0,0,0,0|2,0,0]=4 22357 B18R2.6463 Cc1cccc(c1)[C@@H](C)NCc2cccnc2 34a_100000698126_100000733263 [0,2,0,0,0,0|2,0,0]=4 22358 B18R2.6463 Cc1cccc(c1)[C@@H](C)NCc2ccncc2 207a_100000698126_100000186114 [0,2,0,0,0,0|2,0,0]=4 22359 B18R2.6463 Cc1cccc(c1)[C@@H](C)NCc2ccncc2 2230a_100000698126_100015193705 [0,2,0,0,0,0|2,0,0]=4 22360 B18R2.6463 Cc1cccc(n1)C(C)NCc2ccccc2 207a_100011877385_100015611070 [0,2,0,0,0,0|2,0,0]=4 22361 B18R2.6463 Cc1cccc(n1)C(C)NCc2ccccc2 2230a_100011877385_100015291786 [0,2,0,0,0,0|2,0,0]=4 22362 B18R2.6463 Cc1cccc(n1)C(C)NCc2ccccc2 269862a_100015324214_100011877301 [0,2,0,0,0,0|2,0,0]=4 22363 B18R2.6463 Cc1cccc(n1)C(C)NCc2ccccc2 270004a_100011877385_100015611070 [0,2,0,0,0,0|2,0,0]=4 22364 B18R2.6463 Cc1cccc(n1)C(C)OCc2ccccc2 34a_200011877368_100015291786 [0,2,0,0,0,0|1,0,0]=3 22365 B18R2.6463 Cc1cccc(n1)C(C)OCc2ccccc2 7a_200011877368_100000211182 [0,2,0,0,0,0|1,0,0]=3 22366 B18R2.6463 Cc1cccc(n1)C(C)OCc2ccccn2 34a_200011877368_100000721315 [0,2,0,0,0,0|2,0,0]=4 22367 B18R2.6463 Cc1cccc(n1)C(C)OCc2ccccn2 7a_200011877368_100000721315 [0,2,0,0,0,0|2,0,0]=4 22368 B18R2.6463 Cc1cccc(n1)C(C)OCc2cccnc2 34a_200011877368_100000733263 [0,2,0,0,0,0|2,0,0]=4 22369 B18R2.6463 Cc1cccc(n1)C(C)OCc2cccnc2 7a_200011877368_100000741622 [0,2,0,0,0,0|2,0,0]=4 22370 B18R2.6463 Cc1cccc(n1)C(C)OCc2ccncc2 7a_200011877368_100015193705 [0,2,0,0,0,0|2,0,0]=4 22371 B18R2.6463 Cc1ccnc(c1)C(C)NCc2ccccc2 207a_100011933787_100015611070 [0,2,0,0,0,0|2,0,0]=4 22372 B18R2.6463 Cc1ccnc(c1)C(C)NCc2ccccc2 2230a_100011933787_100015291786 [0,2,0,0,0,0|2,0,0]=4 22373 B18R2.6463 Cc1ccnc(c1)C(C)NCc2ccccc2 269862a_100015324214_100000728896 [0,2,0,0,0,0|2,0,0]=4 22374 B18R2.6463 Cc1ccnc(c1)C(C)NCc2ccccc2 270004a_100011933787_100015611070 [0,2,0,0,0,0|2,0,0]=4 22375 B18R2.6463 Cc1ccnc(c1)C(C)NCc2ccccc2 270004a_100015324214_100000728896 [0,2,0,0,0,0|2,0,0]=4 22376 B18R2.6463 Cc1cncc(c1)C(C)NCc2ccccc2 269862a_100015324214_100000702010 [0,2,0,0,0,0|2,0,0]=4 22377 B18R2.6463 O=C(CCc1ccccc1)c2cccc(c2)Br 1458a_100000210664_100000765856 [0,2,0,0,0,0|1,0,1]=4 22378 B18R2.6463 O=C(CCc1ccccc1)c2cccc(c2)Cl 1458a_100000210390_100000765856 [0,2,0,0,0,0|1,0,1]=4 22379 B18R2.6463 O=C(CCc1ccccc1)c2cccc(c2)F 1458a_100000210950_100000765856 [0,2,0,0,0,0|1,0,1]=4 22380 B18R2.6463 O=C(CCc1ccccc1)c2cccc(c2)I 1458a_100000184098_100000765856 [0,2,0,0,0,0|1,0,1]=4 22381 B18R2.6463 O=C(CCc1ccccc1)c2cccc(c2)O 1458a_100000183914_100000765856 [0,2,0,0,0,0|1,0,1]=4 22382 B18R2.6463 O=C(NCc1ccccc1)c2cccc(c2)Br 11a_100015324214_100000210664 [0,2,0,0,0,0|1,0,1]=4 22383 B18R2.6463 O=C(NCc1ccccc1)c2cccc(c2)Br 1626a_100015324214_100000210664 [0,2,0,0,0,0|1,0,1]=4 22384 B18R2.6463 O=C(NCc1ccccc1)c2cccc(c2)Br 240690a_100015324214_100000210664 [0,2,0,0,0,0|1,0,1]=4 22385 B18R2.6463 O=C(NCc1ccccc1)c2cccc(c2)Br 527a_100015324214_100000210664 [0,2,0,0,0,0|1,0,1]=4 22386 B18R2.6463 O=C(NCc1ccccc1)c2cccc(c2)Cl 11a_100015324214_100000210390 [0,2,0,0,0,0|1,0,1]=4 22387 B18R2.6463 O=C(NCc1ccccc1)c2cccc(c2)Cl 1626a_100015324214_100000210390 [0,2,0,0,0,0|1,0,1]=4 22388 B18R2.6463 O=C(NCc1ccccc1)c2cccc(c2)Cl 240690a_100015324214_100000210390 [0,2,0,0,0,0|1,0,1]=4 22389 B18R2.6463 O=C(NCc1ccccc1)c2cccc(c2)Cl 527a_100015324214_100000210390 [0,2,0,0,0,0|1,0,1]=4 22390 B18R2.6463 O=C(NCc1ccccc1)c2cccc(c2)F 11a_100015324214_100000210950 [0,2,0,0,0,0|1,0,1]=4 22391 B18R2.6463 O=C(NCc1ccccc1)c2cccc(c2)F 1626a_100015324214_100000210950 [0,2,0,0,0,0|1,0,1]=4 22392 B18R2.6463 O=C(NCc1ccccc1)c2cccc(c2)F 240690a_100015324214_100000210950 [0,2,0,0,0,0|1,0,1]=4 22393 B18R2.6463 O=C(NCc1ccccc1)c2cccc(c2)F 527a_100015324214_100000210950 [0,2,0,0,0,0|1,0,1]=4 22394 B18R2.6463 O=C(NCc1ccccc1)c2cccc(c2)I 11a_100015324214_100000184098 [0,2,0,0,0,0|1,0,1]=4 22395 B18R2.6463 O=C(NCc1ccccc1)c2cccc(c2)I 1626a_100015324214_100000184098 [0,2,0,0,0,0|1,0,1]=4 22396 B18R2.6463 O=C(NCc1ccccc1)c2cccc(c2)I 240690a_100015324214_100000184098 [0,2,0,0,0,0|1,0,1]=4 22397 B18R2.6463 O=C(NCc1ccccc1)c2cccc(c2)I 527a_100015324214_100000184098 [0,2,0,0,0,0|1,0,1]=4 22398 B18R2.6463 O=C(NCc1ccccc1)c2cccc(c2)O 240690a_100015324214_100000183914 [0,2,0,0,0,0|1,0,1]=4 22399 B18R2.6463 O=C(NCc1ccccc1)c2cccc(c2)O 271570a_203496583355_200000153165 [0,2,0,0,0,0|1,0,1]=4 22400 B18R2.6463 O=C(NCc1ccccc1)c2cccc(c2)O 527a_100015324214_100000183914 [0,2,0,0,0,0|1,0,1]=4 22401 B18R2.6463 O=C(OCc1ccccc1)c2cc(ccn2)O 271570a_203496583355_200045471927 [0,2,0,0,0,0|1,0,1]=4 22402 B18R2.6463 O=C(OCc1ccccc1)c2ccnc(c2)O 271570a_203496583355_200012776275 [0,2,0,0,0,0|1,0,1]=4 22403 B18R2.6467 CC(CNc1cccc(c1)Br)c2ccccc2 34a_100000210019_100000756946 [0,2,0,0,0,0|2,0,0]=4 22404 B18R2.6467 CC(CNc1cccc(c1)Cl)c2ccccc2 34a_100000185859_100000756946 [0,2,0,0,0,0|2,0,0]=4 22405 B18R2.6467 CC(CNc1cccc(c1)F)c2ccccc2 34a_100000210047_100000756946 [0,2,0,0,0,0|2,0,0]=4 22406 B18R2.6467 CC(CNc1cccc(c1)I)c2ccccc2 34a_100000211102_100000756946 [0,2,0,0,0,0|2,0,0]=4 22407 B18R2.6467 CC(CNc1cccc(c1)O)c2ccccc2 34a_100000210217_100000756946 [0,2,0,0,0,0|2,0,0]=4 22408 B18R2.6467 CC(COc1cccc(c1)Br)c2ccccc2 34a_100000210342_100000756946 [0,2,0,0,0,0|2,0,0]=4 22409 B18R2.6467 CC(COc1cccc(c1)Br)c2ccccc2 7a_100000210342_100000756946 [0,2,0,0,0,0|2,0,0]=4 22410 B18R2.6467 CC(COc1cccc(c1)Cl)c2ccccc2 34a_100000210295_100000756946 [0,2,0,0,0,0|2,0,0]=4 22411 B18R2.6467 CC(COc1cccc(c1)Cl)c2ccccc2 7a_100000210295_100000756946 [0,2,0,0,0,0|2,0,0]=4 22412 B18R2.6467 CC(COc1cccc(c1)F)c2ccccc2 34a_100000210426_100000756946 [0,2,0,0,0,0|2,0,0]=4 22413 B18R2.6467 CC(COc1cccc(c1)F)c2ccccc2 7a_100000210426_100000756946 [0,2,0,0,0,0|2,0,0]=4 22414 B18R2.6467 CC(COc1cccc(c1)I)c2ccccc2 34a_100000211634_100000756946 [0,2,0,0,0,0|2,0,0]=4 22415 B18R2.6467 CC(COc1cccc(c1)I)c2ccccc2 7a_100000211634_100000756946 [0,2,0,0,0,0|2,0,0]=4 22416 B18R2.6467 CC(COc1cccc(c1)N)c2ccccc2 34a_100000210217_100000756946 [0,2,0,0,0,0|2,0,0]=4 22417 B18R2.6467 CC(CSc1cccc(c1)Br)c2ccccc2 62a_100000691529_100000756946 [0,2,0,0,0,0|2,0,0]=4 22418 B18R2.6467 CC(CSc1cccc(c1)Br)c2ccccc2 62a_100000756946_100000691529 [0,2,0,0,0,0|2,0,0]=4 22419 B18R2.6467 CC(CSc1cccc(c1)Cl)c2ccccc2 62a_100000699651_100000756946 [0,2,0,0,0,0|2,0,0]=4 22420 B18R2.6467 CC(CSc1cccc(c1)Cl)c2ccccc2 62a_100000756946_100000699651 [0,2,0,0,0,0|2,0,0]=4 22421 B18R2.6467 CC(CSc1cccc(c1)F)c2ccccc2 62a_100000685547_100000756946 [0,2,0,0,0,0|2,0,0]=4 22422 B18R2.6467 CC(CSc1cccc(c1)F)c2ccccc2 62a_100000756946_100000685547 [0,2,0,0,0,0|2,0,0]=4 22423 B18R2.6467 CC(CSc1cccc(c1)N)c2ccccc2 62a_100000210019_100000756946 [0,2,0,0,0,0|2,0,0]=4 22424 B18R2.6467 CC(CSc1cccc(c1)N)c2ccccc2 62a_100000756946_100000210019 [0,2,0,0,0,0|2,0,0]=4 22425 B18R2.6467 CC(CSc1cccc(c1)O)c2ccccc2 62a_100000756946_100000211634 [0,2,0,0,0,0|2,0,0]=4 22426 B18R2.6467 CC(CSc1cccc(c1)[S])c2ccccc2 62a_100000756946_114929384022 [0,2,0,0,0,0|2,0,0]=4 22427 B18R2.6467 CC(CSc1cccc(c1)[S])c2ccccc2 62a_114929384022_100000756946 [0,2,0,0,0,0|2,0,0]=4 22428 B18R2.6467 CC(NCc1cccc(=O)[nH]1)c2ccccc2 2230a_100000696482_100000230085 [0,2,0,0,0,0|2,0,0]=4 22429 B18R2.6467 CC(NCc1cccc(c1)Br)c2ccccc2 2230a_100000174977_100000230085 [0,2,0,0,0,0|1,0,0]=3 22430 B18R2.6467 CC(NCc1cccc(c1)Br)c2ccccc2 269862a_100000174977_100000185851 [0,2,0,0,0,0|1,0,0]=3 22431 B18R2.6467 CC(NCc1cccc(c1)Br)c2ccccc2 34a_100000174977_100000211855 [0,2,0,0,0,0|1,0,0]=3 22432 B18R2.6467 CC(NCc1cccc(c1)Br)c2ccccn2 207a_100000181244_100000210085 [0,2,0,0,0,0|2,0,0]=4 22433 B18R2.6467 CC(NCc1cccc(c1)Br)c2ccccn2 2230a_100000181244_100000698116 [0,2,0,0,0,0|2,0,0]=4 22434 B18R2.6467 CC(NCc1cccc(c1)Br)c2ccccn2 269862a_100000174977_100000210467 [0,2,0,0,0,0|2,0,0]=4 22435 B18R2.6467 CC(NCc1cccc(c1)Br)c2ccccn2 270004a_100000181244_100000210085 [0,2,0,0,0,0|2,0,0]=4 22436 B18R2.6467 CC(NCc1cccc(c1)Br)c2cccnc2 207a_100000195435_100000210085 [0,2,0,0,0,0|2,0,0]=4 22437 B18R2.6467 CC(NCc1cccc(c1)Br)c2cccnc2 2230a_100000195435_100000698116 [0,2,0,0,0,0|2,0,0]=4 22438 B18R2.6467 CC(NCc1cccc(c1)Br)c2cccnc2 269862a_100000174977_100000210468 [0,2,0,0,0,0|2,0,0]=4 22439 B18R2.6467 CC(NCc1cccc(c1)Br)c2cccnc2 270004a_100000195435_100000210085 [0,2,0,0,0,0|2,0,0]=4 22440 B18R2.6467 CC(NCc1cccc(c1)Br)c2ccncc2 207a_100000181269_100000210085 [0,2,0,0,0,0|2,0,0]=4 22441 B18R2.6467 CC(NCc1cccc(c1)Br)c2ccncc2 2230a_100000181269_100000698116 [0,2,0,0,0,0|2,0,0]=4 22442 B18R2.6467 CC(NCc1cccc(c1)Br)c2ccncc2 269862a_100000174977_100000185792 [0,2,0,0,0,0|2,0,0]=4 22443 B18R2.6467 CC(NCc1cccc(c1)Br)c2ccncc2 270004a_100000181269_100000210085 [0,2,0,0,0,0|2,0,0]=4 22444 B18R2.6467 CC(NCc1cccc(c1)Cl)c2ccccc2 2230a_100000174878_100000230085 [0,2,0,0,0,0|1,0,0]=3 22445 B18R2.6467 CC(NCc1cccc(c1)Cl)c2ccccc2 269862a_100000174878_100000185851 [0,2,0,0,0,0|1,0,0]=3 22446 B18R2.6467 CC(NCc1cccc(c1)Cl)c2ccccc2 34a_100000174878_100000211855 [0,2,0,0,0,0|1,0,0]=3 22447 B18R2.6467 CC(NCc1cccc(c1)Cl)c2ccccn2 207a_100000181244_100000210801 [0,2,0,0,0,0|2,0,0]=4 22448 B18R2.6467 CC(NCc1cccc(c1)Cl)c2ccccn2 2230a_100000181244_100000181238 [0,2,0,0,0,0|2,0,0]=4 22449 B18R2.6467 CC(NCc1cccc(c1)Cl)c2ccccn2 269862a_100000174878_100000210467 [0,2,0,0,0,0|2,0,0]=4 22450 B18R2.6467 CC(NCc1cccc(c1)Cl)c2ccccn2 270004a_100000181244_100000210801 [0,2,0,0,0,0|2,0,0]=4 22451 B18R2.6467 CC(NCc1cccc(c1)Cl)c2cccnc2 207a_100000195435_100000210801 [0,2,0,0,0,0|2,0,0]=4 22452 B18R2.6467 CC(NCc1cccc(c1)Cl)c2cccnc2 2230a_100000195435_100000181238 [0,2,0,0,0,0|2,0,0]=4 22453 B18R2.6467 CC(NCc1cccc(c1)Cl)c2cccnc2 269862a_100000174878_100000210468 [0,2,0,0,0,0|2,0,0]=4 22454 B18R2.6467 CC(NCc1cccc(c1)Cl)c2cccnc2 270004a_100000195435_100000210801 [0,2,0,0,0,0|2,0,0]=4 22455 B18R2.6467 CC(NCc1cccc(c1)Cl)c2ccncc2 207a_100000181269_100000210801 [0,2,0,0,0,0|2,0,0]=4 22456 B18R2.6467 CC(NCc1cccc(c1)Cl)c2ccncc2 2230a_100000181269_100000181238 [0,2,0,0,0,0|2,0,0]=4 22457 B18R2.6467 CC(NCc1cccc(c1)Cl)c2ccncc2 269862a_100000174878_100000185792 [0,2,0,0,0,0|2,0,0]=4 22458 B18R2.6467 CC(NCc1cccc(c1)Cl)c2ccncc2 270004a_100000181269_100000210801 [0,2,0,0,0,0|2,0,0]=4 22459 B18R2.6467 CC(NCc1cccc(c1)F)c2ccccc2 2230a_100000174948_100000230085 [0,2,0,0,0,0|1,0,0]=3 22460 B18R2.6467 CC(NCc1cccc(c1)F)c2ccccc2 269862a_100000174948_100000185851 [0,2,0,0,0,0|1,0,0]=3 22461 B18R2.6467 CC(NCc1cccc(c1)F)c2ccccc2 34a_100000174948_100000211855 [0,2,0,0,0,0|1,0,0]=3 22462 B18R2.6467 CC(NCc1cccc(c1)F)c2ccccn2 207a_100000181244_100000210812 [0,2,0,0,0,0|2,0,0]=4 22463 B18R2.6467 CC(NCc1cccc(c1)F)c2ccccn2 2230a_100000181244_100000230114 [0,2,0,0,0,0|2,0,0]=4 22464 B18R2.6467 CC(NCc1cccc(c1)F)c2ccccn2 269862a_100000174948_100000210467 [0,2,0,0,0,0|2,0,0]=4 22465 B18R2.6467 CC(NCc1cccc(c1)F)c2ccccn2 270004a_100000181244_100000210812 [0,2,0,0,0,0|2,0,0]=4 22466 B18R2.6467 CC(NCc1cccc(c1)F)c2cccnc2 207a_100000195435_100000210812 [0,2,0,0,0,0|2,0,0]=4 22467 B18R2.6467 CC(NCc1cccc(c1)F)c2cccnc2 2230a_100000195435_100000230114 [0,2,0,0,0,0|2,0,0]=4 22468 B18R2.6467 CC(NCc1cccc(c1)F)c2cccnc2 269862a_100000174948_100000210468 [0,2,0,0,0,0|2,0,0]=4 22469 B18R2.6467 CC(NCc1cccc(c1)F)c2cccnc2 270004a_100000195435_100000210812 [0,2,0,0,0,0|2,0,0]=4 22470 B18R2.6467 CC(NCc1cccc(c1)F)c2ccncc2 207a_100000181269_100000210812 [0,2,0,0,0,0|2,0,0]=4 22471 B18R2.6467 CC(NCc1cccc(c1)F)c2ccncc2 2230a_100000181269_100000230114 [0,2,0,0,0,0|2,0,0]=4 22472 B18R2.6467 CC(NCc1cccc(c1)F)c2ccncc2 269862a_100000174948_100000185792 [0,2,0,0,0,0|2,0,0]=4 22473 B18R2.6467 CC(NCc1cccc(c1)F)c2ccncc2 270004a_100000181269_100000210812 [0,2,0,0,0,0|2,0,0]=4 22474 B18R2.6467 CC(NCc1cccc(c1)I)c2ccccc2 2230a_100000106179_100000230085 [0,2,0,0,0,0|1,0,0]=3 22475 B18R2.6467 CC(NCc1cccc(c1)I)c2ccccc2 269862a_100000106179_100000185851 [0,2,0,0,0,0|1,0,0]=3 22476 B18R2.6467 CC(NCc1cccc(c1)I)c2ccccc2 34a_100000106179_100000211855 [0,2,0,0,0,0|1,0,0]=3 22477 B18R2.6467 CC(NCc1cccc(c1)I)c2ccccn2 207a_100000181244_100000014684 [0,2,0,0,0,0|2,0,0]=4 22478 B18R2.6467 CC(NCc1cccc(c1)I)c2ccccn2 2230a_100000181244_100011218688 [0,2,0,0,0,0|2,0,0]=4 22479 B18R2.6467 CC(NCc1cccc(c1)I)c2ccccn2 269862a_100000106179_100000210467 [0,2,0,0,0,0|2,0,0]=4 22480 B18R2.6467 CC(NCc1cccc(c1)I)c2ccccn2 270004a_100000181244_100000014684 [0,2,0,0,0,0|2,0,0]=4 22481 B18R2.6467 CC(NCc1cccc(c1)I)c2cccnc2 207a_100000195435_100000014684 [0,2,0,0,0,0|2,0,0]=4 22482 B18R2.6467 CC(NCc1cccc(c1)I)c2cccnc2 2230a_100000195435_100011218688 [0,2,0,0,0,0|2,0,0]=4 22483 B18R2.6467 CC(NCc1cccc(c1)I)c2cccnc2 269862a_100000106179_100000210468 [0,2,0,0,0,0|2,0,0]=4 22484 B18R2.6467 CC(NCc1cccc(c1)I)c2cccnc2 270004a_100000195435_100000014684 [0,2,0,0,0,0|2,0,0]=4 22485 B18R2.6467 CC(NCc1cccc(c1)I)c2ccncc2 207a_100000181269_100000014684 [0,2,0,0,0,0|2,0,0]=4 22486 B18R2.6467 CC(NCc1cccc(c1)I)c2ccncc2 2230a_100000181269_100011218688 [0,2,0,0,0,0|2,0,0]=4 22487 B18R2.6467 CC(NCc1cccc(c1)I)c2ccncc2 269862a_100000106179_100000185792 [0,2,0,0,0,0|2,0,0]=4 22488 B18R2.6467 CC(NCc1cccc(c1)I)c2ccncc2 270004a_100000181269_100000014684 [0,2,0,0,0,0|2,0,0]=4 22489 B18R2.6467 CC(NCc1cccc(c1)O)c2ccccc2 2230a_100000743036_100000230085 [0,2,0,0,0,0|1,0,0]=3 22490 B18R2.6467 CC(NCc1cccc(c1)O)c2ccccc2 269862a_100000743036_100000185851 [0,2,0,0,0,0|1,0,0]=3 22491 B18R2.6467 CC(NCc1cccc(c1)O)c2ccccc2 34a_100000743036_100000211855 [0,2,0,0,0,0|1,0,0]=3 22492 B18R2.6467 CC(NCc1cccc(c1)O)c2ccccn2 207a_100000181244_100000188321 [0,2,0,0,0,0|2,0,0]=4 22493 B18R2.6467 CC(NCc1cccc(c1)O)c2ccccn2 2230a_100000181244_100011660834 [0,2,0,0,0,0|2,0,0]=4 22494 B18R2.6467 CC(NCc1cccc(c1)O)c2ccccn2 269862a_100000743036_100000210467 [0,2,0,0,0,0|2,0,0]=4 22495 B18R2.6467 CC(NCc1cccc(c1)O)c2ccccn2 270004a_100000181244_100000188321 [0,2,0,0,0,0|2,0,0]=4 22496 B18R2.6467 CC(NCc1cccc(c1)O)c2cccnc2 207a_100000195435_100000188321 [0,2,0,0,0,0|2,0,0]=4 22497 B18R2.6467 CC(NCc1cccc(c1)O)c2cccnc2 2230a_100000195435_100011660834 [0,2,0,0,0,0|2,0,0]=4 22498 B18R2.6467 CC(NCc1cccc(c1)O)c2cccnc2 269862a_100000743036_100000210468 [0,2,0,0,0,0|2,0,0]=4 22499 B18R2.6467 CC(NCc1cccc(c1)O)c2cccnc2 270004a_100000195435_100000188321 [0,2,0,0,0,0|2,0,0]=4 22500 B18R2.6467 CC(NCc1cccc(c1)O)c2ccncc2 207a_100000181269_100000188321 [0,2,0,0,0,0|2,0,0]=4 22501 B18R2.6467 CC(NCc1cccc(c1)O)c2ccncc2 2230a_100000181269_100011660834 [0,2,0,0,0,0|2,0,0]=4 22502 B18R2.6467 CC(NCc1cccc(c1)O)c2ccncc2 269862a_100000743036_100000185792 [0,2,0,0,0,0|2,0,0]=4 22503 B18R2.6467 CC(NCc1cccc(c1)O)c2ccncc2 270004a_100000181269_100000188321 [0,2,0,0,0,0|2,0,0]=4 22504 B18R2.6467 CC(NCc1cccc(n1)Br)c2ccccc2 2230a_100016987751_100000230085 [0,2,0,0,0,0|2,0,0]=4 22505 B18R2.6467 CC(NCc1cccc(n1)Cl)c2ccccc2 2230a_100016990191_100000230085 [0,2,0,0,0,0|2,0,0]=4 22506 B18R2.6467 CC(NCc1cccc(n1)F)c2ccccc2 2230a_100015188798_100000230085 [0,2,0,0,0,0|2,0,0]=4 22507 B18R2.6467 CC(NCc1cccc(n1)F)c2ccccc2 34a_100015188798_100000211855 [0,2,0,0,0,0|2,0,0]=4 22508 B18R2.6467 CC(NCc1ccnc(c1)Br)c2ccccc2 2230a_100025757509_100000230085 [0,2,0,0,0,0|2,0,0]=4 22509 B18R2.6467 CC(NCc1ccnc(c1)Br)c2ccccc2 269862a_100025757509_100000185851 [0,2,0,0,0,0|2,0,0]=4 22510 B18R2.6467 CC(NCc1ccnc(c1)Br)c2ccccc2 34a_100025757509_100000211855 [0,2,0,0,0,0|2,0,0]=4 22511 B18R2.6467 CC(NCc1ccnc(c1)Cl)c2ccccc2 2230a_100015205668_100000230085 [0,2,0,0,0,0|2,0,0]=4 22512 B18R2.6467 CC(NCc1ccnc(c1)Cl)c2ccccc2 269862a_100015205668_100000185851 [0,2,0,0,0,0|2,0,0]=4 22513 B18R2.6467 CC(NCc1ccnc(c1)Cl)c2ccccc2 34a_100015205668_100000211855 [0,2,0,0,0,0|2,0,0]=4 22514 B18R2.6467 CC(NCc1ccnc(c1)F)c2ccccc2 2230a_100015188774_100000230085 [0,2,0,0,0,0|2,0,0]=4 22515 B18R2.6467 CC(NCc1ccnc(c1)F)c2ccccc2 269862a_100015188774_100000185851 [0,2,0,0,0,0|2,0,0]=4 22516 B18R2.6467 CC(NCc1ccnc(c1)F)c2ccccc2 34a_100015188774_100000211855 [0,2,0,0,0,0|2,0,0]=4 22517 B18R2.6467 CC(NCc1cncc(c1)Br)c2ccccc2 269862a_100011249555_100000185851 [0,2,0,0,0,0|2,0,0]=4 22518 B18R2.6467 CC(NCc1cncc(c1)Cl)c2ccccc2 2230a_200020614424_100000230085 [0,2,0,0,0,0|2,0,0]=4 22519 B18R2.6467 CC(NCc1cncc(c1)Cl)c2ccccc2 269862a_200020614424_100000185851 [0,2,0,0,0,0|2,0,0]=4 22520 B18R2.6467 CC(NCc1cncc(c1)F)c2ccccc2 2230a_100011962886_100000230085 [0,2,0,0,0,0|2,0,0]=4 22521 B18R2.6467 CC(NCc1cncc(c1)F)c2ccccc2 269862a_100011962886_100000185851 [0,2,0,0,0,0|2,0,0]=4 22522 B18R2.6467 CC(NCc1cncc(c1)F)c2ccccc2 34a_100011962886_100000211855 [0,2,0,0,0,0|2,0,0]=4 22523 B18R2.6467 CC(OCc1cc(ccn1)Cl)c2ccccc2 34a_100000748867_100000211855 [0,2,0,0,0,0|1,0,0]=3 22524 B18R2.6467 CC(OCc1cc(ccn1)N)c2ccccc2 34a_100000692640_100000211855 [0,2,0,0,0,0|1,0,0]=3 22525 B18R2.6467 CC(OCc1ccc[n+](c1)[O-])c2ccccc2 34a_100000037817_100000211855 [0,2,0,0,0,0|1,0,0]=3 22526 B18R2.6467 CC(OCc1ccc[n+](c1)[O-])c2ccccc2 7a_100000037817_100000230085 [0,2,0,0,0,0|1,0,0]=3 22527 B18R2.6467 CC(OCc1cccc(c1)Br)c2ccccc2 34a_100000687537_100000211855 [0,2,0,0,0,0|0,0,0]=2 22528 B18R2.6467 CC(OCc1cccc(c1)Br)c2ccccc2 7a_100000687537_100000230085 [0,2,0,0,0,0|0,0,0]=2 22529 B18R2.6467 CC(OCc1cccc(c1)Br)c2cnccn2 7a_100000687537_200000703233 [0,2,0,0,0,0|2,0,0]=4 22530 B18R2.6467 CC(OCc1cccc(c1)Cl)c2ccccc2 34a_100000241301_100000211855 [0,2,0,0,0,0|0,0,0]=2 22531 B18R2.6467 CC(OCc1cccc(c1)Cl)c2ccccc2 7a_100000241301_100000230085 [0,2,0,0,0,0|0,0,0]=2 22532 B18R2.6467 CC(OCc1cccc(c1)Cl)c2cnccn2 7a_100000241301_200000703233 [0,2,0,0,0,0|2,0,0]=4 22533 B18R2.6467 CC(OCc1cccc(c1)F)c2ccccc2 34a_100000210976_100000211855 [0,2,0,0,0,0|0,0,0]=2 22534 B18R2.6467 CC(OCc1cccc(c1)F)c2ccccc2 7a_100000210976_100000230085 [0,2,0,0,0,0|0,0,0]=2 22535 B18R2.6467 CC(OCc1cccc(c1)F)c2cnccn2 7a_100000210976_200000703233 [0,2,0,0,0,0|2,0,0]=4 22536 B18R2.6467 CC(OCc1cccc(c1)I)c2ccccc2 34a_100011215336_100000211855 [0,2,0,0,0,0|0,0,0]=2 22537 B18R2.6467 CC(OCc1cccc(c1)I)c2ccccc2 7a_100011215336_100000230085 [0,2,0,0,0,0|0,0,0]=2 22538 B18R2.6467 CC(OCc1cccc(c1)I)c2cnccn2 7a_100011215336_200000703233 [0,2,0,0,0,0|2,0,0]=4 22539 B18R2.6467 CC(OCc1cccc(c1)N)c2ccccc2 34a_100000211919_100000211855 [0,2,0,0,0,0|0,0,0]=2 22540 B18R2.6467 CC(OCc1cccc(n1)Br)c2ccccc2 34a_100000694195_100000211855 [0,2,0,0,0,0|1,0,0]=3 22541 B18R2.6467 CC(OCc1cccc(n1)Cl)c2ccccc2 34a_100011998359_100000211855 [0,2,0,0,0,0|1,0,0]=3 22542 B18R2.6467 CC(OCc1cccc(n1)F)c2ccccc2 34a_100000086748_100000211855 [0,2,0,0,0,0|1,0,0]=3 22543 B18R2.6467 CC(OCc1ccnc(c1)Br)c2ccccc2 34a_100009814636_100000211855 [0,2,0,0,0,0|1,0,0]=3 22544 B18R2.6467 CC(OCc1ccnc(c1)Br)c2ccccc2 7a_100009814636_100000230085 [0,2,0,0,0,0|1,0,0]=3 22545 B18R2.6467 CC(OCc1ccnc(c1)Cl)c2ccccc2 34a_100000748751_100000211855 [0,2,0,0,0,0|1,0,0]=3 22546 B18R2.6467 CC(OCc1ccnc(c1)F)c2ccccc2 34a_100000082451_100000211855 [0,2,0,0,0,0|1,0,0]=3 22547 B18R2.6467 CC(OCc1cncc(c1)Br)c2ccccc2 34a_100011259137_100000211855 [0,2,0,0,0,0|1,0,0]=3 22548 B18R2.6467 CC(OCc1cncc(c1)Br)c2ccccc2 7a_100011259137_100000230085 [0,2,0,0,0,0|1,0,0]=3 22549 B18R2.6467 CC(OCc1cncc(c1)Cl)c2ccccc2 34a_100000092867_100000211855 [0,2,0,0,0,0|1,0,0]=3 22550 B18R2.6467 CC(OCc1cncc(c1)Cl)c2ccccc2 7a_100000092867_100000230085 [0,2,0,0,0,0|1,0,0]=3 22551 B18R2.6467 CC(OCc1cncc(c1)F)c2ccccc2 34a_100011962875_100000211855 [0,2,0,0,0,0|1,0,0]=3 22552 B18R2.6467 CC(OCc1cncc(c1)F)c2ccccc2 7a_100011962875_100000230085 [0,2,0,0,0,0|1,0,0]=3 22553 B18R2.6467 CC(OCc1cncc(c1)N)c2ccccc2 34a_100000085308_100000211855 [0,2,0,0,0,0|1,0,0]=3 22554 B18R2.6467 CC(SCc1cc(ccn1)Br)c2ccccc2 62a_100000230085_100010173614 [0,2,0,0,0,0|1,1,0]=4 22555 B18R2.6467 CC(SCc1cc(ccn1)Br)c2ccccc2 62a_100010173614_100000230085 [0,2,0,0,0,0|1,1,0]=4 22556 B18R2.6467 CC(SCc1cc(ccn1)Cl)c2ccccc2 62a_100000230085_100016988179 [0,2,0,0,0,0|1,1,0]=4 22557 B18R2.6467 CC(SCc1cc(ccn1)Cl)c2ccccc2 62a_100016988179_100000230085 [0,2,0,0,0,0|1,1,0]=4 22558 B18R2.6467 CC(SCc1cccc(c1)Br)c2ccccc2 62a_100000211773_100000230085 [0,2,0,0,0,0|0,1,0]=3 22559 B18R2.6467 CC(SCc1cccc(c1)Br)c2ccccc2 62a_100000230085_100000211773 [0,2,0,0,0,0|0,1,0]=3 22560 B18R2.6467 CC(SCc1cccc(c1)Cl)c2ccccc2 62a_100000187163_100000230085 [0,2,0,0,0,0|0,1,0]=3 22561 B18R2.6467 CC(SCc1cccc(c1)Cl)c2ccccc2 62a_100000230085_100000187163 [0,2,0,0,0,0|0,1,0]=3 22562 B18R2.6467 CC(SCc1cccc(c1)F)c2ccccc2 62a_100000230085_100000230114 [0,2,0,0,0,0|0,1,0]=3 22563 B18R2.6467 CC(SCc1cccc(c1)F)c2ccccc2 62a_100000230114_100000230085 [0,2,0,0,0,0|0,1,0]=3 22564 B18R2.6467 CC(SCc1cccc(c1)I)c2ccccc2 62a_100000230085_100011218688 [0,2,0,0,0,0|0,1,0]=3 22565 B18R2.6467 CC(SCc1cccc(c1)I)c2ccccc2 62a_100011218688_100000230085 [0,2,0,0,0,0|0,1,0]=3 22566 B18R2.6467 CC(SCc1cccc(c1)O)c2ccccc2 62a_100000230085_100011660834 [0,2,0,0,0,0|0,1,0]=3 22567 B18R2.6467 CC(SCc1cccc(c1)O)c2ccccc2 62a_100011660834_100000230085 [0,2,0,0,0,0|0,1,0]=3 22568 B18R2.6467 CC(SCc1cccc(n1)Br)c2ccccc2 62a_100000230085_100009889011 [0,2,0,0,0,0|1,1,0]=4 22569 B18R2.6467 CC(SCc1cccc(n1)Br)c2ccccc2 62a_100009889011_100000230085 [0,2,0,0,0,0|1,1,0]=4 22570 B18R2.6467 CC(SCc1cccc(n1)Cl)c2ccccc2 62a_100000086093_100000230085 [0,2,0,0,0,0|1,1,0]=4 22571 B18R2.6467 CC(SCc1cccc(n1)Cl)c2ccccc2 62a_100000230085_100000086093 [0,2,0,0,0,0|1,1,0]=4 22572 B18R2.6467 CC(SCc1cccc(n1)F)c2ccccc2 62a_100000230085_100009819644 [0,2,0,0,0,0|1,1,0]=4 22573 B18R2.6467 CC(SCc1cccc(n1)F)c2ccccc2 62a_100009819644_100000230085 [0,2,0,0,0,0|1,1,0]=4 22574 B18R2.6467 CC(SCc1ccnc(c1)Br)c2ccccc2 62a_100000230085_100010243470 [0,2,0,0,0,0|1,1,0]=4 22575 B18R2.6467 CC(SCc1ccnc(c1)Br)c2ccccc2 62a_100010254460_100000230085 [0,2,0,0,0,0|1,1,0]=4 22576 B18R2.6467 CC(SCc1ccnc(c1)Cl)c2ccccc2 62a_100000230085_100000764220 [0,2,0,0,0,0|1,1,0]=4 22577 B18R2.6467 CC(SCc1ccnc(c1)Cl)c2ccccc2 62a_100000764220_100000230085 [0,2,0,0,0,0|1,1,0]=4 22578 B18R2.6467 CC(SCc1cncc(c1)Br)c2ccccc2 62a_100000230085_100000738771 [0,2,0,0,0,0|1,1,0]=4 22579 B18R2.6467 CC(SCc1cncc(c1)Br)c2ccccc2 62a_100000738771_100000230085 [0,2,0,0,0,0|1,1,0]=4 22580 B18R2.6467 CC(SCc1cncc(c1)Cl)c2ccccc2 62a_100000230085_100016992070 [0,2,0,0,0,0|1,1,0]=4 22581 B18R2.6467 CC(SCc1cncc(c1)Cl)c2ccccc2 62a_100016992070_100000230085 [0,2,0,0,0,0|1,1,0]=4 22582 B18R2.6467 CC(SCc1cncc(c1)F)c2ccccc2 62a_100000230085_100000725299 [0,2,0,0,0,0|1,1,0]=4 22583 B18R2.6467 CC(SCc1cncc(c1)F)c2ccccc2 62a_100000725299_100000230085 [0,2,0,0,0,0|1,1,0]=4 22584 B18R2.6467 CN(CCc1cccc(c1)Br)c2ccccc2 2230a_100000210012_100011740638 [0,2,0,0,0,0|2,0,0]=4 22585 B18R2.6467 CN(CCc1cccc(c1)Br)c2ccccc2 269982a_100000210012_100011740638 [0,2,0,0,0,0|2,0,0]=4 22586 B18R2.6467 CN(CCc1cccc(c1)Br)c2ccccc2 34a_100000210012_100011740638 [0,2,0,0,0,0|2,0,0]=4 22587 B18R2.6467 CN(CCc1cccc(c1)Cl)c2ccccc2 2230a_100000210012_100011713710 [0,2,0,0,0,0|2,0,0]=4 22588 B18R2.6467 CN(CCc1cccc(c1)Cl)c2ccccc2 269982a_100000210012_100011713710 [0,2,0,0,0,0|2,0,0]=4 22589 B18R2.6467 CN(CCc1cccc(c1)Cl)c2ccccc2 34a_100000210012_100011713710 [0,2,0,0,0,0|2,0,0]=4 22590 B18R2.6467 CN(CCc1cccc(c1)F)c2ccccc2 2230a_100000210012_100011217235 [0,2,0,0,0,0|2,0,0]=4 22591 B18R2.6467 CN(CCc1cccc(c1)F)c2ccccc2 269982a_100000210012_100011217235 [0,2,0,0,0,0|2,0,0]=4 22592 B18R2.6467 CN(CCc1cccc(c1)F)c2ccccc2 34a_100000210012_100011217235 [0,2,0,0,0,0|2,0,0]=4 22593 B18R2.6467 C[C@@H](NCc1cc(ccn1)Br)c2ccccc2 2230a_100000751104_100010173614 [0,2,0,0,0,0|2,0,0]=4 22594 B18R2.6467 C[C@@H](NCc1cc(ccn1)Br)c2ccccc2 270004a_100000751104_100009818557 [0,2,0,0,0,0|2,0,0]=4 22595 B18R2.6467 C[C@@H](NCc1cc(ccn1)Cl)c2ccccc2 2230a_100000751104_100016988179 [0,2,0,0,0,0|2,0,0]=4 22596 B18R2.6467 C[C@@H](NCc1cc(ccn1)Cl)c2ccccc2 270004a_100000751104_100011998288 [0,2,0,0,0,0|2,0,0]=4 22597 B18R2.6467 C[C@@H](NCc1cccc(=O)[nH]1)c2ccccc2 207a_100000751104_100011935257 [0,2,0,0,0,0|2,0,0]=4 22598 B18R2.6467 C[C@@H](NCc1cccc(c1)Br)c2ccccc2 207a_100000751104_100000210085 [0,2,0,0,0,0|1,0,0]=3 22599 B18R2.6467 C[C@@H](NCc1cccc(c1)Br)c2ccccc2 2230a_100000751104_100000698116 [0,2,0,0,0,0|1,0,0]=3 22600 B18R2.6467 C[C@@H](NCc1cccc(c1)Br)c2ccccc2 270004a_100000751104_100000210085 [0,2,0,0,0,0|1,0,0]=3 22601 B18R2.6467 C[C@@H](NCc1cccc(c1)Cl)c2ccccc2 207a_100000751104_100000210801 [0,2,0,0,0,0|1,0,0]=3 22602 B18R2.6467 C[C@@H](NCc1cccc(c1)Cl)c2ccccc2 2230a_100000751104_100000181238 [0,2,0,0,0,0|1,0,0]=3 22603 B18R2.6467 C[C@@H](NCc1cccc(c1)Cl)c2ccccc2 270004a_100000751104_100000210801 [0,2,0,0,0,0|1,0,0]=3 22604 B18R2.6467 C[C@@H](NCc1cccc(c1)F)c2ccccc2 207a_100000751104_100000210812 [0,2,0,0,0,0|1,0,0]=3 22605 B18R2.6467 C[C@@H](NCc1cccc(c1)F)c2ccccc2 2230a_100000751104_100000230114 [0,2,0,0,0,0|1,0,0]=3 22606 B18R2.6467 C[C@@H](NCc1cccc(c1)F)c2ccccc2 270004a_100000751104_100000210812 [0,2,0,0,0,0|1,0,0]=3 22607 B18R2.6467 C[C@@H](NCc1cccc(c1)I)c2ccccc2 207a_100000751104_100000014684 [0,2,0,0,0,0|1,0,0]=3 22608 B18R2.6467 C[C@@H](NCc1cccc(c1)I)c2ccccc2 2230a_100000751104_100011218688 [0,2,0,0,0,0|1,0,0]=3 22609 B18R2.6467 C[C@@H](NCc1cccc(c1)I)c2ccccc2 270004a_100000751104_100000014684 [0,2,0,0,0,0|1,0,0]=3 22610 B18R2.6467 C[C@@H](NCc1cccc(c1)O)c2ccccc2 207a_100000751104_100000188321 [0,2,0,0,0,0|1,0,0]=3 22611 B18R2.6467 C[C@@H](NCc1cccc(c1)O)c2ccccc2 2230a_100000751104_100011660834 [0,2,0,0,0,0|1,0,0]=3 22612 B18R2.6467 C[C@@H](NCc1cccc(c1)O)c2ccccc2 270004a_100000751104_100000188321 [0,2,0,0,0,0|1,0,0]=3 22613 B18R2.6467 C[C@@H](NCc1cccc(n1)Br)c2ccccc2 2230a_100000751104_100009889011 [0,2,0,0,0,0|2,0,0]=4 22614 B18R2.6467 C[C@@H](NCc1cccc(n1)Br)c2ccccc2 270004a_100000751104_100000688028 [0,2,0,0,0,0|2,0,0]=4 22615 B18R2.6467 C[C@@H](NCc1cccc(n1)Cl)c2ccccc2 2230a_100000751104_100000086093 [0,2,0,0,0,0|2,0,0]=4 22616 B18R2.6467 C[C@@H](NCc1cccc(n1)Cl)c2ccccc2 270004a_100000751104_100011361687 [0,2,0,0,0,0|2,0,0]=4 22617 B18R2.6467 C[C@@H](NCc1cccc(n1)F)c2ccccc2 2230a_100000751104_100009819644 [0,2,0,0,0,0|2,0,0]=4 22618 B18R2.6467 C[C@@H](NCc1cccc(n1)F)c2ccccc2 270004a_100000751104_100000050434 [0,2,0,0,0,0|2,0,0]=4 22619 B18R2.6467 C[C@@H](NCc1ccnc(c1)Br)c2ccccc2 2230a_100000751104_100010243470 [0,2,0,0,0,0|2,0,0]=4 22620 B18R2.6467 C[C@@H](NCc1ccnc(c1)Br)c2ccccc2 270004a_100000751104_100009814634 [0,2,0,0,0,0|2,0,0]=4 22621 B18R2.6467 C[C@@H](NCc1ccnc(c1)Cl)c2ccccc2 2230a_100000751104_100000764220 [0,2,0,0,0,0|2,0,0]=4 22622 B18R2.6467 C[C@@H](NCc1ccnc(c1)Cl)c2ccccc2 270004a_100000751104_100011290808 [0,2,0,0,0,0|2,0,0]=4 22623 B18R2.6467 C[C@@H](NCc1ccnc(c1)F)c2ccccc2 270004a_100000751104_100000068331 [0,2,0,0,0,0|2,0,0]=4 22624 B18R2.6467 C[C@@H](NCc1ccnc(c1)O)c2ccccc2 207a_100000751104_100000688113 [0,2,0,0,0,0|2,0,0]=4 22625 B18R2.6467 C[C@@H](NCc1cncc(c1)Br)c2ccccc2 207a_100000751104_100000687066 [0,2,0,0,0,0|2,0,0]=4 22626 B18R2.6467 C[C@@H](NCc1cncc(c1)Br)c2ccccc2 2230a_100000751104_100000738771 [0,2,0,0,0,0|2,0,0]=4 22627 B18R2.6467 C[C@@H](NCc1cncc(c1)Br)c2ccccc2 270004a_100000751104_100000687066 [0,2,0,0,0,0|2,0,0]=4 22628 B18R2.6467 C[C@@H](NCc1cncc(c1)Cl)c2ccccc2 207a_100000751104_100000088910 [0,2,0,0,0,0|2,0,0]=4 22629 B18R2.6467 C[C@@H](NCc1cncc(c1)Cl)c2ccccc2 2230a_100000751104_100016992070 [0,2,0,0,0,0|2,0,0]=4 22630 B18R2.6467 C[C@@H](NCc1cncc(c1)Cl)c2ccccc2 270004a_100000751104_100000088910 [0,2,0,0,0,0|2,0,0]=4 22631 B18R2.6467 C[C@@H](NCc1cncc(c1)F)c2ccccc2 207a_100000751104_100011361476 [0,2,0,0,0,0|2,0,0]=4 22632 B18R2.6467 C[C@@H](NCc1cncc(c1)F)c2ccccc2 2230a_100000751104_100000725299 [0,2,0,0,0,0|2,0,0]=4 22633 B18R2.6467 C[C@@H](NCc1cncc(c1)F)c2ccccc2 270004a_100000751104_100011361476 [0,2,0,0,0,0|2,0,0]=4 22634 B18R2.6467 C[C@@H](NCc1cncc(c1)O)c2ccccc2 207a_100000751104_100012187055 [0,2,0,0,0,0|2,0,0]=4 22635 B18R2.6467 C[C@@H](NCc1cncc(c1)O)c2ccccc2 270004a_100000751104_100012187055 [0,2,0,0,0,0|2,0,0]=4 22636 B18R2.6467 C[C@@H](OCc1cc(ccn1)Br)c2ccccc2 34a_100000761318_100010173614 [0,2,0,0,0,0|1,0,0]=3 22637 B18R2.6467 C[C@@H](OCc1cc(ccn1)Br)c2ccccc2 7a_100000761318_100010173614 [0,2,0,0,0,0|1,0,0]=3 22638 B18R2.6467 C[C@@H](OCc1cc(ccn1)Cl)c2ccccc2 34a_100000761318_100016988179 [0,2,0,0,0,0|1,0,0]=3 22639 B18R2.6467 C[C@@H](OCc1cc(ccn1)Cl)c2ccccc2 7a_100000761318_100016988179 [0,2,0,0,0,0|1,0,0]=3 22640 B18R2.6467 C[C@@H](OCc1cccc(c1)Br)c2ccccc2 34a_100000761318_100000698116 [0,2,0,0,0,0|0,0,0]=2 22641 B18R2.6467 C[C@@H](OCc1cccc(c1)Br)c2ccccc2 7a_100000761318_100000211773 [0,2,0,0,0,0|0,0,0]=2 22642 B18R2.6467 C[C@@H](OCc1cccc(c1)Cl)c2ccccc2 34a_100000761318_100000187163 [0,2,0,0,0,0|0,0,0]=2 22643 B18R2.6467 C[C@@H](OCc1cccc(c1)Cl)c2ccccc2 7a_100000761318_100000187163 [0,2,0,0,0,0|0,0,0]=2 22644 B18R2.6467 C[C@@H](OCc1cccc(c1)F)c2ccccc2 34a_100000761318_100000187166 [0,2,0,0,0,0|0,0,0]=2 22645 B18R2.6467 C[C@@H](OCc1cccc(c1)F)c2ccccc2 7a_100000761318_100000230114 [0,2,0,0,0,0|0,0,0]=2 22646 B18R2.6467 C[C@@H](OCc1cccc(c1)I)c2ccccc2 34a_100000761318_100011218688 [0,2,0,0,0,0|0,0,0]=2 22647 B18R2.6467 C[C@@H](OCc1cccc(c1)I)c2ccccc2 7a_100000761318_100011218688 [0,2,0,0,0,0|0,0,0]=2 22648 B18R2.6467 C[C@@H](OCc1cccc(c1)O)c2ccccc2 34a_100000761318_100011660834 [0,2,0,0,0,0|0,0,0]=2 22649 B18R2.6467 C[C@@H](OCc1cccc(c1)O)c2ccccc2 7a_100000761318_100000084143 [0,2,0,0,0,0|0,0,0]=2 22650 B18R2.6467 C[C@@H](OCc1cccc(n1)Br)c2ccccc2 34a_100000761318_100009889011 [0,2,0,0,0,0|1,0,0]=3 22651 B18R2.6467 C[C@@H](OCc1cccc(n1)Br)c2ccccc2 7a_100000761318_100009889011 [0,2,0,0,0,0|1,0,0]=3 22652 B18R2.6467 C[C@@H](OCc1cccc(n1)Cl)c2ccccc2 34a_100000761318_100000086093 [0,2,0,0,0,0|1,0,0]=3 22653 B18R2.6467 C[C@@H](OCc1cccc(n1)Cl)c2ccccc2 7a_100000761318_100000086093 [0,2,0,0,0,0|1,0,0]=3 22654 B18R2.6467 C[C@@H](OCc1cccc(n1)F)c2ccccc2 34a_100000761318_100009819644 [0,2,0,0,0,0|1,0,0]=3 22655 B18R2.6467 C[C@@H](OCc1cccc(n1)F)c2ccccc2 7a_100000761318_100009819644 [0,2,0,0,0,0|1,0,0]=3 22656 B18R2.6467 C[C@@H](OCc1ccnc(c1)Br)c2ccccc2 34a_100000761318_100010243470 [0,2,0,0,0,0|1,0,0]=3 22657 B18R2.6467 C[C@@H](OCc1ccnc(c1)Br)c2ccccc2 7a_100000761318_100010254460 [0,2,0,0,0,0|1,0,0]=3 22658 B18R2.6467 C[C@@H](OCc1ccnc(c1)Cl)c2ccccc2 34a_100000761318_100000764220 [0,2,0,0,0,0|1,0,0]=3 22659 B18R2.6467 C[C@@H](OCc1ccnc(c1)Cl)c2ccccc2 7a_100000761318_100000764220 [0,2,0,0,0,0|1,0,0]=3 22660 B18R2.6467 C[C@@H](OCc1ccnc(n1)Cl)c2ccccc2 34a_100000761318_100000099655 [0,2,0,0,0,0|2,0,0]=4 22661 B18R2.6467 C[C@@H](OCc1ccnc(n1)Cl)c2ccccc2 7a_100000761318_100000099655 [0,2,0,0,0,0|2,0,0]=4 22662 B18R2.6467 C[C@@H](OCc1cncc(c1)Br)c2ccccc2 34a_100000761318_100000738771 [0,2,0,0,0,0|1,0,0]=3 22663 B18R2.6467 C[C@@H](OCc1cncc(c1)Br)c2ccccc2 7a_100000761318_100000738771 [0,2,0,0,0,0|1,0,0]=3 22664 B18R2.6467 C[C@@H](OCc1cncc(c1)Cl)c2ccccc2 34a_100000761318_100016992070 [0,2,0,0,0,0|1,0,0]=3 22665 B18R2.6467 C[C@@H](OCc1cncc(c1)Cl)c2ccccc2 7a_100000761318_100016992070 [0,2,0,0,0,0|1,0,0]=3 22666 B18R2.6467 C[C@@H](OCc1cncc(c1)F)c2ccccc2 34a_100000761318_100000725299 [0,2,0,0,0,0|1,0,0]=3 22667 B18R2.6467 C[C@@H](OCc1cncc(c1)F)c2ccccc2 7a_100000761318_100000725299 [0,2,0,0,0,0|1,0,0]=3 22668 B18R2.6467 Cc1cc(ccn1)CNC(C)c2ccccc2 269862a_100011934566_100000185851 [0,2,0,0,0,0|2,0,0]=4 22669 B18R2.6467 Cc1cc(ccn1)CNC(C)c2ccccc2 34a_100011934566_100000211855 [0,2,0,0,0,0|2,0,0]=4 22670 B18R2.6467 Cc1cc(ccn1)CN[C@H](C)c2ccccc2 207a_100000751104_100011361630 [0,2,0,0,0,0|2,0,0]=4 22671 B18R2.6467 Cc1cc(ccn1)CN[C@H](C)c2ccccc2 2230a_100000751104_200020672517 [0,2,0,0,0,0|2,0,0]=4 22672 B18R2.6467 Cc1cc(ccn1)CN[C@H](C)c2ccccc2 270004a_100000751104_100011361630 [0,2,0,0,0,0|2,0,0]=4 22673 B18R2.6467 Cc1cc(ccn1)COC(C)c2ccccc2 34a_100011998630_100000211855 [0,2,0,0,0,0|1,0,0]=3 22674 B18R2.6467 Cc1cc(ccn1)CO[C@H](C)c2ccccc2 34a_100000761318_200020672517 [0,2,0,0,0,0|1,0,0]=3 22675 B18R2.6467 Cc1cc(ccn1)CO[C@H](C)c2ccccc2 7a_100000761318_200020672517 [0,2,0,0,0,0|1,0,0]=3 22676 B18R2.6467 Cc1cc(ccn1)CSC(C)c2ccccc2 62a_100000230085_200020672517 [0,2,0,0,0,0|1,1,0]=4 22677 B18R2.6467 Cc1cc(ccn1)CSC(C)c2ccccc2 62a_200020672517_100000230085 [0,2,0,0,0,0|1,1,0]=4 22678 B18R2.6467 Cc1cccc(c1)CCC(=O)c2ccccc2 1458a_100000185807_100011713685 [0,2,0,0,0,0|1,0,1]=4 22679 B18R2.6467 Cc1cccc(c1)CCN(C)c2ccccc2 2230a_100000210012_100011713685 [0,2,0,0,0,0|2,0,0]=4 22680 B18R2.6467 Cc1cccc(c1)CCN(C)c2ccccc2 269982a_100000210012_100011713685 [0,2,0,0,0,0|2,0,0]=4 22681 B18R2.6467 Cc1cccc(c1)CCN(C)c2ccccc2 34a_100000210012_100011713685 [0,2,0,0,0,0|2,0,0]=4 22682 B18R2.6467 Cc1cccc(c1)CNC(=O)c2ccccc2 11a_100000185548_100000185807 [0,2,0,0,0,0|1,0,1]=4 22683 B18R2.6467 Cc1cccc(c1)CNC(=O)c2ccccc2 1626a_100000185548_100000185807 [0,2,0,0,0,0|1,0,1]=4 22684 B18R2.6467 Cc1cccc(c1)CNC(=O)c2ccccc2 240690a_100000185548_100000185807 [0,2,0,0,0,0|1,0,1]=4 22685 B18R2.6467 Cc1cccc(c1)CNC(=O)c2ccccc2 527a_100000185548_100000185807 [0,2,0,0,0,0|1,0,1]=4 22686 B18R2.6467 Cc1cccc(c1)CNC(C)c2ccccc2 2230a_100000185548_100000230085 [0,2,0,0,0,0|1,0,0]=3 22687 B18R2.6467 Cc1cccc(c1)CNC(C)c2ccccc2 269862a_100000185548_100000185851 [0,2,0,0,0,0|1,0,0]=3 22688 B18R2.6467 Cc1cccc(c1)CNC(C)c2ccccc2 34a_100000185548_100000211855 [0,2,0,0,0,0|1,0,0]=3 22689 B18R2.6467 Cc1cccc(c1)CNC(C)c2ccccn2 207a_100000181244_100000211157 [0,2,0,0,0,0|2,0,0]=4 22690 B18R2.6467 Cc1cccc(c1)CNC(C)c2ccccn2 2230a_100000181244_100000211840 [0,2,0,0,0,0|2,0,0]=4 22691 B18R2.6467 Cc1cccc(c1)CNC(C)c2ccccn2 269862a_100000185548_100000210467 [0,2,0,0,0,0|2,0,0]=4 22692 B18R2.6467 Cc1cccc(c1)CNC(C)c2ccccn2 270004a_100000181244_100000211157 [0,2,0,0,0,0|2,0,0]=4 22693 B18R2.6467 Cc1cccc(c1)CNC(C)c2cccnc2 207a_100000195435_100000211157 [0,2,0,0,0,0|2,0,0]=4 22694 B18R2.6467 Cc1cccc(c1)CNC(C)c2cccnc2 2230a_100000195435_100000211840 [0,2,0,0,0,0|2,0,0]=4 22695 B18R2.6467 Cc1cccc(c1)CNC(C)c2cccnc2 269862a_100000185548_100000210468 [0,2,0,0,0,0|2,0,0]=4 22696 B18R2.6467 Cc1cccc(c1)CNC(C)c2cccnc2 270004a_100000195435_100000211157 [0,2,0,0,0,0|2,0,0]=4 22697 B18R2.6467 Cc1cccc(c1)CNC(C)c2ccncc2 207a_100000181269_100000211157 [0,2,0,0,0,0|2,0,0]=4 22698 B18R2.6467 Cc1cccc(c1)CNC(C)c2ccncc2 2230a_100000181269_100000211840 [0,2,0,0,0,0|2,0,0]=4 22699 B18R2.6467 Cc1cccc(c1)CNC(C)c2ccncc2 269862a_100000185548_100000185792 [0,2,0,0,0,0|2,0,0]=4 22700 B18R2.6467 Cc1cccc(c1)CNC(C)c2ccncc2 270004a_100000181269_100000211157 [0,2,0,0,0,0|2,0,0]=4 22701 B18R2.6467 Cc1cccc(c1)CN[C@H](C)c2ccccc2 207a_100000751104_100000211157 [0,2,0,0,0,0|1,0,0]=3 22702 B18R2.6467 Cc1cccc(c1)CN[C@H](C)c2ccccc2 2230a_100000751104_100000211840 [0,2,0,0,0,0|1,0,0]=3 22703 B18R2.6467 Cc1cccc(c1)CN[C@H](C)c2ccccc2 270004a_100000751104_100000211157 [0,2,0,0,0,0|1,0,0]=3 22704 B18R2.6467 Cc1cccc(c1)COC(C)c2ccccc2 34a_100011217746_100000211855 [0,2,0,0,0,0|0,0,0]=2 22705 B18R2.6467 Cc1cccc(c1)COC(C)c2ccccc2 7a_100011217746_100000230085 [0,2,0,0,0,0|0,0,0]=2 22706 B18R2.6467 Cc1cccc(c1)COC(C)c2cnccn2 7a_100011217746_200000703233 [0,2,0,0,0,0|2,0,0]=4 22707 B18R2.6467 Cc1cccc(c1)CO[C@H](C)c2ccccc2 34a_100000761318_100000211840 [0,2,0,0,0,0|0,0,0]=2 22708 B18R2.6467 Cc1cccc(c1)CO[C@H](C)c2ccccc2 7a_100000761318_100000211840 [0,2,0,0,0,0|0,0,0]=2 22709 B18R2.6467 Cc1cccc(c1)CSC(C)c2ccccc2 62a_100000211840_100000230085 [0,2,0,0,0,0|0,1,0]=3 22710 B18R2.6467 Cc1cccc(c1)CSC(C)c2ccccc2 62a_100000230085_100000211840 [0,2,0,0,0,0|0,1,0]=3 22711 B18R2.6467 Cc1cccc(c1)NCC(C)c2ccccc2 2230a_100000188690_100000756946 [0,2,0,0,0,0|2,0,0]=4 22712 B18R2.6467 Cc1cccc(c1)NCC(C)c2ccccc2 34a_100000188690_100000756946 [0,2,0,0,0,0|2,0,0]=4 22713 B18R2.6467 Cc1cccc(c1)NCC(O)c2ccccc2 2230a_100000188690_100000185958 [0,2,0,0,0,0|2,0,0]=4 22714 B18R2.6467 Cc1cccc(c1)NCC(O)c2ccccc2 34a_100000188690_100000185958 [0,2,0,0,0,0|2,0,0]=4 22715 B18R2.6467 Cc1cccc(c1)NC[C@@H](O)c2ccccc2 2230a_100000188690_100011933945 [0,2,0,0,0,0|2,0,0]=4 22716 B18R2.6467 Cc1cccc(c1)NC[C@@H](O)c2ccccc2 34a_100000188690_100011933945 [0,2,0,0,0,0|2,0,0]=4 22717 B18R2.6467 Cc1cccc(c1)OCC(C)c2ccccc2 34a_100000210337_100000756946 [0,2,0,0,0,0|2,0,0]=4 22718 B18R2.6467 Cc1cccc(c1)OCC(C)c2ccccc2 7a_100000210337_100000756946 [0,2,0,0,0,0|2,0,0]=4 22719 B18R2.6467 Cc1cccc(c1)OCC(O)c2ccccc2 34a_100000210337_100000185958 [0,2,0,0,0,0|2,0,0]=4 22720 B18R2.6467 Cc1cccc(c1)OCC(O)c2ccccc2 7a_100000210337_100000185958 [0,2,0,0,0,0|2,0,0]=4 22721 B18R2.6467 Cc1cccc(c1)OC[C@@H](O)c2ccccc2 34a_100000210337_100011933945 [0,2,0,0,0,0|2,0,0]=4 22722 B18R2.6467 Cc1cccc(c1)OC[C@@H](O)c2ccccc2 7a_100000210337_100011933945 [0,2,0,0,0,0|2,0,0]=4 22723 B18R2.6467 Cc1cccc(c1)SCC(C)c2ccccc2 62a_100000756946_100011215228 [0,2,0,0,0,0|2,0,0]=4 22724 B18R2.6467 Cc1cccc(c1)SCC(C)c2ccccc2 62a_100011215228_100000756946 [0,2,0,0,0,0|2,0,0]=4 22725 B18R2.6467 Cc1cccc(c1)SCC(O)c2ccccc2 62a_100000185958_100011215228 [0,2,0,0,0,0|2,0,0]=4 22726 B18R2.6467 Cc1cccc(c1)SCC(O)c2ccccc2 62a_100011215228_100000185958 [0,2,0,0,0,0|2,0,0]=4 22727 B18R2.6467 Cc1cccc(c1)SC[C@@H](O)c2ccccc2 62a_100011215228_100011933945 [0,2,0,0,0,0|2,0,0]=4 22728 B18R2.6467 Cc1cccc(c1)SC[C@@H](O)c2ccccc2 62a_100011933945_100011215228 [0,2,0,0,0,0|2,0,0]=4 22729 B18R2.6467 Cc1cccc(n1)CNC(C)c2ccccc2 34a_100000701342_100000211855 [0,2,0,0,0,0|2,0,0]=4 22730 B18R2.6467 Cc1cccc(n1)CN[C@H](C)c2ccccc2 207a_100000751104_100011215050 [0,2,0,0,0,0|2,0,0]=4 22731 B18R2.6467 Cc1cccc(n1)CN[C@H](C)c2ccccc2 2230a_100000751104_100000757606 [0,2,0,0,0,0|2,0,0]=4 22732 B18R2.6467 Cc1cccc(n1)CN[C@H](C)c2ccccc2 270004a_100000751104_100011215050 [0,2,0,0,0,0|2,0,0]=4 22733 B18R2.6467 Cc1cccc(n1)COC(C)c2ccccc2 34a_100000690600_100000211855 [0,2,0,0,0,0|1,0,0]=3 22734 B18R2.6467 Cc1cccc(n1)CO[C@H](C)c2ccccc2 34a_100000761318_100000757606 [0,2,0,0,0,0|1,0,0]=3 22735 B18R2.6467 Cc1cccc(n1)CO[C@H](C)c2ccccc2 7a_100000761318_100000757606 [0,2,0,0,0,0|1,0,0]=3 22736 B18R2.6467 Cc1cccc(n1)CSC(C)c2ccccc2 62a_100000230085_100000757606 [0,2,0,0,0,0|1,1,0]=4 22737 B18R2.6467 Cc1cccc(n1)CSC(C)c2ccccc2 62a_100000757606_100000230085 [0,2,0,0,0,0|1,1,0]=4 22738 B18R2.6467 Cc1ccnc(c1)CN[C@H](C)c2ccccc2 207a_100000751104_100011361488 [0,2,0,0,0,0|2,0,0]=4 22739 B18R2.6467 Cc1ccnc(c1)CN[C@H](C)c2ccccc2 2230a_100000751104_100000718516 [0,2,0,0,0,0|2,0,0]=4 22740 B18R2.6467 Cc1ccnc(c1)CN[C@H](C)c2ccccc2 270004a_100000751104_100011361488 [0,2,0,0,0,0|2,0,0]=4 22741 B18R2.6467 Cc1ccnc(c1)COC(C)c2ccccc2 34a_100011998357_100000211855 [0,2,0,0,0,0|1,0,0]=3 22742 B18R2.6467 Cc1ccnc(c1)CO[C@H](C)c2ccccc2 34a_100000761318_100000718516 [0,2,0,0,0,0|1,0,0]=3 22743 B18R2.6467 Cc1ccnc(c1)CO[C@H](C)c2ccccc2 7a_100000761318_100000718516 [0,2,0,0,0,0|1,0,0]=3 22744 B18R2.6467 Cc1ccnc(c1)CSC(C)c2ccccc2 62a_100000230085_100000718516 [0,2,0,0,0,0|1,1,0]=4 22745 B18R2.6467 Cc1ccnc(c1)CSC(C)c2ccccc2 62a_100000718516_100000230085 [0,2,0,0,0,0|1,1,0]=4 22746 B18R2.6467 Cc1cncc(c1)CNC(C)c2ccccc2 2230a_100000692839_100000230085 [0,2,0,0,0,0|2,0,0]=4 22747 B18R2.6467 Cc1cncc(c1)CNC(C)c2ccccc2 269862a_100000692839_100000185851 [0,2,0,0,0,0|2,0,0]=4 22748 B18R2.6467 Cc1cncc(c1)CNC(C)c2ccccc2 34a_100000692839_100000211855 [0,2,0,0,0,0|2,0,0]=4 22749 B18R2.6467 Cc1cncc(c1)CN[C@H](C)c2ccccc2 207a_100000751104_100011998712 [0,2,0,0,0,0|2,0,0]=4 22750 B18R2.6467 Cc1cncc(c1)CN[C@H](C)c2ccccc2 2230a_100000751104_100000716715 [0,2,0,0,0,0|2,0,0]=4 22751 B18R2.6467 Cc1cncc(c1)CN[C@H](C)c2ccccc2 270004a_100000751104_100011998712 [0,2,0,0,0,0|2,0,0]=4 22752 B18R2.6467 Cc1cncc(c1)COC(C)c2ccccc2 34a_100011998709_100000211855 [0,2,0,0,0,0|1,0,0]=3 22753 B18R2.6467 Cc1cncc(c1)COC(C)c2ccccc2 7a_100011998709_100000230085 [0,2,0,0,0,0|1,0,0]=3 22754 B18R2.6467 Cc1cncc(c1)CO[C@H](C)c2ccccc2 34a_100000761318_100000716715 [0,2,0,0,0,0|1,0,0]=3 22755 B18R2.6467 Cc1cncc(c1)CO[C@H](C)c2ccccc2 7a_100000761318_100000716715 [0,2,0,0,0,0|1,0,0]=3 22756 B18R2.6467 Cc1cncc(c1)CSC(C)c2ccccc2 62a_100000230085_100000716715 [0,2,0,0,0,0|1,1,0]=4 22757 B18R2.6467 Cc1cncc(c1)CSC(C)c2ccccc2 62a_100000716715_100000230085 [0,2,0,0,0,0|1,1,0]=4 22758 B18R2.6467 Cc1cnnc(c1)COC(C)c2ccccc2 34a_100016212594_100000211855 [0,2,0,0,0,0|2,0,0]=4 22759 B18R2.6467 Nc1cccc(c1)OCC(O)c2ccccc2 34a_100000210217_100000185958 [0,2,0,0,0,0|2,0,0]=4 22760 B18R2.6467 Nc1cccc(c1)OC[C@@H](O)c2ccccc2 34a_100000210217_100011933945 [0,2,0,0,0,0|2,0,0]=4 22761 B18R2.6467 Nc1cccc(c1)SCC(O)c2ccccc2 62a_100000185958_100000210019 [0,2,0,0,0,0|2,0,0]=4 22762 B18R2.6467 Nc1cccc(c1)SCC(O)c2ccccc2 62a_100000210019_100000185958 [0,2,0,0,0,0|2,0,0]=4 22763 B18R2.6467 Nc1cccc(c1)SC[C@@H](O)c2ccccc2 62a_100000210019_100011933945 [0,2,0,0,0,0|2,0,0]=4 22764 B18R2.6467 Nc1cccc(c1)SC[C@@H](O)c2ccccc2 62a_100011933945_100000210019 [0,2,0,0,0,0|2,0,0]=4 22765 B18R2.6467 O=C(CCc1cccc(c1)Br)c2ccccc2 1458a_100000185807_100011740638 [0,2,0,0,0,0|1,0,1]=4 22766 B18R2.6467 O=C(CCc1cccc(c1)Cl)c2ccccc2 1458a_100000185807_100011713710 [0,2,0,0,0,0|1,0,1]=4 22767 B18R2.6467 O=C(CCc1cccc(c1)F)c2ccccc2 1458a_100000185807_100011217235 [0,2,0,0,0,0|1,0,1]=4 22768 B18R2.6467 O=C(NCc1cccc(c1)Br)c2ccccc2 11a_100000174977_100000185807 [0,2,0,0,0,0|1,0,1]=4 22769 B18R2.6467 O=C(NCc1cccc(c1)Br)c2ccccc2 1626a_100000174977_100000185807 [0,2,0,0,0,0|1,0,1]=4 22770 B18R2.6467 O=C(NCc1cccc(c1)Br)c2ccccc2 240690a_100000174977_100000185807 [0,2,0,0,0,0|1,0,1]=4 22771 B18R2.6467 O=C(NCc1cccc(c1)Br)c2ccccc2 527a_100000174977_100000185807 [0,2,0,0,0,0|1,0,1]=4 22772 B18R2.6467 O=C(NCc1cccc(c1)Cl)c2ccccc2 11a_100000174878_100000185807 [0,2,0,0,0,0|1,0,1]=4 22773 B18R2.6467 O=C(NCc1cccc(c1)Cl)c2ccccc2 1626a_100000174878_100000185807 [0,2,0,0,0,0|1,0,1]=4 22774 B18R2.6467 O=C(NCc1cccc(c1)Cl)c2ccccc2 240690a_100000174878_100000185807 [0,2,0,0,0,0|1,0,1]=4 22775 B18R2.6467 O=C(NCc1cccc(c1)Cl)c2ccccc2 527a_100000174878_100000185807 [0,2,0,0,0,0|1,0,1]=4 22776 B18R2.6467 O=C(NCc1cccc(c1)F)c2ccccc2 11a_100000174948_100000185807 [0,2,0,0,0,0|1,0,1]=4 22777 B18R2.6467 O=C(NCc1cccc(c1)F)c2ccccc2 1626a_100000174948_100000185807 [0,2,0,0,0,0|1,0,1]=4 22778 B18R2.6467 O=C(NCc1cccc(c1)F)c2ccccc2 240690a_100000174948_100000185807 [0,2,0,0,0,0|1,0,1]=4 22779 B18R2.6467 O=C(NCc1cccc(c1)F)c2ccccc2 527a_100000174948_100000185807 [0,2,0,0,0,0|1,0,1]=4 22780 B18R2.6467 O=C(NCc1cccc(c1)I)c2ccccc2 11a_100000106179_100000185807 [0,2,0,0,0,0|1,0,1]=4 22781 B18R2.6467 O=C(NCc1cccc(c1)I)c2ccccc2 1626a_100000106179_100000185807 [0,2,0,0,0,0|1,0,1]=4 22782 B18R2.6467 O=C(NCc1cccc(c1)I)c2ccccc2 240690a_100000106179_100000185807 [0,2,0,0,0,0|1,0,1]=4 22783 B18R2.6467 O=C(NCc1cccc(c1)I)c2ccccc2 527a_100000106179_100000185807 [0,2,0,0,0,0|1,0,1]=4 22784 B18R2.6467 O=C(NCc1cccc(c1)O)c2ccccc2 240690a_100000743036_100000185807 [0,2,0,0,0,0|1,0,1]=4 22785 B18R2.6467 O=C(NCc1cccc(c1)O)c2ccccc2 527a_100000743036_100000185807 [0,2,0,0,0,0|1,0,1]=4 22786 B18R2.6467 OC(CNc1cccc(c1)Br)c2ccccc2 34a_100000210019_100000185958 [0,2,0,0,0,0|2,0,0]=4 22787 B18R2.6467 OC(CNc1cccc(c1)Cl)c2ccccc2 34a_100000185859_100000185958 [0,2,0,0,0,0|2,0,0]=4 22788 B18R2.6467 OC(CNc1cccc(c1)F)c2ccccc2 34a_100000210047_100000185958 [0,2,0,0,0,0|2,0,0]=4 22789 B18R2.6467 OC(CNc1cccc(c1)I)c2ccccc2 34a_100000211102_100000185958 [0,2,0,0,0,0|2,0,0]=4 22790 B18R2.6467 OC(COc1cccc(c1)Br)c2ccccc2 34a_100000210342_100000185958 [0,2,0,0,0,0|2,0,0]=4 22791 B18R2.6467 OC(COc1cccc(c1)Br)c2ccccc2 7a_100000210342_100000185958 [0,2,0,0,0,0|2,0,0]=4 22792 B18R2.6467 OC(COc1cccc(c1)Cl)c2ccccc2 34a_100000210295_100000185958 [0,2,0,0,0,0|2,0,0]=4 22793 B18R2.6467 OC(COc1cccc(c1)Cl)c2ccccc2 7a_100000210295_100000185958 [0,2,0,0,0,0|2,0,0]=4 22794 B18R2.6467 OC(COc1cccc(c1)F)c2ccccc2 34a_100000210426_100000185958 [0,2,0,0,0,0|2,0,0]=4 22795 B18R2.6467 OC(COc1cccc(c1)F)c2ccccc2 7a_100000210426_100000185958 [0,2,0,0,0,0|2,0,0]=4 22796 B18R2.6467 OC(COc1cccc(c1)I)c2ccccc2 34a_100000211634_100000185958 [0,2,0,0,0,0|2,0,0]=4 22797 B18R2.6467 OC(COc1cccc(c1)I)c2ccccc2 7a_100000211634_100000185958 [0,2,0,0,0,0|2,0,0]=4 22798 B18R2.6467 OC(CSc1cccc(c1)Br)c2ccccc2 62a_100000185958_100000691529 [0,2,0,0,0,0|2,0,0]=4 22799 B18R2.6467 OC(CSc1cccc(c1)Br)c2ccccc2 62a_100000691529_100000185958 [0,2,0,0,0,0|2,0,0]=4 22800 B18R2.6467 OC(CSc1cccc(c1)Cl)c2ccccc2 62a_100000185958_100000699651 [0,2,0,0,0,0|2,0,0]=4 22801 B18R2.6467 OC(CSc1cccc(c1)Cl)c2ccccc2 62a_100000699651_100000185958 [0,2,0,0,0,0|2,0,0]=4 22802 B18R2.6467 OC(CSc1cccc(c1)F)c2ccccc2 62a_100000185958_100000685547 [0,2,0,0,0,0|2,0,0]=4 22803 B18R2.6467 OC(CSc1cccc(c1)F)c2ccccc2 62a_100000685547_100000185958 [0,2,0,0,0,0|2,0,0]=4 22804 B18R2.6467 OC(CSc1cccc(c1)[S])c2ccccc2 62a_100000185958_114929384022 [0,2,0,0,0,0|2,0,0]=4 22805 B18R2.6467 OC(CSc1cccc(c1)[S])c2ccccc2 62a_114929384022_100000185958 [0,2,0,0,0,0|2,0,0]=4 22806 B18R2.6467 O[C@H](CNc1cccc(c1)Br)c2ccccc2 34a_100000210019_100011933945 [0,2,0,0,0,0|2,0,0]=4 22807 B18R2.6467 O[C@H](CNc1cccc(c1)Cl)c2ccccc2 34a_100000185859_100011933945 [0,2,0,0,0,0|2,0,0]=4 22808 B18R2.6467 O[C@H](CNc1cccc(c1)F)c2ccccc2 34a_100000210047_100011933945 [0,2,0,0,0,0|2,0,0]=4 22809 B18R2.6467 O[C@H](CNc1cccc(c1)I)c2ccccc2 34a_100000211102_100011933945 [0,2,0,0,0,0|2,0,0]=4 22810 B18R2.6467 O[C@H](COc1cccc(c1)Br)c2ccccc2 34a_100000210342_100011933945 [0,2,0,0,0,0|2,0,0]=4 22811 B18R2.6467 O[C@H](COc1cccc(c1)Br)c2ccccc2 7a_100000210342_100011933945 [0,2,0,0,0,0|2,0,0]=4 22812 B18R2.6467 O[C@H](COc1cccc(c1)Cl)c2ccccc2 34a_100000210295_100011933945 [0,2,0,0,0,0|2,0,0]=4 22813 B18R2.6467 O[C@H](COc1cccc(c1)Cl)c2ccccc2 7a_100000210295_100011933945 [0,2,0,0,0,0|2,0,0]=4 22814 B18R2.6467 O[C@H](COc1cccc(c1)F)c2ccccc2 34a_100000210426_100011933945 [0,2,0,0,0,0|2,0,0]=4 22815 B18R2.6467 O[C@H](COc1cccc(c1)F)c2ccccc2 7a_100000210426_100011933945 [0,2,0,0,0,0|2,0,0]=4 22816 B18R2.6467 O[C@H](COc1cccc(c1)I)c2ccccc2 34a_100000211634_100011933945 [0,2,0,0,0,0|2,0,0]=4 22817 B18R2.6467 O[C@H](COc1cccc(c1)I)c2ccccc2 7a_100000211634_100011933945 [0,2,0,0,0,0|2,0,0]=4 22818 B18R2.6467 O[C@H](CSc1cccc(c1)Br)c2ccccc2 62a_100000691529_100011933945 [0,2,0,0,0,0|2,0,0]=4 22819 B18R2.6467 O[C@H](CSc1cccc(c1)Br)c2ccccc2 62a_100011933945_100000691529 [0,2,0,0,0,0|2,0,0]=4 22820 B18R2.6467 O[C@H](CSc1cccc(c1)Cl)c2ccccc2 62a_100000699651_100011933945 [0,2,0,0,0,0|2,0,0]=4 22821 B18R2.6467 O[C@H](CSc1cccc(c1)Cl)c2ccccc2 62a_100011933945_100000699651 [0,2,0,0,0,0|2,0,0]=4 22822 B18R2.6467 O[C@H](CSc1cccc(c1)F)c2ccccc2 62a_100000685547_100011933945 [0,2,0,0,0,0|2,0,0]=4 22823 B18R2.6467 O[C@H](CSc1cccc(c1)F)c2ccccc2 62a_100011933945_100000685547 [0,2,0,0,0,0|2,0,0]=4 22824 B18R2.6467 O[C@H](CSc1cccc(c1)[S])c2ccccc2 62a_100011933945_114929384022 [0,2,0,0,0,0|2,0,0]=4 22825 B18R2.6467 O[C@H](CSc1cccc(c1)[S])c2ccccc2 62a_114929384022_100011933945 [0,2,0,0,0,0|2,0,0]=4 22826 B18R2.6467 Oc1cccc(c1)NCC(O)c2ccccc2 34a_100000210217_100000185958 [0,2,0,0,0,0|2,0,0]=4 22827 B18R2.6467 Oc1cccc(c1)NC[C@@H](O)c2ccccc2 34a_100000210217_100011933945 [0,2,0,0,0,0|2,0,0]=4 22828 B18R2.6467 Oc1cccc(c1)SCC(O)c2ccccc2 62a_100000185958_100000211634 [0,2,0,0,0,0|2,0,0]=4 22829 B18R2.6467 Oc1cccc(c1)SC[C@@H](O)c2ccccc2 62a_100011933945_100000211634 [0,2,0,0,0,0|2,0,0]=4 22830 B18R2.32237 CC(C)(CSc1ccccc1)c2ccccc2 62a_100000703224_100000041952 [0,2,0,0,0,0|2,0,0]=4 22831 B18R2.32237 CC(C)(CSc1ccccc1)c2ccccc2 62a_100000719477_100000703224 [0,2,0,0,0,0|2,0,0]=4 22832 B18R2.32237 CC(C)(NCc1ccccc1)c2ccccc2 207a_100011218174_100015611070 [0,2,0,0,0,0|1,0,0]=3 22833 B18R2.32237 CC(C)(NCc1ccccc1)c2ccccc2 2230a_100011218174_100015291786 [0,2,0,0,0,0|1,0,0]=3 22834 B18R2.32237 CC(C)(NCc1ccccc1)c2ccccc2 2230a_100015324214_100000034625 [0,2,0,0,0,0|1,0,0]=3 22835 B18R2.32237 CC(C)(NCc1ccccc1)c2ccccc2 270004a_100011218174_100015611070 [0,2,0,0,0,0|1,0,0]=3 22836 B18R2.32237 CC(C)(NCc1ccccc1)c2ccccn2 207a_100011999416_100015611070 [0,2,0,0,0,0|2,0,0]=4 22837 B18R2.32237 CC(C)(NCc1ccccc1)c2ccccn2 2230a_100011999416_100015291786 [0,2,0,0,0,0|2,0,0]=4 22838 B18R2.32237 CC(C)(NCc1ccccc1)c2ccccn2 270004a_100011999416_100015611070 [0,2,0,0,0,0|2,0,0]=4 22839 B18R2.32237 CC(C)(NCc1ccccc1)c2cccnc2 207a_100011376175_100015611070 [0,2,0,0,0,0|2,0,0]=4 22840 B18R2.32237 CC(C)(NCc1ccccc1)c2cccnc2 2230a_100011376175_100015291786 [0,2,0,0,0,0|2,0,0]=4 22841 B18R2.32237 CC(C)(NCc1ccccc1)c2cccnc2 270004a_100011376175_100015611070 [0,2,0,0,0,0|2,0,0]=4 22842 B18R2.32237 CC(C)(NCc1ccccn1)c2ccccc2 207a_100011218174_100000209966 [0,2,0,0,0,0|2,0,0]=4 22843 B18R2.32237 CC(C)(NCc1ccccn1)c2ccccc2 2230a_100011218174_100000721315 [0,2,0,0,0,0|2,0,0]=4 22844 B18R2.32237 CC(C)(NCc1ccccn1)c2ccccc2 270004a_100011218174_100000209966 [0,2,0,0,0,0|2,0,0]=4 22845 B18R2.32237 CC(C)(NCc1cccnc1)c2ccccc2 207a_100011218174_100000209961 [0,2,0,0,0,0|2,0,0]=4 22846 B18R2.32237 CC(C)(NCc1cccnc1)c2ccccc2 2230a_100011218174_100000741622 [0,2,0,0,0,0|2,0,0]=4 22847 B18R2.32237 CC(C)(NCc1cccnc1)c2ccccc2 270004a_100011218174_100000209961 [0,2,0,0,0,0|2,0,0]=4 22848 B18R2.32237 CC(C)(NCc1ccncc1)c2ccccc2 207a_100011218174_100000186114 [0,2,0,0,0,0|2,0,0]=4 22849 B18R2.32237 CC(C)(NCc1ccncc1)c2ccccc2 2230a_100011218174_100015193705 [0,2,0,0,0,0|2,0,0]=4 22850 B18R2.32237 CC(C)(OCc1ccccc1)c2ccccc2 7a_100000694644_100000211182 [0,2,0,0,0,0|0,0,0]=2 22851 B18R2.32237 CC(C)(OCc1ccccc1)c2ccccn2 7a_100000041474_100000211182 [0,2,0,0,0,0|1,0,0]=3 22852 B18R2.32237 CC(C)(OCc1ccccn1)c2ccccc2 7a_100000694644_100000721315 [0,2,0,0,0,0|1,0,0]=3 22853 B18R2.32237 CC(C)(OCc1ccccn1)c2ccccn2 7a_100000041474_100000721315 [0,2,0,0,0,0|2,0,0]=4 22854 B18R2.32237 CC(C)(OCc1cccnc1)c2ccccc2 7a_100000694644_100000741622 [0,2,0,0,0,0|1,0,0]=3 22855 B18R2.32237 CC(C)(OCc1cccnc1)c2ccccn2 7a_100000041474_100000741622 [0,2,0,0,0,0|2,0,0]=4 22856 B18R2.32237 CC(C)(OCc1cccnn1)c2ccccc2 7a_100000694644_100016990269 [0,2,0,0,0,0|2,0,0]=4 22857 B18R2.32237 CC(C)(OCc1ccncc1)c2ccccc2 7a_100000694644_100015193705 [0,2,0,0,0,0|1,0,0]=3 22858 B18R2.32237 CC(C)(OCc1ccncc1)c2ccccn2 7a_100000041474_100015193705 [0,2,0,0,0,0|2,0,0]=4 22859 B18R2.32237 CC(C)(OCc1cnccn1)c2ccccc2 7a_100000694644_100016995436 [0,2,0,0,0,0|2,0,0]=4 22860 B18R2.32237 CC(C)(OCc1cncnc1)c2ccccc2 7a_100000694644_100015196519 [0,2,0,0,0,0|2,0,0]=4 22861 B18R2.32237 CC(C)(OCc1ncccn1)c2ccccc2 7a_100000694644_100000703007 [0,2,0,0,0,0|2,0,0]=4 22862 B18R2.32237 CC(C)(SCc1ccccc1)c2ccccc2 62a_100000034625_100015291786 [0,2,0,0,0,0|0,1,0]=3 22863 B18R2.32237 CC(C)(SCc1ccccc1)c2ccccc2 62a_100000211182_100000034625 [0,2,0,0,0,0|0,1,0]=3 22864 B18R2.32237 CC(C)(SCc1ccccn1)c2ccccc2 62a_100000034625_100000721315 [0,2,0,0,0,0|1,1,0]=4 22865 B18R2.32237 CC(C)(SCc1ccccn1)c2ccccc2 62a_100000721315_100000034625 [0,2,0,0,0,0|1,1,0]=4 22866 B18R2.32237 CC(C)(SCc1cccnc1)c2ccccc2 62a_100000034625_100000741622 [0,2,0,0,0,0|1,1,0]=4 22867 B18R2.32237 CC(C)(SCc1cccnc1)c2ccccc2 62a_100000741622_100000034625 [0,2,0,0,0,0|1,1,0]=4 22868 B18R2.32237 CC(C)(SCc1ccncc1)c2ccccc2 62a_100000034625_100015193705 [0,2,0,0,0,0|1,1,0]=4 22869 B18R2.32237 CC(C)(SCc1ccncc1)c2ccccc2 62a_100015193705_100000034625 [0,2,0,0,0,0|1,1,0]=4 22870 B18R2.32237 FC(F)(CNc1ccccc1)c2ccccc2 34a_100000106764_100009875531 [0,2,0,0,0,0|2,0,0]=4 22871 B18R2.32237 FC(F)(COc1ccccc1)c2ccccc2 34a_100000210340_100009875531 [0,2,0,0,0,0|2,0,0]=4 22872 B18R2.32237 FC(F)(CSc1ccccc1)c2ccccc2 62a_100000719477_100009875531 [0,2,0,0,0,0|2,0,0]=4 22873 B18R2.32237 FC(F)(CSc1ccccc1)c2ccccc2 62a_100009875531_100000041952 [0,2,0,0,0,0|2,0,0]=4 22874 B18R2.32237 FC(F)(OCc1ccccc1)c2ccccc2 7a_100000210790_100000036403 [0,2,0,0,0,0|0,0,0]=2 22875 B18R2.32237 FC(F)(SCc1ccccc1)c2ccccc2 62a_100000211182_100000036403 [0,2,0,0,0,0|0,1,0]=3 22876 B18R2.32237 FC(F)(SCc1ccccn1)c2ccccc2 62a_100000721315_100000036403 [0,2,0,0,0,0|1,1,0]=4 22877 B18R2.32237 FC(F)(SCc1cccnc1)c2ccccc2 62a_100000741622_100000036403 [0,2,0,0,0,0|1,1,0]=4 22878 B18R2.32237 FC(F)(SCc1ccncc1)c2ccccc2 62a_100015193705_100000036403 [0,2,0,0,0,0|1,1,0]=4 22879 B18R2.32237 O=S(=O)(NCc1ccccc1)c2ccccc2 270084a_100015324214_100000210345 [0,2,0,0,0,0|2,0,0]=4 22880 B18R2.32237 O=S(=O)(NCc1ccccc1)c2ccccc2 274078a_100015324214_100000210345 [0,2,0,0,0,0|2,0,0]=4 22881 B18R2.32237 O=S(=O)(NCc1ccccc1)c2ccccc2 40a_100015324214_100000032697 [0,2,0,0,0,0|2,0,0]=4 22882 B18R2.445 BrCc1ccccc1COCc2ccccc2 34a_100009816955_100015291786 [0,2,0,0,0,0|0,0,0]=2 22883 B18R2.445 BrCc1ccccc1COCc2ccccc2 7a_100009816955_100000211182 [0,2,0,0,0,0|0,0,0]=2 22884 B18R2.445 BrCc1ccccc1COCc2ccccn2 34a_100009816955_100000721315 [0,2,0,0,0,0|1,0,0]=3 22885 B18R2.445 BrCc1ccccc1COCc2ccccn2 7a_100009816955_100000721315 [0,2,0,0,0,0|1,0,0]=3 22886 B18R2.445 BrCc1ccccc1COCc2cccnc2 34a_100009816955_100000733263 [0,2,0,0,0,0|1,0,0]=3 22887 B18R2.445 BrCc1ccccc1COCc2cccnc2 7a_100009816955_100000741622 [0,2,0,0,0,0|1,0,0]=3 22888 B18R2.445 BrCc1ccccc1COCc2cccnn2 34a_100009816955_100016990269 [0,2,0,0,0,0|2,0,0]=4 22889 B18R2.445 BrCc1ccccc1COCc2cccnn2 7a_100009816955_100016990269 [0,2,0,0,0,0|2,0,0]=4 22890 B18R2.445 BrCc1ccccc1COCc2ccncc2 7a_100009816955_100015193705 [0,2,0,0,0,0|1,0,0]=3 22891 B18R2.445 BrCc1ccccc1COCc2cnccn2 34a_100009816955_100016995436 [0,2,0,0,0,0|2,0,0]=4 22892 B18R2.445 BrCc1ccccc1COCc2cnccn2 7a_100009816955_100016995436 [0,2,0,0,0,0|2,0,0]=4 22893 B18R2.445 BrCc1ccccc1COCc2cncnc2 34a_100009816955_100015196519 [0,2,0,0,0,0|2,0,0]=4 22894 B18R2.445 BrCc1ccccc1COCc2cncnc2 7a_100009816955_100015196519 [0,2,0,0,0,0|2,0,0]=4 22895 B18R2.445 BrCc1ccccc1COCc2ncccn2 34a_100009816955_100000703007 [0,2,0,0,0,0|2,0,0]=4 22896 B18R2.445 BrCc1ccccc1COCc2ncccn2 7a_100009816955_100000703007 [0,2,0,0,0,0|2,0,0]=4 22897 B18R2.445 C#Cc1ccccc1CNCc2ccccc2 270004a_100020634229_100015611070 [0,2,0,0,0,0|1,0,0]=3 22898 B18R2.445 C#Cc1ccccc1CNCc2ccccc2 34a_100020634229_100015291786 [0,2,0,0,0,0|1,0,0]=3 22899 B18R2.445 C#Cc1ccccc1CNCc2ccccn2 270004a_100020634229_100000209966 [0,2,0,0,0,0|2,0,0]=4 22900 B18R2.445 C#Cc1ccccc1CNCc2ccccn2 34a_100020634229_100000721315 [0,2,0,0,0,0|2,0,0]=4 22901 B18R2.445 C#Cc1ccccc1CNCc2cccnc2 270004a_100020634229_100000209961 [0,2,0,0,0,0|2,0,0]=4 22902 B18R2.445 C#Cc1ccccc1CNCc2cccnc2 34a_100020634229_100000733263 [0,2,0,0,0,0|2,0,0]=4 22903 B18R2.445 C#Cc1ccccc1COCc2ccccc2 34a_100000054652_100015291786 [0,2,0,0,0,0|0,0,0]=2 22904 B18R2.445 C#Cc1ccccc1COCc2ccccc2 7a_100000054652_100000211182 [0,2,0,0,0,0|0,0,0]=2 22905 B18R2.445 C#Cc1ccccc1COCc2ccccn2 34a_100000054652_100000721315 [0,2,0,0,0,0|1,0,0]=3 22906 B18R2.445 C#Cc1ccccc1COCc2ccccn2 7a_100000054652_100000721315 [0,2,0,0,0,0|1,0,0]=3 22907 B18R2.445 C#Cc1ccccc1COCc2cccnc2 34a_100000054652_100000733263 [0,2,0,0,0,0|1,0,0]=3 22908 B18R2.445 C#Cc1ccccc1COCc2cccnc2 7a_100000054652_100000741622 [0,2,0,0,0,0|1,0,0]=3 22909 B18R2.445 C#Cc1ccccc1COCc2cccnn2 34a_100000054652_100016990269 [0,2,0,0,0,0|2,0,0]=4 22910 B18R2.445 C#Cc1ccccc1COCc2cccnn2 7a_100000054652_100016990269 [0,2,0,0,0,0|2,0,0]=4 22911 B18R2.445 C#Cc1ccccc1COCc2ccncc2 7a_100000054652_100015193705 [0,2,0,0,0,0|1,0,0]=3 22912 B18R2.445 C#Cc1ccccc1COCc2cnccn2 34a_100000054652_100016995436 [0,2,0,0,0,0|2,0,0]=4 22913 B18R2.445 C#Cc1ccccc1COCc2cnccn2 7a_100000054652_100016995436 [0,2,0,0,0,0|2,0,0]=4 22914 B18R2.445 C#Cc1ccccc1COCc2cncnc2 34a_100000054652_100015196519 [0,2,0,0,0,0|2,0,0]=4 22915 B18R2.445 C#Cc1ccccc1COCc2cncnc2 7a_100000054652_100015196519 [0,2,0,0,0,0|2,0,0]=4 22916 B18R2.445 C#Cc1ccccc1COCc2ncccn2 34a_100000054652_100000703007 [0,2,0,0,0,0|2,0,0]=4 22917 B18R2.445 C#Cc1ccccc1COCc2ncccn2 7a_100000054652_100000703007 [0,2,0,0,0,0|2,0,0]=4 22918 B18R2.445 C#Cc1ccccc1NCCc2ccccc2 34a_100011470550_100000765856 [0,2,0,0,0,0|2,0,0]=4 22919 B18R2.445 C#Cc1ccccc1OCCc2ccccc2 34a_200011470546_100000765856 [0,2,0,0,0,0|2,0,0]=4 22920 B18R2.445 C#Cc1ccccc1OCCc2ccccc2 7a_200011470546_100000765856 [0,2,0,0,0,0|2,0,0]=4 22921 B18R2.445 C=Cc1ccccc1CNCc2ccccc2 271570a_100011290941_200000195884 [0,2,0,0,0,0|1,0,0]=3 22922 B18R2.445 C=Cc1ccccc1COCc2ccccc2 34a_200010883148_100015291786 [0,2,0,0,0,0|0,0,0]=2 22923 B18R2.445 C=Cc1ccccc1COCc2ccccc2 7a_200010883148_100000211182 [0,2,0,0,0,0|0,0,0]=2 22924 B18R2.445 C=Cc1ccccc1COCc2ccccn2 34a_200010883148_100000721315 [0,2,0,0,0,0|1,0,0]=3 22925 B18R2.445 C=Cc1ccccc1COCc2ccccn2 7a_200010883148_100000721315 [0,2,0,0,0,0|1,0,0]=3 22926 B18R2.445 C=Cc1ccccc1COCc2cccnc2 34a_200010883148_100000733263 [0,2,0,0,0,0|1,0,0]=3 22927 B18R2.445 C=Cc1ccccc1COCc2cccnc2 7a_200010883148_100000741622 [0,2,0,0,0,0|1,0,0]=3 22928 B18R2.445 C=Cc1ccccc1COCc2cccnn2 34a_200010883148_100016990269 [0,2,0,0,0,0|2,0,0]=4 22929 B18R2.445 C=Cc1ccccc1COCc2cccnn2 7a_200010883148_100016990269 [0,2,0,0,0,0|2,0,0]=4 22930 B18R2.445 C=Cc1ccccc1COCc2ccncc2 7a_200010883148_100015193705 [0,2,0,0,0,0|1,0,0]=3 22931 B18R2.445 C=Cc1ccccc1COCc2cnccn2 34a_200010883148_100016995436 [0,2,0,0,0,0|2,0,0]=4 22932 B18R2.445 C=Cc1ccccc1COCc2cnccn2 7a_200010883148_100016995436 [0,2,0,0,0,0|2,0,0]=4 22933 B18R2.445 C=Cc1ccccc1COCc2cncnc2 34a_200010883148_100015196519 [0,2,0,0,0,0|2,0,0]=4 22934 B18R2.445 C=Cc1ccccc1COCc2cncnc2 7a_200010883148_100015196519 [0,2,0,0,0,0|2,0,0]=4 22935 B18R2.445 C=Cc1ccccc1COCc2ncccn2 34a_200010883148_100000703007 [0,2,0,0,0,0|2,0,0]=4 22936 B18R2.445 C=Cc1ccccc1COCc2ncccn2 7a_200010883148_100000703007 [0,2,0,0,0,0|2,0,0]=4 22937 B18R2.445 C=Cc1ccccc1NCCc2ccccc2 34a_100012022501_100000765856 [0,2,0,0,0,0|2,0,0]=4 22938 B18R2.445 C=Cc1ccccc1SCCc2ccccc2 62a_100000765856_100011218376 [0,2,0,0,0,0|2,0,0]=4 22939 B18R2.445 C=Cc1ccccc1SCCc2ccccc2 62a_100011218376_100011218657 [0,2,0,0,0,0|2,0,0]=4 22940 B18R2.445 CCc1ccccc1C=CCc2ccccc2 271570a_200016263579_100011215823 [0,2,0,0,0,0|1,0,1]=4 22941 B18R2.445 CCc1ccccc1CNCc2ccccc2 207a_100015324214_100011219594 [0,2,0,0,0,0|1,0,0]=3 22942 B18R2.445 CCc1ccccc1CNCc2ccccc2 270004a_100015324214_100011219594 [0,2,0,0,0,0|1,0,0]=3 22943 B18R2.445 CCc1ccccc1CNCc2ccccn2 270004a_100000210449_100011219594 [0,2,0,0,0,0|2,0,0]=4 22944 B18R2.445 CCc1ccccc1CNCc2cccnc2 207a_100000210453_100011219594 [0,2,0,0,0,0|2,0,0]=4 22945 B18R2.445 CCc1ccccc1CNCc2cccnc2 270004a_100000210453_100011219594 [0,2,0,0,0,0|2,0,0]=4 22946 B18R2.445 CCc1ccccc1COCc2ccccc2 34a_100011663872_100015291786 [0,2,0,0,0,0|0,0,0]=2 22947 B18R2.445 CCc1ccccc1COCc2ccccc2 7a_100011663872_100000211182 [0,2,0,0,0,0|0,0,0]=2 22948 B18R2.445 CCc1ccccc1COCc2ccccn2 34a_100011663872_100000721315 [0,2,0,0,0,0|1,0,0]=3 22949 B18R2.445 CCc1ccccc1COCc2ccccn2 7a_100011663872_100000721315 [0,2,0,0,0,0|1,0,0]=3 22950 B18R2.445 CCc1ccccc1COCc2cccnc2 34a_100011663872_100000733263 [0,2,0,0,0,0|1,0,0]=3 22951 B18R2.445 CCc1ccccc1COCc2cccnc2 7a_100011663872_100000741622 [0,2,0,0,0,0|1,0,0]=3 22952 B18R2.445 CCc1ccccc1COCc2cccnn2 34a_100011663872_100016990269 [0,2,0,0,0,0|2,0,0]=4 22953 B18R2.445 CCc1ccccc1COCc2cccnn2 7a_100011663872_100016990269 [0,2,0,0,0,0|2,0,0]=4 22954 B18R2.445 CCc1ccccc1COCc2ccncc2 7a_100011663872_100015193705 [0,2,0,0,0,0|1,0,0]=3 22955 B18R2.445 CCc1ccccc1COCc2cnccn2 34a_100011663872_100016995436 [0,2,0,0,0,0|2,0,0]=4 22956 B18R2.445 CCc1ccccc1COCc2cnccn2 7a_100011663872_100016995436 [0,2,0,0,0,0|2,0,0]=4 22957 B18R2.445 CCc1ccccc1COCc2cncnc2 34a_100011663872_100015196519 [0,2,0,0,0,0|2,0,0]=4 22958 B18R2.445 CCc1ccccc1COCc2cncnc2 7a_100011663872_100015196519 [0,2,0,0,0,0|2,0,0]=4 22959 B18R2.445 CCc1ccccc1COCc2ncccn2 34a_100011663872_100000703007 [0,2,0,0,0,0|2,0,0]=4 22960 B18R2.445 CCc1ccccc1COCc2ncccn2 7a_100011663872_100000703007 [0,2,0,0,0,0|2,0,0]=4 22961 B18R2.445 CCc1ccccc1NCCc2ccccc2 2230a_100000212081_100000765856 [0,2,0,0,0,0|2,0,0]=4 22962 B18R2.445 CCc1ccccc1NCCc2ccccc2 34a_100000212081_100000765856 [0,2,0,0,0,0|2,0,0]=4 22963 B18R2.445 CCc1ccccc1NCCc2ccccc2 7a_100000212081_100000765856 [0,2,0,0,0,0|2,0,0]=4 22964 B18R2.445 CCc1ccccc1OCCc2ccccc2 34a_100000210936_100000765856 [0,2,0,0,0,0|2,0,0]=4 22965 B18R2.445 CCc1ccccc1OCCc2ccccc2 7a_100000210936_100000765856 [0,2,0,0,0,0|2,0,0]=4 22966 B18R2.445 CCc1ccccc1SCCc2ccccc2 62a_100000765856_100011215823 [0,2,0,0,0,0|2,0,0]=4 22967 B18R2.445 CCc1ccccc1SCCc2ccccc2 62a_100011215823_100011218657 [0,2,0,0,0,0|2,0,0]=4 22968 B18R2.445 CNc1ccccc1C=CCc2ccccc2 271570a_200016263579_100020606079 [0,2,0,0,0,0|1,0,1]=4 22969 B18R2.445 CNc1ccccc1OCCc2ccccc2 34a_100000033821_100000765856 [0,2,0,0,0,0|2,0,0]=4 22970 B18R2.445 CNc1ccccc1SCCc2ccccc2 62a_100000765856_100020606079 [0,2,0,0,0,0|2,0,0]=4 22971 B18R2.445 CNc1ccccc1SCCc2ccccc2 62a_100020606079_100011218657 [0,2,0,0,0,0|2,0,0]=4 22972 B18R2.445 COc1ccccc1C=CCc2ccccc2 271570a_200016263579_100000174000 [0,2,0,0,0,0|1,0,1]=4 22973 B18R2.445 COc1ccccc1CCNc2ccccc2 34a_100000106764_100011713687 [0,2,0,0,0,0|2,0,0]=4 22974 B18R2.445 COc1ccccc1CCOc2ccccc2 34a_100000210340_100011713687 [0,2,0,0,0,0|2,0,0]=4 22975 B18R2.445 COc1ccccc1CCOc2ccccc2 7a_100000210340_100011713687 [0,2,0,0,0,0|2,0,0]=4 22976 B18R2.445 COc1ccccc1CCSc2ccccc2 62a_100000719477_100011713687 [0,2,0,0,0,0|2,0,0]=4 22977 B18R2.445 COc1ccccc1CCSc2ccccc2 62a_100011713687_100000041952 [0,2,0,0,0,0|2,0,0]=4 22978 B18R2.445 COc1ccccc1CNCc2ccccc2 207a_100000188900_100015611070 [0,2,0,0,0,0|1,0,0]=3 22979 B18R2.445 COc1ccccc1CNCc2ccccc2 207a_100015324214_100000169842 [0,2,0,0,0,0|1,0,0]=3 22980 B18R2.445 COc1ccccc1CNCc2ccccc2 2230a_100015324214_100000210004 [0,2,0,0,0,0|1,0,0]=3 22981 B18R2.445 COc1ccccc1CNCc2ccccc2 270004a_100000188900_100015611070 [0,2,0,0,0,0|1,0,0]=3 22982 B18R2.445 COc1ccccc1CNCc2ccccc2 270004a_100015324214_100000169842 [0,2,0,0,0,0|1,0,0]=3 22983 B18R2.445 COc1ccccc1CNCc2ccccc2 34a_100000188900_100015291786 [0,2,0,0,0,0|1,0,0]=3 22984 B18R2.445 COc1ccccc1CNCc2ccccc2 34a_100011219060_200000210301 [0,2,0,0,0,0|1,0,0]=3 22985 B18R2.445 COc1ccccc1CNCc2ccccc2 34a_100015324214_100000210004 [0,2,0,0,0,0|1,0,0]=3 22986 B18R2.445 COc1ccccc1CNCc2ccccn2 207a_100000188900_100000209966 [0,2,0,0,0,0|2,0,0]=4 22987 B18R2.445 COc1ccccc1CNCc2ccccn2 270004a_100000188900_100000209966 [0,2,0,0,0,0|2,0,0]=4 22988 B18R2.445 COc1ccccc1CNCc2ccccn2 270004a_100000210449_100000169842 [0,2,0,0,0,0|2,0,0]=4 22989 B18R2.445 COc1ccccc1CNCc2ccccn2 34a_100000188900_100000721315 [0,2,0,0,0,0|2,0,0]=4 22990 B18R2.445 COc1ccccc1CNCc2cccnc2 207a_100000188900_100000209961 [0,2,0,0,0,0|2,0,0]=4 22991 B18R2.445 COc1ccccc1CNCc2cccnc2 207a_100000210453_100000169842 [0,2,0,0,0,0|2,0,0]=4 22992 B18R2.445 COc1ccccc1CNCc2cccnc2 270004a_100000188900_100000209961 [0,2,0,0,0,0|2,0,0]=4 22993 B18R2.445 COc1ccccc1CNCc2cccnc2 270004a_100000210453_100000169842 [0,2,0,0,0,0|2,0,0]=4 22994 B18R2.445 COc1ccccc1CNCc2cccnc2 34a_100000188900_100000733263 [0,2,0,0,0,0|2,0,0]=4 22995 B18R2.445 COc1ccccc1CNCc2ccncc2 207a_100000188900_100000186114 [0,2,0,0,0,0|2,0,0]=4 22996 B18R2.445 COc1ccccc1COCc2ccccc2 34a_100000210790_100000210004 [0,2,0,0,0,0|0,0,0]=2 22997 B18R2.445 COc1ccccc1COCc2ccccc2 34a_100000211301_100015291786 [0,2,0,0,0,0|0,0,0]=2 22998 B18R2.445 COc1ccccc1COCc2ccccc2 7a_100000210790_100000210004 [0,2,0,0,0,0|0,0,0]=2 22999 B18R2.445 COc1ccccc1COCc2ccccn2 34a_100000211301_100000721315 [0,2,0,0,0,0|1,0,0]=3 23000 B18R2.445 COc1ccccc1COCc2cccnc2 34a_100000211301_100000733263 [0,2,0,0,0,0|1,0,0]=3 23001 B18R2.445 COc1ccccc1COCc2cccnn2 34a_100000211301_100016990269 [0,2,0,0,0,0|2,0,0]=4 23002 B18R2.445 COc1ccccc1COCc2cnccn2 34a_100000211301_100016995436 [0,2,0,0,0,0|2,0,0]=4 23003 B18R2.445 COc1ccccc1COCc2cncnc2 34a_100000211301_100015196519 [0,2,0,0,0,0|2,0,0]=4 23004 B18R2.445 COc1ccccc1COCc2ncccn2 34a_100000211301_100000703007 [0,2,0,0,0,0|2,0,0]=4 23005 B18R2.445 COc1ccccc1CSCc2ccccc2 62a_100000210004_100015291786 [0,2,0,0,0,0|0,1,0]=3 23006 B18R2.445 COc1ccccc1CSCc2ccccc2 62a_100000211182_100000210004 [0,2,0,0,0,0|0,1,0]=3 23007 B18R2.445 COc1ccccc1CSCc2ccccn2 62a_100000210004_100000721315 [0,2,0,0,0,0|1,1,0]=4 23008 B18R2.445 COc1ccccc1CSCc2ccccn2 62a_100000721315_100000210004 [0,2,0,0,0,0|1,1,0]=4 23009 B18R2.445 COc1ccccc1CSCc2cccnc2 62a_100000210004_100000741622 [0,2,0,0,0,0|1,1,0]=4 23010 B18R2.445 COc1ccccc1CSCc2cccnc2 62a_100000741622_100000210004 [0,2,0,0,0,0|1,1,0]=4 23011 B18R2.445 COc1ccccc1CSCc2ccncc2 62a_100000210004_100015193705 [0,2,0,0,0,0|1,1,0]=4 23012 B18R2.445 COc1ccccc1CSCc2ccncc2 62a_100015193705_100000210004 [0,2,0,0,0,0|1,1,0]=4 23013 B18R2.445 COc1ccccc1NCCc2ccccc2 34a_100000210025_100000765856 [0,2,0,0,0,0|2,0,0]=4 23014 B18R2.445 COc1ccccc1OCCc2ccccc2 34a_100000210385_100000765856 [0,2,0,0,0,0|2,0,0]=4 23015 B18R2.445 COc1ccccc1SCCc2ccccc2 62a_100000210334_100011218657 [0,2,0,0,0,0|2,0,0]=4 23016 B18R2.445 COc1ccccc1SCCc2ccccc2 62a_100000765856_100000210334 [0,2,0,0,0,0|2,0,0]=4 23017 B18R2.445 COc1cccnc1CNCc2ccccc2 207a_100015324214_100011912573 [0,2,0,0,0,0|2,0,0]=4 23018 B18R2.445 COc1cccnc1CNCc2ccccc2 270004a_100015324214_100011912573 [0,2,0,0,0,0|2,0,0]=4 23019 B18R2.445 COc1cccnc1COCc2ccccc2 34a_100011998681_100015291786 [0,2,0,0,0,0|1,0,0]=3 23020 B18R2.445 COc1cccnc1COCc2ccccn2 34a_100011998681_100000721315 [0,2,0,0,0,0|2,0,0]=4 23021 B18R2.445 COc1cccnc1COCc2cccnc2 34a_100011998681_100000733263 [0,2,0,0,0,0|2,0,0]=4 23022 B18R2.445 COc1ccncc1CNCc2ccccc2 207a_100015324214_200011997045 [0,2,0,0,0,0|2,0,0]=4 23023 B18R2.445 COc1ccncc1CNCc2ccccc2 270004a_100015324214_200011997045 [0,2,0,0,0,0|2,0,0]=4 23024 B18R2.445 COc1cnccc1CNCc2ccccc2 207a_100015324214_100011361505 [0,2,0,0,0,0|2,0,0]=4 23025 B18R2.445 COc1cnccc1CNCc2ccccc2 2230a_100015324214_100020635607 [0,2,0,0,0,0|2,0,0]=4 23026 B18R2.445 COc1cnccc1CNCc2ccccc2 270004a_100015324214_100011361505 [0,2,0,0,0,0|2,0,0]=4 23027 B18R2.445 COc1cnccc1COCc2ccccc2 7a_100000210790_100020635607 [0,2,0,0,0,0|1,0,0]=3 23028 B18R2.445 COc1cnccc1CSCc2ccccc2 62a_100000211182_100020635607 [0,2,0,0,0,0|1,1,0]=4 23029 B18R2.445 COc1cnccc1CSCc2ccccc2 62a_100020635607_100015291786 [0,2,0,0,0,0|1,1,0]=4 23030 B18R2.445 COc1ncccc1CNCc2ccccc2 207a_100015324214_100011290804 [0,2,0,0,0,0|2,0,0]=4 23031 B18R2.445 COc1ncccc1CNCc2ccccc2 207a_100102524934_100015611070 [0,2,0,0,0,0|2,0,0]=4 23032 B18R2.445 COc1ncccc1CNCc2ccccc2 2230a_100015324214_100020631285 [0,2,0,0,0,0|2,0,0]=4 23033 B18R2.445 COc1ncccc1CNCc2ccccc2 270004a_100015324214_100011290804 [0,2,0,0,0,0|2,0,0]=4 23034 B18R2.445 COc1ncccc1CNCc2ccccc2 270004a_100102524934_100015611070 [0,2,0,0,0,0|2,0,0]=4 23035 B18R2.445 COc1ncccc1CNCc2ccccc2 34a_100015324214_100020631285 [0,2,0,0,0,0|2,0,0]=4 23036 B18R2.445 COc1ncccc1COCc2ccccc2 34a_100000210790_100020631285 [0,2,0,0,0,0|1,0,0]=3 23037 B18R2.445 COc1ncccc1COCc2ccccc2 34a_100000717863_100015291786 [0,2,0,0,0,0|1,0,0]=3 23038 B18R2.445 COc1ncccc1COCc2ccccc2 7a_100000210790_100020631285 [0,2,0,0,0,0|1,0,0]=3 23039 B18R2.445 COc1ncccc1COCc2ccccn2 34a_100000717863_100000721315 [0,2,0,0,0,0|2,0,0]=4 23040 B18R2.445 COc1ncccc1COCc2cccnc2 34a_100000717863_100000733263 [0,2,0,0,0,0|2,0,0]=4 23041 B18R2.445 COc1ncccc1CSCc2ccccc2 62a_100000211182_100020631285 [0,2,0,0,0,0|1,1,0]=4 23042 B18R2.445 COc1ncccc1CSCc2ccccc2 62a_100020631285_100015291786 [0,2,0,0,0,0|1,1,0]=4 23043 B18R2.445 CSc1ccccc1C=CCc2ccccc2 271570a_200016263579_100011217816 [0,2,0,0,0,0|1,0,1]=4 23044 B18R2.445 CSc1ccccc1CNCc2ccccc2 207a_100015324214_100011217347 [0,2,0,0,0,0|1,0,0]=3 23045 B18R2.445 CSc1ccccc1CNCc2ccccc2 207a_102495365025_100015611070 [0,2,0,0,0,0|1,0,0]=3 23046 B18R2.445 CSc1ccccc1CNCc2ccccc2 2230a_100015324214_100000699184 [0,2,0,0,0,0|1,0,0]=3 23047 B18R2.445 CSc1ccccc1CNCc2ccccc2 270004a_100015324214_100011217347 [0,2,0,0,0,0|1,0,0]=3 23048 B18R2.445 CSc1ccccc1CNCc2ccccc2 270004a_102495365025_100015611070 [0,2,0,0,0,0|1,0,0]=3 23049 B18R2.445 CSc1ccccc1CNCc2ccccc2 34a_100015324214_100000699184 [0,2,0,0,0,0|1,0,0]=3 23050 B18R2.445 CSc1ccccc1CNCc2ccccc2 34a_102495365025_100015291786 [0,2,0,0,0,0|1,0,0]=3 23051 B18R2.445 CSc1ccccc1CNCc2ccccc2 62a_200000195884_200000210301 [0,2,0,0,0,0|1,0,0]=3 23052 B18R2.445 CSc1ccccc1CNCc2ccccc2 62a_200000210301_200000195884 [0,2,0,0,0,0|1,0,0]=3 23053 B18R2.445 CSc1ccccc1CNCc2ccccn2 207a_102495365025_100000209966 [0,2,0,0,0,0|2,0,0]=4 23054 B18R2.445 CSc1ccccc1CNCc2ccccn2 270004a_100000210449_100011217347 [0,2,0,0,0,0|2,0,0]=4 23055 B18R2.445 CSc1ccccc1CNCc2ccccn2 270004a_102495365025_100000209966 [0,2,0,0,0,0|2,0,0]=4 23056 B18R2.445 CSc1ccccc1CNCc2ccccn2 34a_102495365025_100000721315 [0,2,0,0,0,0|2,0,0]=4 23057 B18R2.445 CSc1ccccc1CNCc2cccnc2 207a_100000210453_100011217347 [0,2,0,0,0,0|2,0,0]=4 23058 B18R2.445 CSc1ccccc1CNCc2cccnc2 207a_102495365025_100000209961 [0,2,0,0,0,0|2,0,0]=4 23059 B18R2.445 CSc1ccccc1CNCc2cccnc2 270004a_100000210453_100011217347 [0,2,0,0,0,0|2,0,0]=4 23060 B18R2.445 CSc1ccccc1CNCc2cccnc2 270004a_102495365025_100000209961 [0,2,0,0,0,0|2,0,0]=4 23061 B18R2.445 CSc1ccccc1CNCc2cccnc2 34a_102495365025_100000733263 [0,2,0,0,0,0|2,0,0]=4 23062 B18R2.445 CSc1ccccc1CNCc2ccncc2 207a_102495365025_100000186114 [0,2,0,0,0,0|2,0,0]=4 23063 B18R2.445 CSc1ccccc1COCc2ccccc2 34a_100000210790_100000699184 [0,2,0,0,0,0|0,0,0]=2 23064 B18R2.445 CSc1ccccc1COCc2ccccc2 34a_100000699167_100015291786 [0,2,0,0,0,0|0,0,0]=2 23065 B18R2.445 CSc1ccccc1COCc2ccccc2 7a_100000210790_100000699184 [0,2,0,0,0,0|0,0,0]=2 23066 B18R2.445 CSc1ccccc1COCc2ccccn2 34a_100000699167_100000721315 [0,2,0,0,0,0|1,0,0]=3 23067 B18R2.445 CSc1ccccc1COCc2cccnc2 34a_100000699167_100000733263 [0,2,0,0,0,0|1,0,0]=3 23068 B18R2.445 CSc1ccccc1COCc2cccnn2 34a_100000699167_100016990269 [0,2,0,0,0,0|2,0,0]=4 23069 B18R2.445 CSc1ccccc1COCc2cnccn2 34a_100000699167_100016995436 [0,2,0,0,0,0|2,0,0]=4 23070 B18R2.445 CSc1ccccc1COCc2cncnc2 34a_100000699167_100015196519 [0,2,0,0,0,0|2,0,0]=4 23071 B18R2.445 CSc1ccccc1COCc2ncccn2 34a_100000699167_100000703007 [0,2,0,0,0,0|2,0,0]=4 23072 B18R2.445 CSc1ccccc1CSCc2ccccc2 62a_100000211182_100000699184 [0,2,0,0,0,0|0,1,0]=3 23073 B18R2.445 CSc1ccccc1CSCc2ccccc2 62a_100000699184_100015291786 [0,2,0,0,0,0|0,1,0]=3 23074 B18R2.445 CSc1ccccc1CSCc2ccccn2 62a_100000699184_100000721315 [0,2,0,0,0,0|1,1,0]=4 23075 B18R2.445 CSc1ccccc1CSCc2ccccn2 62a_100000721315_100000699184 [0,2,0,0,0,0|1,1,0]=4 23076 B18R2.445 CSc1ccccc1CSCc2cccnc2 62a_100000699184_100000741622 [0,2,0,0,0,0|1,1,0]=4 23077 B18R2.445 CSc1ccccc1CSCc2cccnc2 62a_100000741622_100000699184 [0,2,0,0,0,0|1,1,0]=4 23078 B18R2.445 CSc1ccccc1CSCc2ccncc2 62a_100000699184_100015193705 [0,2,0,0,0,0|1,1,0]=4 23079 B18R2.445 CSc1ccccc1CSCc2ccncc2 62a_100015193705_100000699184 [0,2,0,0,0,0|1,1,0]=4 23080 B18R2.445 CSc1ccccc1NCCc2ccccc2 34a_100000211160_100000765856 [0,2,0,0,0,0|2,0,0]=4 23081 B18R2.445 CSc1ccccc1OCCc2ccccc2 34a_100011216402_100000765856 [0,2,0,0,0,0|2,0,0]=4 23082 B18R2.445 CSc1ccccc1SCCc2ccccc2 62a_100000765856_100011217816 [0,2,0,0,0,0|2,0,0]=4 23083 B18R2.445 CSc1ccccc1SCCc2ccccc2 62a_100011217816_100011218657 [0,2,0,0,0,0|2,0,0]=4 23084 B18R2.445 N#Cc1ccccc1C=CCc2ccccc2 271570a_200016263579_100000188569 [0,2,0,0,0,0|1,0,1]=4 23085 B18R2.445 N#Cc1ccccc1CCNc2ccccc2 34a_100000106764_200013032965 [0,2,0,0,0,0|2,0,0]=4 23086 B18R2.445 N#Cc1ccccc1CCOc2ccccc2 34a_100000210340_200013032965 [0,2,0,0,0,0|2,0,0]=4 23087 B18R2.445 N#Cc1ccccc1CCOc2ccccc2 7a_100000210340_200013032965 [0,2,0,0,0,0|2,0,0]=4 23088 B18R2.445 N#Cc1ccccc1CCSc2ccccc2 62a_100000719477_200013032965 [0,2,0,0,0,0|2,0,0]=4 23089 B18R2.445 N#Cc1ccccc1CNCc2ccccc2 2230a_100015324214_100000181865 [0,2,0,0,0,0|1,0,0]=3 23090 B18R2.445 N#Cc1ccccc1CNCc2ccccc2 270004a_100016989011_100015611070 [0,2,0,0,0,0|1,0,0]=3 23091 B18R2.445 N#Cc1ccccc1CNCc2ccccc2 34a_100015324214_100000181865 [0,2,0,0,0,0|1,0,0]=3 23092 B18R2.445 N#Cc1ccccc1CNCc2ccccc2 34a_100016989011_100015291786 [0,2,0,0,0,0|1,0,0]=3 23093 B18R2.445 N#Cc1ccccc1CNCc2ccccn2 270004a_100016989011_100000209966 [0,2,0,0,0,0|2,0,0]=4 23094 B18R2.445 N#Cc1ccccc1CNCc2ccccn2 34a_100016989011_100000721315 [0,2,0,0,0,0|2,0,0]=4 23095 B18R2.445 N#Cc1ccccc1CNCc2cccnc2 270004a_100016989011_100000209961 [0,2,0,0,0,0|2,0,0]=4 23096 B18R2.445 N#Cc1ccccc1CNCc2cccnc2 34a_100016989011_100000733263 [0,2,0,0,0,0|2,0,0]=4 23097 B18R2.445 N#Cc1ccccc1COCc2ccccc2 34a_100000210790_100000181865 [0,2,0,0,0,0|0,0,0]=2 23098 B18R2.445 N#Cc1ccccc1COCc2ccccc2 34a_200011269968_100015291786 [0,2,0,0,0,0|0,0,0]=2 23099 B18R2.445 N#Cc1ccccc1COCc2ccccc2 7a_100000210790_100000181865 [0,2,0,0,0,0|0,0,0]=2 23100 B18R2.445 N#Cc1ccccc1COCc2ccccc2 7a_200011269968_100000211182 [0,2,0,0,0,0|0,0,0]=2 23101 B18R2.445 N#Cc1ccccc1COCc2ccccn2 34a_200011269968_100000721315 [0,2,0,0,0,0|1,0,0]=3 23102 B18R2.445 N#Cc1ccccc1COCc2ccccn2 7a_200011269968_100000721315 [0,2,0,0,0,0|1,0,0]=3 23103 B18R2.445 N#Cc1ccccc1COCc2cccnc2 34a_200011269968_100000733263 [0,2,0,0,0,0|1,0,0]=3 23104 B18R2.445 N#Cc1ccccc1COCc2cccnc2 7a_200011269968_100000741622 [0,2,0,0,0,0|1,0,0]=3 23105 B18R2.445 N#Cc1ccccc1COCc2cccnn2 34a_200011269968_100016990269 [0,2,0,0,0,0|2,0,0]=4 23106 B18R2.445 N#Cc1ccccc1COCc2cccnn2 7a_200011269968_100016990269 [0,2,0,0,0,0|2,0,0]=4 23107 B18R2.445 N#Cc1ccccc1COCc2ccncc2 7a_200011269968_100015193705 [0,2,0,0,0,0|1,0,0]=3 23108 B18R2.445 N#Cc1ccccc1COCc2cnccn2 34a_200011269968_100016995436 [0,2,0,0,0,0|2,0,0]=4 23109 B18R2.445 N#Cc1ccccc1COCc2cnccn2 7a_200011269968_100016995436 [0,2,0,0,0,0|2,0,0]=4 23110 B18R2.445 N#Cc1ccccc1COCc2cncnc2 34a_200011269968_100015196519 [0,2,0,0,0,0|2,0,0]=4 23111 B18R2.445 N#Cc1ccccc1COCc2cncnc2 7a_200011269968_100015196519 [0,2,0,0,0,0|2,0,0]=4 23112 B18R2.445 N#Cc1ccccc1COCc2ncccn2 34a_200011269968_100000703007 [0,2,0,0,0,0|2,0,0]=4 23113 B18R2.445 N#Cc1ccccc1COCc2ncccn2 7a_200011269968_100000703007 [0,2,0,0,0,0|2,0,0]=4 23114 B18R2.445 N#Cc1ccccc1CSCc2ccccc2 62a_100000186380_100015291786 [0,2,0,0,0,0|0,1,0]=3 23115 B18R2.445 N#Cc1ccccc1CSCc2ccccc2 62a_100000211182_100000181865 [0,2,0,0,0,0|0,1,0]=3 23116 B18R2.445 N#Cc1ccccc1CSCc2ccccn2 62a_100000186380_100000721315 [0,2,0,0,0,0|1,1,0]=4 23117 B18R2.445 N#Cc1ccccc1CSCc2ccccn2 62a_100000721315_100000181865 [0,2,0,0,0,0|1,1,0]=4 23118 B18R2.445 N#Cc1ccccc1CSCc2cccnc2 62a_100000186380_100000741622 [0,2,0,0,0,0|1,1,0]=4 23119 B18R2.445 N#Cc1ccccc1CSCc2cccnc2 62a_100000741622_100000181865 [0,2,0,0,0,0|1,1,0]=4 23120 B18R2.445 N#Cc1ccccc1CSCc2ccncc2 62a_100000186380_100015193705 [0,2,0,0,0,0|1,1,0]=4 23121 B18R2.445 N#Cc1ccccc1CSCc2ccncc2 62a_100015193705_100000181865 [0,2,0,0,0,0|1,1,0]=4 23122 B18R2.445 N#Cc1ccccc1NCCc2ccccc2 34a_100000211148_100000765856 [0,2,0,0,0,0|2,0,0]=4 23123 B18R2.445 N#Cc1ccccc1OCCc2ccccc2 34a_100000211048_100000765856 [0,2,0,0,0,0|2,0,0]=4 23124 B18R2.445 N#Cc1ccccc1OCCc2ccccc2 7a_100000211048_100000765856 [0,2,0,0,0,0|2,0,0]=4 23125 B18R2.445 N#Cc1ccccc1SCCc2ccccc2 62a_100000765856_100000188569 [0,2,0,0,0,0|2,0,0]=4 23126 B18R2.445 N#Cc1cccnc1CNCc2ccccc2 2230a_100015324214_100000099805 [0,2,0,0,0,0|2,0,0]=4 23127 B18R2.445 N#Cc1cccnc1COCc2ccccc2 7a_100000210790_100000099805 [0,2,0,0,0,0|1,0,0]=3 23128 B18R2.445 N#Cc1cccnc1CSCc2ccccc2 62a_100000211182_100000099805 [0,2,0,0,0,0|1,1,0]=4 23129 B18R2.445 N#Cc1ncccc1CNCc2ccccc2 2230a_100015324214_100011768898 [0,2,0,0,0,0|2,0,0]=4 23130 B18R2.445 N#Cc1ncccc1CNCc2ccccc2 34a_100015324214_100011768898 [0,2,0,0,0,0|2,0,0]=4 23131 B18R2.445 N#Cc1ncccc1COCc2ccccc2 34a_100000210790_100011768898 [0,2,0,0,0,0|1,0,0]=3 23132 B18R2.445 N#Cc1ncccc1COCc2ccccc2 7a_100000210790_100011768898 [0,2,0,0,0,0|1,0,0]=3 23133 B18R2.445 N#Cc1ncccc1CSCc2ccccc2 62a_100000211182_100011768898 [0,2,0,0,0,0|1,1,0]=4 23134 B18R2.445 NCc1ccccc1C=CCc2ccccc2 271570a_200016263579_100000689332 [0,2,0,0,0,0|1,0,1]=4 23135 B18R2.445 NCc1ccccc1COCc2ccccc2 34a_100000743596_100015291786 [0,2,0,0,0,0|0,0,0]=2 23136 B18R2.445 NCc1ccccc1COCc2ccccn2 34a_100000743596_100000721315 [0,2,0,0,0,0|1,0,0]=3 23137 B18R2.445 NCc1ccccc1COCc2cccnc2 34a_100000743596_100000733263 [0,2,0,0,0,0|1,0,0]=3 23138 B18R2.445 NCc1ccccc1COCc2cccnn2 34a_100000743596_100016990269 [0,2,0,0,0,0|2,0,0]=4 23139 B18R2.445 NCc1ccccc1COCc2cnccn2 34a_100000743596_100016995436 [0,2,0,0,0,0|2,0,0]=4 23140 B18R2.445 NCc1ccccc1COCc2cncnc2 34a_100000743596_100015196519 [0,2,0,0,0,0|2,0,0]=4 23141 B18R2.445 NCc1ccccc1COCc2ncccn2 34a_100000743596_100000703007 [0,2,0,0,0,0|2,0,0]=4 23142 B18R2.445 NCc1ccccc1OCCc2ccccc2 34a_100000185550_100000765856 [0,2,0,0,0,0|2,0,0]=4 23143 B18R2.445 NCc1ccccc1SCCc2ccccc2 62a_100000689332_100011218657 [0,2,0,0,0,0|2,0,0]=4 23144 B18R2.445 NCc1ccccc1SCCc2ccccc2 62a_100000765856_100000689332 [0,2,0,0,0,0|2,0,0]=4 23145 B18R2.445 NNc1ccccc1C=CCc2ccccc2 271570a_200016263579_100000241748 [0,2,0,0,0,0|1,0,1]=4 23146 B18R2.445 NNc1ccccc1SCCc2ccccc2 62a_100000241748_100011218657 [0,2,0,0,0,0|2,0,0]=4 23147 B18R2.445 NNc1ccccc1SCCc2ccccc2 62a_100000765856_100000241748 [0,2,0,0,0,0|2,0,0]=4 23148 B18R2.445 O=Cc1ccccc1C=CCc2ccccc2 271570a_200016263579_100000211189 [0,2,0,0,0,0|1,0,1]=4 23149 B18R2.445 O=Cc1ccccc1CCNc2ccccc2 34a_100000106764_100010186698 [0,2,0,0,0,0|2,0,0]=4 23150 B18R2.445 O=Cc1ccccc1CCOc2ccccc2 34a_100000210340_100010186698 [0,2,0,0,0,0|2,0,0]=4 23151 B18R2.445 O=Cc1ccccc1CCOc2ccccc2 7a_100000210340_100010186698 [0,2,0,0,0,0|2,0,0]=4 23152 B18R2.445 O=Cc1ccccc1CCSc2ccccc2 62a_100000719477_100010186698 [0,2,0,0,0,0|2,0,0]=4 23153 B18R2.445 O=Cc1ccccc1CCSc2ccccc2 62a_100010186698_100000041952 [0,2,0,0,0,0|2,0,0]=4 23154 B18R2.445 O=Cc1ccccc1CNCc2ccccc2 2230a_100015324214_200009853537 [0,2,0,0,0,0|1,0,0]=3 23155 B18R2.445 O=Cc1ccccc1CNCc2ccccc2 34a_100015324214_200009853537 [0,2,0,0,0,0|1,0,0]=3 23156 B18R2.445 O=Cc1ccccc1COCc2ccccc2 34a_100000210790_200009853537 [0,2,0,0,0,0|0,0,0]=2 23157 B18R2.445 O=Cc1ccccc1COCc2ccccc2 7a_100000210790_200009853537 [0,2,0,0,0,0|0,0,0]=2 23158 B18R2.445 O=Cc1ccccc1CSCc2ccccc2 62a_100000211182_200009853537 [0,2,0,0,0,0|0,1,0]=3 23159 B18R2.445 O=Cc1ccccc1CSCc2ccccc2 62a_200009853537_100015291786 [0,2,0,0,0,0|0,1,0]=3 23160 B18R2.445 O=Cc1ccccc1CSCc2ccccn2 62a_100000721315_200009853537 [0,2,0,0,0,0|1,1,0]=4 23161 B18R2.445 O=Cc1ccccc1CSCc2ccccn2 62a_200009853537_100000721315 [0,2,0,0,0,0|1,1,0]=4 23162 B18R2.445 O=Cc1ccccc1CSCc2cccnc2 62a_100000741622_200009853537 [0,2,0,0,0,0|1,1,0]=4 23163 B18R2.445 O=Cc1ccccc1CSCc2cccnc2 62a_200009853537_100000741622 [0,2,0,0,0,0|1,1,0]=4 23164 B18R2.445 O=Cc1ccccc1CSCc2ccncc2 62a_100015193705_200009853537 [0,2,0,0,0,0|1,1,0]=4 23165 B18R2.445 O=Cc1ccccc1CSCc2ccncc2 62a_200009853537_100015193705 [0,2,0,0,0,0|1,1,0]=4 23166 B18R2.445 O=Cc1ccccc1SCCc2ccccc2 62a_100000210073_100011218657 [0,2,0,0,0,0|2,0,0]=4 23167 B18R2.445 O=Cc1ccccc1SCCc2ccccc2 62a_100000765856_100000210073 [0,2,0,0,0,0|2,0,0]=4 23168 B18R2.445 OCc1ccccc1C=CCc2ccccc2 271570a_200016263579_100000187465 [0,2,0,0,0,0|1,0,1]=4 23169 B18R2.445 OCc1ccccc1CNCc2ccccc2 207a_100000743596_100015611070 [0,2,0,0,0,0|1,0,0]=3 23170 B18R2.445 OCc1ccccc1CNCc2ccccc2 2230a_100015324214_100009816955 [0,2,0,0,0,0|1,0,0]=3 23171 B18R2.445 OCc1ccccc1CNCc2ccccc2 270004a_100000743596_100015611070 [0,2,0,0,0,0|1,0,0]=3 23172 B18R2.445 OCc1ccccc1CNCc2ccccc2 34a_100015324214_100009816955 [0,2,0,0,0,0|1,0,0]=3 23173 B18R2.445 OCc1ccccc1CNCc2ccccn2 207a_100000743596_100000209966 [0,2,0,0,0,0|2,0,0]=4 23174 B18R2.445 OCc1ccccc1CNCc2ccccn2 270004a_100000743596_100000209966 [0,2,0,0,0,0|2,0,0]=4 23175 B18R2.445 OCc1ccccc1CNCc2cccnc2 207a_100000743596_100000209961 [0,2,0,0,0,0|2,0,0]=4 23176 B18R2.445 OCc1ccccc1CNCc2cccnc2 270004a_100000743596_100000209961 [0,2,0,0,0,0|2,0,0]=4 23177 B18R2.445 OCc1ccccc1CNCc2ccncc2 207a_100000743596_100000186114 [0,2,0,0,0,0|2,0,0]=4 23178 B18R2.445 OCc1ccccc1COCc2ccccc2 34a_100000210790_100009816955 [0,2,0,0,0,0|0,0,0]=2 23179 B18R2.445 OCc1ccccc1COCc2ccccc2 7a_100000210790_100009816955 [0,2,0,0,0,0|0,0,0]=2 23180 B18R2.445 OCc1ccccc1CSCc2ccccc2 62a_100000211182_100009816955 [0,2,0,0,0,0|0,1,0]=3 23181 B18R2.445 OCc1ccccc1CSCc2ccccc2 62a_100009816955_100015291786 [0,2,0,0,0,0|0,1,0]=3 23182 B18R2.445 OCc1ccccc1CSCc2ccccn2 62a_100000721315_100009816955 [0,2,0,0,0,0|1,1,0]=4 23183 B18R2.445 OCc1ccccc1CSCc2ccccn2 62a_100009816955_100000721315 [0,2,0,0,0,0|1,1,0]=4 23184 B18R2.445 OCc1ccccc1CSCc2cccnc2 62a_100000741622_100009816955 [0,2,0,0,0,0|1,1,0]=4 23185 B18R2.445 OCc1ccccc1CSCc2cccnc2 62a_100009816955_100000741622 [0,2,0,0,0,0|1,1,0]=4 23186 B18R2.445 OCc1ccccc1CSCc2ccncc2 62a_100009816955_100015193705 [0,2,0,0,0,0|1,1,0]=4 23187 B18R2.445 OCc1ccccc1CSCc2ccncc2 62a_100015193705_100009816955 [0,2,0,0,0,0|1,1,0]=4 23188 B18R2.445 OCc1ccccc1NCCc2ccccc2 34a_100000212039_100000765856 [0,2,0,0,0,0|2,0,0]=4 23189 B18R2.445 OCc1ccccc1OCCc2ccccc2 34a_100011216872_100000765856 [0,2,0,0,0,0|2,0,0]=4 23190 B18R2.445 OCc1ccccc1SCCc2ccccc2 62a_100000187465_100011218657 [0,2,0,0,0,0|2,0,0]=4 23191 B18R2.445 OCc1ccccc1SCCc2ccccc2 62a_100000765856_100000187465 [0,2,0,0,0,0|2,0,0]=4 23192 B18R2.445 [13CH3]Oc1ccccc1CNCc2ccccc2 34a_100011219060_200025704644 [0,2,0,0,0,0|1,0,0]=3 23193 B18R2.445 [13CH3]Sc1ccccc1CNCc2ccccc2 62a_200000195884_200025704644 [0,2,0,0,0,0|1,0,0]=3 23194 B18R2.445 [13CH3]Sc1ccccc1CNCc2ccccc2 62a_200025704644_200000195884 [0,2,0,0,0,0|1,0,0]=3 23195 B18R2.3922 Brc1c(cccc1CNCc2ccccc2)I 2230a_100015324214_100010254545 [0,2,0,0,0,0|1,0,0]=3 23196 B18R2.3922 Brc1c(cccc1CNCc2ccccc2)I 34a_100015324214_100010254545 [0,2,0,0,0,0|1,0,0]=3 23197 B18R2.3922 Brc1c(cccc1COCc2ccccc2)I 34a_100000210790_100010254545 [0,2,0,0,0,0|0,0,0]=2 23198 B18R2.3922 Brc1c(cccc1COCc2ccccc2)I 34a_100010240205_100015291786 [0,2,0,0,0,0|0,0,0]=2 23199 B18R2.3922 Brc1c(cccc1COCc2ccccc2)I 7a_100000210790_100010254545 [0,2,0,0,0,0|0,0,0]=2 23200 B18R2.3922 Brc1c(cccc1COCc2ccccc2)I 7a_100010240205_100000211182 [0,2,0,0,0,0|0,0,0]=2 23201 B18R2.3922 Brc1c(cccc1COCc2ccccn2)I 34a_100010240205_100000721315 [0,2,0,0,0,0|1,0,0]=3 23202 B18R2.3922 Brc1c(cccc1COCc2ccccn2)I 7a_100010240205_100000721315 [0,2,0,0,0,0|1,0,0]=3 23203 B18R2.3922 Brc1c(cccc1COCc2cccnc2)I 34a_100010240205_100000733263 [0,2,0,0,0,0|1,0,0]=3 23204 B18R2.3922 Brc1c(cccc1COCc2cccnc2)I 7a_100010240205_100000741622 [0,2,0,0,0,0|1,0,0]=3 23205 B18R2.3922 Brc1c(cccc1COCc2cccnn2)I 34a_100010240205_100016990269 [0,2,0,0,0,0|2,0,0]=4 23206 B18R2.3922 Brc1c(cccc1COCc2cccnn2)I 7a_100010240205_100016990269 [0,2,0,0,0,0|2,0,0]=4 23207 B18R2.3922 Brc1c(cccc1COCc2ccncc2)I 7a_100010240205_100015193705 [0,2,0,0,0,0|1,0,0]=3 23208 B18R2.3922 Brc1c(cccc1COCc2cnccn2)I 34a_100010240205_100016995436 [0,2,0,0,0,0|2,0,0]=4 23209 B18R2.3922 Brc1c(cccc1COCc2cnccn2)I 7a_100010240205_100016995436 [0,2,0,0,0,0|2,0,0]=4 23210 B18R2.3922 Brc1c(cccc1COCc2cncnc2)I 34a_100010240205_100015196519 [0,2,0,0,0,0|2,0,0]=4 23211 B18R2.3922 Brc1c(cccc1COCc2cncnc2)I 7a_100010240205_100015196519 [0,2,0,0,0,0|2,0,0]=4 23212 B18R2.3922 Brc1c(cccc1COCc2ncccn2)I 34a_100010240205_100000703007 [0,2,0,0,0,0|2,0,0]=4 23213 B18R2.3922 Brc1c(cccc1COCc2ncccn2)I 7a_100010240205_100000703007 [0,2,0,0,0,0|2,0,0]=4 23214 B18R2.3922 Brc1c(cccc1CSCc2ccccc2)I 62a_100000211182_100010254545 [0,2,0,0,0,0|0,1,0]=3 23215 B18R2.3922 Brc1c(cccc1CSCc2ccccc2)I 62a_100010254545_100015291786 [0,2,0,0,0,0|0,1,0]=3 23216 B18R2.3922 Brc1c(cccc1CSCc2ccccn2)I 62a_100000721315_100010254545 [0,2,0,0,0,0|1,1,0]=4 23217 B18R2.3922 Brc1c(cccc1CSCc2ccccn2)I 62a_100010254545_100000721315 [0,2,0,0,0,0|1,1,0]=4 23218 B18R2.3922 Brc1c(cccc1CSCc2cccnc2)I 62a_100000741622_100010254545 [0,2,0,0,0,0|1,1,0]=4 23219 B18R2.3922 Brc1c(cccc1CSCc2cccnc2)I 62a_100010254545_100000741622 [0,2,0,0,0,0|1,1,0]=4 23220 B18R2.3922 Brc1c(cccc1CSCc2ccncc2)I 62a_100010254545_100015193705 [0,2,0,0,0,0|1,1,0]=4 23221 B18R2.3922 Brc1c(cccc1CSCc2ccncc2)I 62a_100015193705_100010254545 [0,2,0,0,0,0|1,1,0]=4 23222 B18R2.3922 Brc1c(cccc1OCCc2ccccc2)I 34a_100010187914_100000765856 [0,2,0,0,0,0|2,0,0]=4 23223 B18R2.3922 Brc1c(cccc1OCCc2ccccc2)I 7a_100010187914_100000765856 [0,2,0,0,0,0|2,0,0]=4 23224 B18R2.3922 Brc1cccc(c1Br)CNCc2ccccc2 207a_100015324214_100010240334 [0,2,0,0,0,0|1,0,0]=3 23225 B18R2.3922 Brc1cccc(c1Br)CNCc2ccccc2 270004a_100015324214_100010240334 [0,2,0,0,0,0|1,0,0]=3 23226 B18R2.3922 Brc1cccc(c1Br)CNCc2ccccn2 270004a_100000210449_100010240334 [0,2,0,0,0,0|2,0,0]=4 23227 B18R2.3922 Brc1cccc(c1Br)CNCc2cccnc2 207a_100000210453_100010240334 [0,2,0,0,0,0|2,0,0]=4 23228 B18R2.3922 Brc1cccc(c1Br)CNCc2cccnc2 270004a_100000210453_100010240334 [0,2,0,0,0,0|2,0,0]=4 23229 B18R2.3922 Brc1cccc(c1Br)OCCc2ccccc2 34a_100010187966_100000765856 [0,2,0,0,0,0|2,0,0]=4 23230 B18R2.3922 Brc1cccc(c1Br)OCCc2ccccc2 7a_100010187966_100000765856 [0,2,0,0,0,0|2,0,0]=4 23231 B18R2.3922 Brc1cccc(c1Br)SCCc2ccccc2 62a_100000765856_100010175083 [0,2,0,0,0,0|2,0,0]=4 23232 B18R2.3922 Brc1cccc(c1Br)SCCc2ccccc2 62a_100010175083_100011218657 [0,2,0,0,0,0|2,0,0]=4 23233 B18R2.3922 Brc1cccc(c1I)COCc2ccccc2 34a_100010146604_100015291786 [0,2,0,0,0,0|0,0,0]=2 23234 B18R2.3922 Brc1cccc(c1I)COCc2ccccc2 7a_100010146604_100000211182 [0,2,0,0,0,0|0,0,0]=2 23235 B18R2.3922 Brc1cccc(c1I)COCc2ccccn2 34a_100010146604_100000721315 [0,2,0,0,0,0|1,0,0]=3 23236 B18R2.3922 Brc1cccc(c1I)COCc2ccccn2 7a_100010146604_100000721315 [0,2,0,0,0,0|1,0,0]=3 23237 B18R2.3922 Brc1cccc(c1I)COCc2cccnc2 34a_100010146604_100000733263 [0,2,0,0,0,0|1,0,0]=3 23238 B18R2.3922 Brc1cccc(c1I)COCc2cccnc2 7a_100010146604_100000741622 [0,2,0,0,0,0|1,0,0]=3 23239 B18R2.3922 Brc1cccc(c1I)COCc2cccnn2 34a_100010146604_100016990269 [0,2,0,0,0,0|2,0,0]=4 23240 B18R2.3922 Brc1cccc(c1I)COCc2cccnn2 7a_100010146604_100016990269 [0,2,0,0,0,0|2,0,0]=4 23241 B18R2.3922 Brc1cccc(c1I)COCc2ccncc2 7a_100010146604_100015193705 [0,2,0,0,0,0|1,0,0]=3 23242 B18R2.3922 Brc1cccc(c1I)COCc2cnccn2 34a_100010146604_100016995436 [0,2,0,0,0,0|2,0,0]=4 23243 B18R2.3922 Brc1cccc(c1I)COCc2cnccn2 7a_100010146604_100016995436 [0,2,0,0,0,0|2,0,0]=4 23244 B18R2.3922 Brc1cccc(c1I)COCc2cncnc2 34a_100010146604_100015196519 [0,2,0,0,0,0|2,0,0]=4 23245 B18R2.3922 Brc1cccc(c1I)COCc2cncnc2 7a_100010146604_100015196519 [0,2,0,0,0,0|2,0,0]=4 23246 B18R2.3922 Brc1cccc(c1I)COCc2ncccn2 34a_100010146604_100000703007 [0,2,0,0,0,0|2,0,0]=4 23247 B18R2.3922 Brc1cccc(c1I)COCc2ncccn2 7a_100010146604_100000703007 [0,2,0,0,0,0|2,0,0]=4 23248 B18R2.3922 Brc1cccc(c1I)NCCc2ccccc2 34a_100020590159_100000765856 [0,2,0,0,0,0|2,0,0]=4 23249 B18R2.3922 Brc1cccc(c1I)OCCc2ccccc2 34a_100010187912_100000765856 [0,2,0,0,0,0|2,0,0]=4 23250 B18R2.3922 Brc1cccc(c1I)OCCc2ccccc2 7a_100010187912_100000765856 [0,2,0,0,0,0|2,0,0]=4 23251 B18R2.3922 Cc1c(cccc1C=CCc2ccccc2)Br 271570a_200016263579_100012353703 [0,2,0,0,0,0|1,0,1]=4 23252 B18R2.3922 Cc1c(cccc1C=CCc2ccccc2)Cl 271570a_200016263579_100000726075 [0,2,0,0,0,0|1,0,1]=4 23253 B18R2.3922 Cc1c(cccc1C=CCc2ccccc2)F 271570a_200016263579_100011216893 [0,2,0,0,0,0|1,0,1]=4 23254 B18R2.3922 Cc1c(cccc1C=CCc2ccccc2)N 271570a_200016263579_100000761887 [0,2,0,0,0,0|1,0,1]=4 23255 B18R2.3922 Cc1c(cccc1C=CCc2ccccc2)O 271570a_200016263579_100012002258 [0,2,0,0,0,0|1,0,1]=4 23256 B18R2.3922 Cc1c(cccc1CNCc2ccccc2)Br 207a_100000724210_100015611070 [0,2,0,0,0,0|1,0,0]=3 23257 B18R2.3922 Cc1c(cccc1CNCc2ccccc2)Br 207a_100015324214_100012179384 [0,2,0,0,0,0|1,0,0]=3 23258 B18R2.3922 Cc1c(cccc1CNCc2ccccc2)Br 2230a_100015324214_100000694682 [0,2,0,0,0,0|1,0,0]=3 23259 B18R2.3922 Cc1c(cccc1CNCc2ccccc2)Br 270004a_100000724210_100015611070 [0,2,0,0,0,0|1,0,0]=3 23260 B18R2.3922 Cc1c(cccc1CNCc2ccccc2)Br 270004a_100015324214_100012179384 [0,2,0,0,0,0|1,0,0]=3 23261 B18R2.3922 Cc1c(cccc1CNCc2ccccc2)Br 34a_100000724210_100015291786 [0,2,0,0,0,0|1,0,0]=3 23262 B18R2.3922 Cc1c(cccc1CNCc2ccccc2)Br 34a_100015324214_100000694682 [0,2,0,0,0,0|1,0,0]=3 23263 B18R2.3922 Cc1c(cccc1CNCc2ccccc2)Cl 207a_100015324214_100012002129 [0,2,0,0,0,0|1,0,0]=3 23264 B18R2.3922 Cc1c(cccc1CNCc2ccccc2)Cl 207a_100020639605_100015611070 [0,2,0,0,0,0|1,0,0]=3 23265 B18R2.3922 Cc1c(cccc1CNCc2ccccc2)Cl 2230a_100015324214_100012186920 [0,2,0,0,0,0|1,0,0]=3 23266 B18R2.3922 Cc1c(cccc1CNCc2ccccc2)Cl 2230a_100020639605_100015291786 [0,2,0,0,0,0|1,0,0]=3 23267 B18R2.3922 Cc1c(cccc1CNCc2ccccc2)Cl 270004a_100015324214_100012002129 [0,2,0,0,0,0|1,0,0]=3 23268 B18R2.3922 Cc1c(cccc1CNCc2ccccc2)Cl 270004a_100020639605_100015611070 [0,2,0,0,0,0|1,0,0]=3 23269 B18R2.3922 Cc1c(cccc1CNCc2ccccc2)Cl 34a_100015324214_100012186920 [0,2,0,0,0,0|1,0,0]=3 23270 B18R2.3922 Cc1c(cccc1CNCc2ccccc2)Cl 34a_100020639605_100015291786 [0,2,0,0,0,0|1,0,0]=3 23271 B18R2.3922 Cc1c(cccc1CNCc2ccccc2)F 207a_100015324214_100000037668 [0,2,0,0,0,0|1,0,0]=3 23272 B18R2.3922 Cc1c(cccc1CNCc2ccccc2)F 207a_100132306986_100015611070 [0,2,0,0,0,0|1,0,0]=3 23273 B18R2.3922 Cc1c(cccc1CNCc2ccccc2)F 2230a_100015324214_100009813626 [0,2,0,0,0,0|1,0,0]=3 23274 B18R2.3922 Cc1c(cccc1CNCc2ccccc2)F 2230a_100132306986_100015291786 [0,2,0,0,0,0|1,0,0]=3 23275 B18R2.3922 Cc1c(cccc1CNCc2ccccc2)F 270004a_100015324214_100000037668 [0,2,0,0,0,0|1,0,0]=3 23276 B18R2.3922 Cc1c(cccc1CNCc2ccccc2)F 270004a_100132306986_100015611070 [0,2,0,0,0,0|1,0,0]=3 23277 B18R2.3922 Cc1c(cccc1CNCc2ccccc2)F 34a_100015324214_100009813626 [0,2,0,0,0,0|1,0,0]=3 23278 B18R2.3922 Cc1c(cccc1CNCc2ccccc2)F 34a_100132306986_100015291786 [0,2,0,0,0,0|1,0,0]=3 23279 B18R2.3922 Cc1c(cccc1CNCc2ccccc2)I 2230a_100015324214_100010150147 [0,2,0,0,0,0|1,0,0]=3 23280 B18R2.3922 Cc1c(cccc1CNCc2ccccc2)I 34a_100015324214_100010150147 [0,2,0,0,0,0|1,0,0]=3 23281 B18R2.3922 Cc1c(cccc1CNCc2ccccc2)O 270004a_100015324214_100009868165 [0,2,0,0,0,0|1,0,0]=3 23282 B18R2.3922 Cc1c(cccc1CNCc2ccccn2)Br 207a_100000724210_100000209966 [0,2,0,0,0,0|2,0,0]=4 23283 B18R2.3922 Cc1c(cccc1CNCc2ccccn2)Br 270004a_100000210449_100012179384 [0,2,0,0,0,0|2,0,0]=4 23284 B18R2.3922 Cc1c(cccc1CNCc2ccccn2)Br 270004a_100000724210_100000209966 [0,2,0,0,0,0|2,0,0]=4 23285 B18R2.3922 Cc1c(cccc1CNCc2ccccn2)Br 34a_100000724210_100000721315 [0,2,0,0,0,0|2,0,0]=4 23286 B18R2.3922 Cc1c(cccc1CNCc2ccccn2)Cl 207a_100020639605_100000209966 [0,2,0,0,0,0|2,0,0]=4 23287 B18R2.3922 Cc1c(cccc1CNCc2ccccn2)Cl 2230a_100020639605_100000721315 [0,2,0,0,0,0|2,0,0]=4 23288 B18R2.3922 Cc1c(cccc1CNCc2ccccn2)Cl 270004a_100000210449_100012002129 [0,2,0,0,0,0|2,0,0]=4 23289 B18R2.3922 Cc1c(cccc1CNCc2ccccn2)Cl 270004a_100020639605_100000209966 [0,2,0,0,0,0|2,0,0]=4 23290 B18R2.3922 Cc1c(cccc1CNCc2ccccn2)Cl 34a_100020639605_100000721315 [0,2,0,0,0,0|2,0,0]=4 23291 B18R2.3922 Cc1c(cccc1CNCc2ccccn2)F 207a_100132306986_100000209966 [0,2,0,0,0,0|2,0,0]=4 23292 B18R2.3922 Cc1c(cccc1CNCc2ccccn2)F 2230a_100132306986_100000721315 [0,2,0,0,0,0|2,0,0]=4 23293 B18R2.3922 Cc1c(cccc1CNCc2ccccn2)F 270004a_100000210449_100000037668 [0,2,0,0,0,0|2,0,0]=4 23294 B18R2.3922 Cc1c(cccc1CNCc2ccccn2)F 270004a_100132306986_100000209966 [0,2,0,0,0,0|2,0,0]=4 23295 B18R2.3922 Cc1c(cccc1CNCc2ccccn2)F 34a_100132306986_100000721315 [0,2,0,0,0,0|2,0,0]=4 23296 B18R2.3922 Cc1c(cccc1CNCc2ccccn2)O 270004a_100000210449_100009868165 [0,2,0,0,0,0|2,0,0]=4 23297 B18R2.3922 Cc1c(cccc1CNCc2cccnc2)Br 207a_100000210453_100012179384 [0,2,0,0,0,0|2,0,0]=4 23298 B18R2.3922 Cc1c(cccc1CNCc2cccnc2)Br 207a_100000724210_100000209961 [0,2,0,0,0,0|2,0,0]=4 23299 B18R2.3922 Cc1c(cccc1CNCc2cccnc2)Br 270004a_100000210453_100012179384 [0,2,0,0,0,0|2,0,0]=4 23300 B18R2.3922 Cc1c(cccc1CNCc2cccnc2)Br 270004a_100000724210_100000209961 [0,2,0,0,0,0|2,0,0]=4 23301 B18R2.3922 Cc1c(cccc1CNCc2cccnc2)Br 34a_100000724210_100000733263 [0,2,0,0,0,0|2,0,0]=4 23302 B18R2.3922 Cc1c(cccc1CNCc2cccnc2)Cl 207a_100000210453_100012002129 [0,2,0,0,0,0|2,0,0]=4 23303 B18R2.3922 Cc1c(cccc1CNCc2cccnc2)Cl 207a_100020639605_100000209961 [0,2,0,0,0,0|2,0,0]=4 23304 B18R2.3922 Cc1c(cccc1CNCc2cccnc2)Cl 2230a_100020639605_100000741622 [0,2,0,0,0,0|2,0,0]=4 23305 B18R2.3922 Cc1c(cccc1CNCc2cccnc2)Cl 270004a_100000210453_100012002129 [0,2,0,0,0,0|2,0,0]=4 23306 B18R2.3922 Cc1c(cccc1CNCc2cccnc2)Cl 270004a_100020639605_100000209961 [0,2,0,0,0,0|2,0,0]=4 23307 B18R2.3922 Cc1c(cccc1CNCc2cccnc2)Cl 34a_100020639605_100000733263 [0,2,0,0,0,0|2,0,0]=4 23308 B18R2.3922 Cc1c(cccc1CNCc2cccnc2)F 207a_100000210453_100000037668 [0,2,0,0,0,0|2,0,0]=4 23309 B18R2.3922 Cc1c(cccc1CNCc2cccnc2)F 207a_100132306986_100000209961 [0,2,0,0,0,0|2,0,0]=4 23310 B18R2.3922 Cc1c(cccc1CNCc2cccnc2)F 2230a_100132306986_100000741622 [0,2,0,0,0,0|2,0,0]=4 23311 B18R2.3922 Cc1c(cccc1CNCc2cccnc2)F 270004a_100000210453_100000037668 [0,2,0,0,0,0|2,0,0]=4 23312 B18R2.3922 Cc1c(cccc1CNCc2cccnc2)F 270004a_100132306986_100000209961 [0,2,0,0,0,0|2,0,0]=4 23313 B18R2.3922 Cc1c(cccc1CNCc2cccnc2)F 34a_100132306986_100000733263 [0,2,0,0,0,0|2,0,0]=4 23314 B18R2.3922 Cc1c(cccc1CNCc2cccnc2)O 270004a_100000210453_100009868165 [0,2,0,0,0,0|2,0,0]=4 23315 B18R2.3922 Cc1c(cccc1CNCc2ccncc2)Br 207a_100000724210_100000186114 [0,2,0,0,0,0|2,0,0]=4 23316 B18R2.3922 Cc1c(cccc1CNCc2ccncc2)Cl 207a_100020639605_100000186114 [0,2,0,0,0,0|2,0,0]=4 23317 B18R2.3922 Cc1c(cccc1CNCc2ccncc2)Cl 2230a_100020639605_100015193705 [0,2,0,0,0,0|2,0,0]=4 23318 B18R2.3922 Cc1c(cccc1CNCc2ccncc2)F 207a_100132306986_100000186114 [0,2,0,0,0,0|2,0,0]=4 23319 B18R2.3922 Cc1c(cccc1CNCc2ccncc2)F 2230a_100132306986_100015193705 [0,2,0,0,0,0|2,0,0]=4 23320 B18R2.3922 Cc1c(cccc1COCc2ccccc2)Br 34a_100000210790_100000694682 [0,2,0,0,0,0|0,0,0]=2 23321 B18R2.3922 Cc1c(cccc1COCc2ccccc2)Br 34a_100000694458_100015291786 [0,2,0,0,0,0|0,0,0]=2 23322 B18R2.3922 Cc1c(cccc1COCc2ccccc2)Br 7a_100000210790_100000694682 [0,2,0,0,0,0|0,0,0]=2 23323 B18R2.3922 Cc1c(cccc1COCc2ccccc2)Br 7a_100000694458_100000211182 [0,2,0,0,0,0|0,0,0]=2 23324 B18R2.3922 Cc1c(cccc1COCc2ccccc2)Cl 34a_100000210790_100012186920 [0,2,0,0,0,0|0,0,0]=2 23325 B18R2.3922 Cc1c(cccc1COCc2ccccc2)Cl 34a_100012000165_100015291786 [0,2,0,0,0,0|0,0,0]=2 23326 B18R2.3922 Cc1c(cccc1COCc2ccccc2)Cl 7a_100000210790_100012186920 [0,2,0,0,0,0|0,0,0]=2 23327 B18R2.3922 Cc1c(cccc1COCc2ccccc2)Cl 7a_100012000165_100000211182 [0,2,0,0,0,0|0,0,0]=2 23328 B18R2.3922 Cc1c(cccc1COCc2ccccc2)F 34a_100000042775_100015291786 [0,2,0,0,0,0|0,0,0]=2 23329 B18R2.3922 Cc1c(cccc1COCc2ccccc2)F 34a_100000210790_100009813626 [0,2,0,0,0,0|0,0,0]=2 23330 B18R2.3922 Cc1c(cccc1COCc2ccccc2)F 7a_100000042775_100000211182 [0,2,0,0,0,0|0,0,0]=2 23331 B18R2.3922 Cc1c(cccc1COCc2ccccc2)F 7a_100000210790_100009813626 [0,2,0,0,0,0|0,0,0]=2 23332 B18R2.3922 Cc1c(cccc1COCc2ccccc2)I 34a_100000210790_100010150147 [0,2,0,0,0,0|0,0,0]=2 23333 B18R2.3922 Cc1c(cccc1COCc2ccccc2)I 34a_100010150139_100015291786 [0,2,0,0,0,0|0,0,0]=2 23334 B18R2.3922 Cc1c(cccc1COCc2ccccc2)I 7a_100000210790_100010150147 [0,2,0,0,0,0|0,0,0]=2 23335 B18R2.3922 Cc1c(cccc1COCc2ccccc2)I 7a_100010150139_100000211182 [0,2,0,0,0,0|0,0,0]=2 23336 B18R2.3922 Cc1c(cccc1COCc2ccccc2)N 34a_102495339961_100015291786 [0,2,0,0,0,0|0,0,0]=2 23337 B18R2.3922 Cc1c(cccc1COCc2ccccc2)N 7a_102495339961_100000211182 [0,2,0,0,0,0|0,0,0]=2 23338 B18R2.3922 Cc1c(cccc1COCc2ccccn2)Br 34a_100000694458_100000721315 [0,2,0,0,0,0|1,0,0]=3 23339 B18R2.3922 Cc1c(cccc1COCc2ccccn2)Br 7a_100000694458_100000721315 [0,2,0,0,0,0|1,0,0]=3 23340 B18R2.3922 Cc1c(cccc1COCc2ccccn2)Cl 34a_100012000165_100000721315 [0,2,0,0,0,0|1,0,0]=3 23341 B18R2.3922 Cc1c(cccc1COCc2ccccn2)Cl 7a_100012000165_100000721315 [0,2,0,0,0,0|1,0,0]=3 23342 B18R2.3922 Cc1c(cccc1COCc2ccccn2)F 34a_100000042775_100000721315 [0,2,0,0,0,0|1,0,0]=3 23343 B18R2.3922 Cc1c(cccc1COCc2ccccn2)F 7a_100000042775_100000721315 [0,2,0,0,0,0|1,0,0]=3 23344 B18R2.3922 Cc1c(cccc1COCc2ccccn2)I 34a_100010150139_100000721315 [0,2,0,0,0,0|1,0,0]=3 23345 B18R2.3922 Cc1c(cccc1COCc2ccccn2)I 7a_100010150139_100000721315 [0,2,0,0,0,0|1,0,0]=3 23346 B18R2.3922 Cc1c(cccc1COCc2ccccn2)N 34a_102495339961_100000721315 [0,2,0,0,0,0|1,0,0]=3 23347 B18R2.3922 Cc1c(cccc1COCc2ccccn2)N 7a_102495339961_100000721315 [0,2,0,0,0,0|1,0,0]=3 23348 B18R2.3922 Cc1c(cccc1COCc2cccnc2)Br 34a_100000694458_100000733263 [0,2,0,0,0,0|1,0,0]=3 23349 B18R2.3922 Cc1c(cccc1COCc2cccnc2)Br 7a_100000694458_100000741622 [0,2,0,0,0,0|1,0,0]=3 23350 B18R2.3922 Cc1c(cccc1COCc2cccnc2)Cl 34a_100012000165_100000733263 [0,2,0,0,0,0|1,0,0]=3 23351 B18R2.3922 Cc1c(cccc1COCc2cccnc2)Cl 7a_100012000165_100000741622 [0,2,0,0,0,0|1,0,0]=3 23352 B18R2.3922 Cc1c(cccc1COCc2cccnc2)F 34a_100000042775_100000733263 [0,2,0,0,0,0|1,0,0]=3 23353 B18R2.3922 Cc1c(cccc1COCc2cccnc2)F 7a_100000042775_100000741622 [0,2,0,0,0,0|1,0,0]=3 23354 B18R2.3922 Cc1c(cccc1COCc2cccnc2)I 34a_100010150139_100000733263 [0,2,0,0,0,0|1,0,0]=3 23355 B18R2.3922 Cc1c(cccc1COCc2cccnc2)I 7a_100010150139_100000741622 [0,2,0,0,0,0|1,0,0]=3 23356 B18R2.3922 Cc1c(cccc1COCc2cccnc2)N 34a_102495339961_100000733263 [0,2,0,0,0,0|1,0,0]=3 23357 B18R2.3922 Cc1c(cccc1COCc2cccnc2)N 7a_102495339961_100000741622 [0,2,0,0,0,0|1,0,0]=3 23358 B18R2.3922 Cc1c(cccc1COCc2cccnn2)Br 34a_100000694458_100016990269 [0,2,0,0,0,0|2,0,0]=4 23359 B18R2.3922 Cc1c(cccc1COCc2cccnn2)Br 7a_100000694458_100016990269 [0,2,0,0,0,0|2,0,0]=4 23360 B18R2.3922 Cc1c(cccc1COCc2cccnn2)Cl 34a_100012000165_100016990269 [0,2,0,0,0,0|2,0,0]=4 23361 B18R2.3922 Cc1c(cccc1COCc2cccnn2)Cl 7a_100012000165_100016990269 [0,2,0,0,0,0|2,0,0]=4 23362 B18R2.3922 Cc1c(cccc1COCc2cccnn2)F 34a_100000042775_100016990269 [0,2,0,0,0,0|2,0,0]=4 23363 B18R2.3922 Cc1c(cccc1COCc2cccnn2)F 7a_100000042775_100016990269 [0,2,0,0,0,0|2,0,0]=4 23364 B18R2.3922 Cc1c(cccc1COCc2cccnn2)I 34a_100010150139_100016990269 [0,2,0,0,0,0|2,0,0]=4 23365 B18R2.3922 Cc1c(cccc1COCc2cccnn2)I 7a_100010150139_100016990269 [0,2,0,0,0,0|2,0,0]=4 23366 B18R2.3922 Cc1c(cccc1COCc2cccnn2)N 34a_102495339961_100016990269 [0,2,0,0,0,0|2,0,0]=4 23367 B18R2.3922 Cc1c(cccc1COCc2cccnn2)N 7a_102495339961_100016990269 [0,2,0,0,0,0|2,0,0]=4 23368 B18R2.3922 Cc1c(cccc1COCc2ccncc2)Br 7a_100000694458_100015193705 [0,2,0,0,0,0|1,0,0]=3 23369 B18R2.3922 Cc1c(cccc1COCc2ccncc2)Cl 7a_100012000165_100015193705 [0,2,0,0,0,0|1,0,0]=3 23370 B18R2.3922 Cc1c(cccc1COCc2ccncc2)F 7a_100000042775_100015193705 [0,2,0,0,0,0|1,0,0]=3 23371 B18R2.3922 Cc1c(cccc1COCc2ccncc2)I 7a_100010150139_100015193705 [0,2,0,0,0,0|1,0,0]=3 23372 B18R2.3922 Cc1c(cccc1COCc2ccncc2)N 7a_102495339961_100015193705 [0,2,0,0,0,0|1,0,0]=3 23373 B18R2.3922 Cc1c(cccc1COCc2cnccn2)Br 34a_100000694458_100016995436 [0,2,0,0,0,0|2,0,0]=4 23374 B18R2.3922 Cc1c(cccc1COCc2cnccn2)Br 7a_100000694458_100016995436 [0,2,0,0,0,0|2,0,0]=4 23375 B18R2.3922 Cc1c(cccc1COCc2cnccn2)Cl 34a_100012000165_100016995436 [0,2,0,0,0,0|2,0,0]=4 23376 B18R2.3922 Cc1c(cccc1COCc2cnccn2)Cl 7a_100012000165_100016995436 [0,2,0,0,0,0|2,0,0]=4 23377 B18R2.3922 Cc1c(cccc1COCc2cnccn2)F 34a_100000042775_100016995436 [0,2,0,0,0,0|2,0,0]=4 23378 B18R2.3922 Cc1c(cccc1COCc2cnccn2)F 7a_100000042775_100016995436 [0,2,0,0,0,0|2,0,0]=4 23379 B18R2.3922 Cc1c(cccc1COCc2cnccn2)I 34a_100010150139_100016995436 [0,2,0,0,0,0|2,0,0]=4 23380 B18R2.3922 Cc1c(cccc1COCc2cnccn2)I 7a_100010150139_100016995436 [0,2,0,0,0,0|2,0,0]=4 23381 B18R2.3922 Cc1c(cccc1COCc2cnccn2)N 34a_102495339961_100016995436 [0,2,0,0,0,0|2,0,0]=4 23382 B18R2.3922 Cc1c(cccc1COCc2cnccn2)N 7a_102495339961_100016995436 [0,2,0,0,0,0|2,0,0]=4 23383 B18R2.3922 Cc1c(cccc1COCc2cncnc2)Br 34a_100000694458_100015196519 [0,2,0,0,0,0|2,0,0]=4 23384 B18R2.3922 Cc1c(cccc1COCc2cncnc2)Br 7a_100000694458_100015196519 [0,2,0,0,0,0|2,0,0]=4 23385 B18R2.3922 Cc1c(cccc1COCc2cncnc2)Cl 34a_100012000165_100015196519 [0,2,0,0,0,0|2,0,0]=4 23386 B18R2.3922 Cc1c(cccc1COCc2cncnc2)Cl 7a_100012000165_100015196519 [0,2,0,0,0,0|2,0,0]=4 23387 B18R2.3922 Cc1c(cccc1COCc2cncnc2)F 34a_100000042775_100015196519 [0,2,0,0,0,0|2,0,0]=4 23388 B18R2.3922 Cc1c(cccc1COCc2cncnc2)F 7a_100000042775_100015196519 [0,2,0,0,0,0|2,0,0]=4 23389 B18R2.3922 Cc1c(cccc1COCc2cncnc2)I 34a_100010150139_100015196519 [0,2,0,0,0,0|2,0,0]=4 23390 B18R2.3922 Cc1c(cccc1COCc2cncnc2)I 7a_100010150139_100015196519 [0,2,0,0,0,0|2,0,0]=4 23391 B18R2.3922 Cc1c(cccc1COCc2cncnc2)N 34a_102495339961_100015196519 [0,2,0,0,0,0|2,0,0]=4 23392 B18R2.3922 Cc1c(cccc1COCc2cncnc2)N 7a_102495339961_100015196519 [0,2,0,0,0,0|2,0,0]=4 23393 B18R2.3922 Cc1c(cccc1COCc2ncccn2)Br 34a_100000694458_100000703007 [0,2,0,0,0,0|2,0,0]=4 23394 B18R2.3922 Cc1c(cccc1COCc2ncccn2)Br 7a_100000694458_100000703007 [0,2,0,0,0,0|2,0,0]=4 23395 B18R2.3922 Cc1c(cccc1COCc2ncccn2)Cl 34a_100012000165_100000703007 [0,2,0,0,0,0|2,0,0]=4 23396 B18R2.3922 Cc1c(cccc1COCc2ncccn2)Cl 7a_100012000165_100000703007 [0,2,0,0,0,0|2,0,0]=4 23397 B18R2.3922 Cc1c(cccc1COCc2ncccn2)F 34a_100000042775_100000703007 [0,2,0,0,0,0|2,0,0]=4 23398 B18R2.3922 Cc1c(cccc1COCc2ncccn2)F 7a_100000042775_100000703007 [0,2,0,0,0,0|2,0,0]=4 23399 B18R2.3922 Cc1c(cccc1COCc2ncccn2)I 34a_100010150139_100000703007 [0,2,0,0,0,0|2,0,0]=4 23400 B18R2.3922 Cc1c(cccc1COCc2ncccn2)I 7a_100010150139_100000703007 [0,2,0,0,0,0|2,0,0]=4 23401 B18R2.3922 Cc1c(cccc1COCc2ncccn2)N 34a_102495339961_100000703007 [0,2,0,0,0,0|2,0,0]=4 23402 B18R2.3922 Cc1c(cccc1COCc2ncccn2)N 7a_102495339961_100000703007 [0,2,0,0,0,0|2,0,0]=4 23403 B18R2.3922 Cc1c(cccc1CSCc2ccccc2)Br 62a_100000211182_100000694682 [0,2,0,0,0,0|0,1,0]=3 23404 B18R2.3922 Cc1c(cccc1CSCc2ccccc2)Br 62a_100000694682_100015291786 [0,2,0,0,0,0|0,1,0]=3 23405 B18R2.3922 Cc1c(cccc1CSCc2ccccc2)Cl 62a_100000211182_100012186920 [0,2,0,0,0,0|0,1,0]=3 23406 B18R2.3922 Cc1c(cccc1CSCc2ccccc2)Cl 62a_100012186920_100015291786 [0,2,0,0,0,0|0,1,0]=3 23407 B18R2.3922 Cc1c(cccc1CSCc2ccccc2)F 62a_100000211182_100009813626 [0,2,0,0,0,0|0,1,0]=3 23408 B18R2.3922 Cc1c(cccc1CSCc2ccccc2)F 62a_100009813626_100015291786 [0,2,0,0,0,0|0,1,0]=3 23409 B18R2.3922 Cc1c(cccc1CSCc2ccccc2)I 62a_100000211182_100010150147 [0,2,0,0,0,0|0,1,0]=3 23410 B18R2.3922 Cc1c(cccc1CSCc2ccccc2)I 62a_100010150147_100015291786 [0,2,0,0,0,0|0,1,0]=3 23411 B18R2.3922 Cc1c(cccc1CSCc2ccccn2)Br 62a_100000694682_100000721315 [0,2,0,0,0,0|1,1,0]=4 23412 B18R2.3922 Cc1c(cccc1CSCc2ccccn2)Br 62a_100000721315_100000694682 [0,2,0,0,0,0|1,1,0]=4 23413 B18R2.3922 Cc1c(cccc1CSCc2ccccn2)Cl 62a_100000721315_100012186920 [0,2,0,0,0,0|1,1,0]=4 23414 B18R2.3922 Cc1c(cccc1CSCc2ccccn2)Cl 62a_100012186920_100000721315 [0,2,0,0,0,0|1,1,0]=4 23415 B18R2.3922 Cc1c(cccc1CSCc2ccccn2)F 62a_100000721315_100009813626 [0,2,0,0,0,0|1,1,0]=4 23416 B18R2.3922 Cc1c(cccc1CSCc2ccccn2)F 62a_100009813626_100000721315 [0,2,0,0,0,0|1,1,0]=4 23417 B18R2.3922 Cc1c(cccc1CSCc2ccccn2)I 62a_100000721315_100010150147 [0,2,0,0,0,0|1,1,0]=4 23418 B18R2.3922 Cc1c(cccc1CSCc2ccccn2)I 62a_100010150147_100000721315 [0,2,0,0,0,0|1,1,0]=4 23419 B18R2.3922 Cc1c(cccc1CSCc2cccnc2)Br 62a_100000694682_100000741622 [0,2,0,0,0,0|1,1,0]=4 23420 B18R2.3922 Cc1c(cccc1CSCc2cccnc2)Br 62a_100000741622_100000694682 [0,2,0,0,0,0|1,1,0]=4 23421 B18R2.3922 Cc1c(cccc1CSCc2cccnc2)Cl 62a_100000741622_100012186920 [0,2,0,0,0,0|1,1,0]=4 23422 B18R2.3922 Cc1c(cccc1CSCc2cccnc2)Cl 62a_100012186920_100000741622 [0,2,0,0,0,0|1,1,0]=4 23423 B18R2.3922 Cc1c(cccc1CSCc2cccnc2)F 62a_100000741622_100009813626 [0,2,0,0,0,0|1,1,0]=4 23424 B18R2.3922 Cc1c(cccc1CSCc2cccnc2)F 62a_100009813626_100000741622 [0,2,0,0,0,0|1,1,0]=4 23425 B18R2.3922 Cc1c(cccc1CSCc2cccnc2)I 62a_100000741622_100010150147 [0,2,0,0,0,0|1,1,0]=4 23426 B18R2.3922 Cc1c(cccc1CSCc2cccnc2)I 62a_100010150147_100000741622 [0,2,0,0,0,0|1,1,0]=4 23427 B18R2.3922 Cc1c(cccc1CSCc2ccncc2)Br 62a_100000694682_100015193705 [0,2,0,0,0,0|1,1,0]=4 23428 B18R2.3922 Cc1c(cccc1CSCc2ccncc2)Br 62a_100015193705_100000694682 [0,2,0,0,0,0|1,1,0]=4 23429 B18R2.3922 Cc1c(cccc1CSCc2ccncc2)Cl 62a_100012186920_100015193705 [0,2,0,0,0,0|1,1,0]=4 23430 B18R2.3922 Cc1c(cccc1CSCc2ccncc2)Cl 62a_100015193705_100012186920 [0,2,0,0,0,0|1,1,0]=4 23431 B18R2.3922 Cc1c(cccc1CSCc2ccncc2)F 62a_100009813626_100015193705 [0,2,0,0,0,0|1,1,0]=4 23432 B18R2.3922 Cc1c(cccc1CSCc2ccncc2)F 62a_100015193705_100009813626 [0,2,0,0,0,0|1,1,0]=4 23433 B18R2.3922 Cc1c(cccc1CSCc2ccncc2)I 62a_100010150147_100015193705 [0,2,0,0,0,0|1,1,0]=4 23434 B18R2.3922 Cc1c(cccc1CSCc2ccncc2)I 62a_100015193705_100010150147 [0,2,0,0,0,0|1,1,0]=4 23435 B18R2.3922 Cc1c(cccc1NCCc2ccccc2)Br 34a_100000750434_100000765856 [0,2,0,0,0,0|2,0,0]=4 23436 B18R2.3922 Cc1c(cccc1NCCc2ccccc2)Cl 2230a_100000210441_100000765856 [0,2,0,0,0,0|2,0,0]=4 23437 B18R2.3922 Cc1c(cccc1NCCc2ccccc2)Cl 34a_100000210441_100000765856 [0,2,0,0,0,0|2,0,0]=4 23438 B18R2.3922 Cc1c(cccc1NCCc2ccccc2)Cl 7a_100000210441_100000765856 [0,2,0,0,0,0|2,0,0]=4 23439 B18R2.3922 Cc1c(cccc1NCCc2ccccc2)F 34a_100000745574_100000765856 [0,2,0,0,0,0|2,0,0]=4 23440 B18R2.3922 Cc1c(cccc1NCCc2ccccc2)F 7a_100000745574_100000765856 [0,2,0,0,0,0|2,0,0]=4 23441 B18R2.3922 Cc1c(cccc1NCCc2ccccc2)I 34a_100000761887_100000765856 [0,2,0,0,0,0|2,0,0]=4 23442 B18R2.3922 Cc1c(cccc1NCCc2ccccc2)O 34a_100011216573_100000765856 [0,2,0,0,0,0|2,0,0]=4 23443 B18R2.3922 Cc1c(cccc1NCCc2ccccc2)O 7a_100011216573_100000765856 [0,2,0,0,0,0|2,0,0]=4 23444 B18R2.3922 Cc1c(cccc1OCCc2ccccc2)Br 34a_100012002258_100000765856 [0,2,0,0,0,0|2,0,0]=4 23445 B18R2.3922 Cc1c(cccc1OCCc2ccccc2)Br 7a_100012002258_100000765856 [0,2,0,0,0,0|2,0,0]=4 23446 B18R2.3922 Cc1c(cccc1OCCc2ccccc2)Cl 34a_100011265684_100000765856 [0,2,0,0,0,0|2,0,0]=4 23447 B18R2.3922 Cc1c(cccc1OCCc2ccccc2)Cl 7a_100011265684_100000765856 [0,2,0,0,0,0|2,0,0]=4 23448 B18R2.3922 Cc1c(cccc1OCCc2ccccc2)F 34a_100011217231_100000765856 [0,2,0,0,0,0|2,0,0]=4 23449 B18R2.3922 Cc1c(cccc1OCCc2ccccc2)F 7a_100011217231_100000765856 [0,2,0,0,0,0|2,0,0]=4 23450 B18R2.3922 Cc1c(cccc1OCCc2ccccc2)N 34a_100011216573_100000765856 [0,2,0,0,0,0|2,0,0]=4 23451 B18R2.3922 Cc1c(cccc1OCCc2ccccc2)N 7a_100011216573_100000765856 [0,2,0,0,0,0|2,0,0]=4 23452 B18R2.3922 Cc1c(cccc1SCCc2ccccc2)Br 62a_100000765856_100012353703 [0,2,0,0,0,0|2,0,0]=4 23453 B18R2.3922 Cc1c(cccc1SCCc2ccccc2)Br 62a_100012353703_100011218657 [0,2,0,0,0,0|2,0,0]=4 23454 B18R2.3922 Cc1c(cccc1SCCc2ccccc2)Cl 62a_100000726075_100011218657 [0,2,0,0,0,0|2,0,0]=4 23455 B18R2.3922 Cc1c(cccc1SCCc2ccccc2)Cl 62a_100000765856_100000726075 [0,2,0,0,0,0|2,0,0]=4 23456 B18R2.3922 Cc1c(cccc1SCCc2ccccc2)F 62a_100000765856_100011216893 [0,2,0,0,0,0|2,0,0]=4 23457 B18R2.3922 Cc1c(cccc1SCCc2ccccc2)F 62a_100011216893_100011218657 [0,2,0,0,0,0|2,0,0]=4 23458 B18R2.3922 Cc1c(cccc1SCCc2ccccc2)N 62a_100000761887_100011218657 [0,2,0,0,0,0|2,0,0]=4 23459 B18R2.3922 Cc1c(cccc1SCCc2ccccc2)N 62a_100000765856_100000761887 [0,2,0,0,0,0|2,0,0]=4 23460 B18R2.3922 Cc1c(cccc1SCCc2ccccc2)O 62a_100000765856_100012002258 [0,2,0,0,0,0|2,0,0]=4 23461 B18R2.3922 Cc1c(cccc1SCCc2ccccc2)O 62a_100012002258_100011218657 [0,2,0,0,0,0|2,0,0]=4 23462 B18R2.3922 Cc1c(ccnc1CNCc2ccccc2)Cl 2230a_100015324214_100020614443 [0,2,0,0,0,0|2,0,0]=4 23463 B18R2.3922 Cc1c(ccnc1CNCc2ccccc2)Cl 34a_100015324214_100020614443 [0,2,0,0,0,0|2,0,0]=4 23464 B18R2.3922 Cc1c(ccnc1COCc2ccccc2)Cl 34a_100000210790_100020614443 [0,2,0,0,0,0|1,0,0]=3 23465 B18R2.3922 Cc1c(ccnc1COCc2ccccc2)Cl 7a_100000210790_100020614443 [0,2,0,0,0,0|1,0,0]=3 23466 B18R2.3922 Cc1c(ccnc1CSCc2ccccc2)Cl 62a_100000211182_100020614443 [0,2,0,0,0,0|1,1,0]=4 23467 B18R2.3922 Cc1c(ccnc1CSCc2ccccc2)Cl 62a_100020614443_100015291786 [0,2,0,0,0,0|1,1,0]=4 23468 B18R2.3922 Cc1c(ccnc1Cl)CNCc2ccccc2 207a_100015324214_100000096011 [0,2,0,0,0,0|2,0,0]=4 23469 B18R2.3922 Cc1c(ccnc1Cl)CNCc2ccccc2 270004a_100015324214_100000096011 [0,2,0,0,0,0|2,0,0]=4 23470 B18R2.3922 Cc1c(cncc1CNCc2ccccc2)Br 207a_100015324214_100010214934 [0,2,0,0,0,0|2,0,0]=4 23471 B18R2.3922 Cc1c(cncc1CNCc2ccccc2)Br 270004a_100015324214_100010214934 [0,2,0,0,0,0|2,0,0]=4 23472 B18R2.3922 Cc1cccc(c1Br)CNCc2ccccc2 207a_100015324214_100012186367 [0,2,0,0,0,0|1,0,0]=3 23473 B18R2.3922 Cc1cccc(c1Br)CNCc2ccccc2 2230a_100015324214_200012349612 [0,2,0,0,0,0|1,0,0]=3 23474 B18R2.3922 Cc1cccc(c1Br)CNCc2ccccc2 270004a_100015324214_100012186367 [0,2,0,0,0,0|1,0,0]=3 23475 B18R2.3922 Cc1cccc(c1Br)CNCc2ccccc2 34a_100015324214_200012349612 [0,2,0,0,0,0|1,0,0]=3 23476 B18R2.3922 Cc1cccc(c1Br)CNCc2ccccn2 270004a_100000210449_100012186367 [0,2,0,0,0,0|2,0,0]=4 23477 B18R2.3922 Cc1cccc(c1Br)CNCc2cccnc2 207a_100000210453_100012186367 [0,2,0,0,0,0|2,0,0]=4 23478 B18R2.3922 Cc1cccc(c1Br)CNCc2cccnc2 270004a_100000210453_100012186367 [0,2,0,0,0,0|2,0,0]=4 23479 B18R2.3922 Cc1cccc(c1Br)COCc2ccccc2 34a_100000210790_200012349612 [0,2,0,0,0,0|0,0,0]=2 23480 B18R2.3922 Cc1cccc(c1Br)COCc2ccccc2 34a_100011659289_100015291786 [0,2,0,0,0,0|0,0,0]=2 23481 B18R2.3922 Cc1cccc(c1Br)COCc2ccccc2 7a_100000210790_200012349612 [0,2,0,0,0,0|0,0,0]=2 23482 B18R2.3922 Cc1cccc(c1Br)COCc2ccccc2 7a_100011659289_100000211182 [0,2,0,0,0,0|0,0,0]=2 23483 B18R2.3922 Cc1cccc(c1Br)COCc2ccccn2 34a_100011659289_100000721315 [0,2,0,0,0,0|1,0,0]=3 23484 B18R2.3922 Cc1cccc(c1Br)COCc2ccccn2 7a_100011659289_100000721315 [0,2,0,0,0,0|1,0,0]=3 23485 B18R2.3922 Cc1cccc(c1Br)COCc2cccnc2 34a_100011659289_100000733263 [0,2,0,0,0,0|1,0,0]=3 23486 B18R2.3922 Cc1cccc(c1Br)COCc2cccnc2 7a_100011659289_100000741622 [0,2,0,0,0,0|1,0,0]=3 23487 B18R2.3922 Cc1cccc(c1Br)COCc2cccnn2 34a_100011659289_100016990269 [0,2,0,0,0,0|2,0,0]=4 23488 B18R2.3922 Cc1cccc(c1Br)COCc2cccnn2 7a_100011659289_100016990269 [0,2,0,0,0,0|2,0,0]=4 23489 B18R2.3922 Cc1cccc(c1Br)COCc2ccncc2 7a_100011659289_100015193705 [0,2,0,0,0,0|1,0,0]=3 23490 B18R2.3922 Cc1cccc(c1Br)COCc2cnccn2 34a_100011659289_100016995436 [0,2,0,0,0,0|2,0,0]=4 23491 B18R2.3922 Cc1cccc(c1Br)COCc2cnccn2 7a_100011659289_100016995436 [0,2,0,0,0,0|2,0,0]=4 23492 B18R2.3922 Cc1cccc(c1Br)COCc2cncnc2 34a_100011659289_100015196519 [0,2,0,0,0,0|2,0,0]=4 23493 B18R2.3922 Cc1cccc(c1Br)COCc2cncnc2 7a_100011659289_100015196519 [0,2,0,0,0,0|2,0,0]=4 23494 B18R2.3922 Cc1cccc(c1Br)COCc2ncccn2 34a_100011659289_100000703007 [0,2,0,0,0,0|2,0,0]=4 23495 B18R2.3922 Cc1cccc(c1Br)COCc2ncccn2 7a_100011659289_100000703007 [0,2,0,0,0,0|2,0,0]=4 23496 B18R2.3922 Cc1cccc(c1Br)CSCc2ccccc2 62a_100000211182_200012349612 [0,2,0,0,0,0|0,1,0]=3 23497 B18R2.3922 Cc1cccc(c1Br)CSCc2ccccc2 62a_200012349612_100015291786 [0,2,0,0,0,0|0,1,0]=3 23498 B18R2.3922 Cc1cccc(c1Br)CSCc2ccccn2 62a_100000721315_200012349612 [0,2,0,0,0,0|1,1,0]=4 23499 B18R2.3922 Cc1cccc(c1Br)CSCc2ccccn2 62a_200012349612_100000721315 [0,2,0,0,0,0|1,1,0]=4 23500 B18R2.3922 Cc1cccc(c1Br)CSCc2cccnc2 62a_100000741622_200012349612 [0,2,0,0,0,0|1,1,0]=4 23501 B18R2.3922 Cc1cccc(c1Br)CSCc2cccnc2 62a_200012349612_100000741622 [0,2,0,0,0,0|1,1,0]=4 23502 B18R2.3922 Cc1cccc(c1Br)CSCc2ccncc2 62a_100015193705_200012349612 [0,2,0,0,0,0|1,1,0]=4 23503 B18R2.3922 Cc1cccc(c1Br)CSCc2ccncc2 62a_200012349612_100015193705 [0,2,0,0,0,0|1,1,0]=4 23504 B18R2.3922 Cc1cccc(c1Br)NCCc2ccccc2 34a_100000684715_100000765856 [0,2,0,0,0,0|2,0,0]=4 23505 B18R2.3922 Cc1cccc(c1Br)OCCc2ccccc2 34a_100000686692_100000765856 [0,2,0,0,0,0|2,0,0]=4 23506 B18R2.3922 Cc1cccc(c1Br)OCCc2ccccc2 7a_100000686692_100000765856 [0,2,0,0,0,0|2,0,0]=4 23507 B18R2.3922 Cc1cccc(c1Br)SCCc2ccccc2 62a_100000765856_100012362457 [0,2,0,0,0,0|2,0,0]=4 23508 B18R2.3922 Cc1cccc(c1Br)SCCc2ccccc2 62a_100012362457_100011218657 [0,2,0,0,0,0|2,0,0]=4 23509 B18R2.3922 Cc1cccc(c1C)C=CCc2ccccc2 271570a_200016263579_100011214922 [0,2,0,0,0,0|1,0,1]=4 23510 B18R2.3922 Cc1cccc(c1C)CNCc2ccccc2 207a_100011211637_100015611070 [0,2,0,0,0,0|1,0,0]=3 23511 B18R2.3922 Cc1cccc(c1C)CNCc2ccccc2 207a_100015324214_100000229941 [0,2,0,0,0,0|1,0,0]=3 23512 B18R2.3922 Cc1cccc(c1C)CNCc2ccccc2 2230a_100011211637_100015291786 [0,2,0,0,0,0|1,0,0]=3 23513 B18R2.3922 Cc1cccc(c1C)CNCc2ccccc2 2230a_100015324214_100011515928 [0,2,0,0,0,0|1,0,0]=3 23514 B18R2.3922 Cc1cccc(c1C)CNCc2ccccc2 270004a_100011211637_100015611070 [0,2,0,0,0,0|1,0,0]=3 23515 B18R2.3922 Cc1cccc(c1C)CNCc2ccccc2 270004a_100015324214_100000229941 [0,2,0,0,0,0|1,0,0]=3 23516 B18R2.3922 Cc1cccc(c1C)CNCc2ccccc2 34a_100011211637_100015291786 [0,2,0,0,0,0|1,0,0]=3 23517 B18R2.3922 Cc1cccc(c1C)CNCc2ccccc2 34a_100015324214_100011273979 [0,2,0,0,0,0|1,0,0]=3 23518 B18R2.3922 Cc1cccc(c1C)CNCc2ccccn2 207a_100011211637_100000209966 [0,2,0,0,0,0|2,0,0]=4 23519 B18R2.3922 Cc1cccc(c1C)CNCc2ccccn2 2230a_100011211637_100000721315 [0,2,0,0,0,0|2,0,0]=4 23520 B18R2.3922 Cc1cccc(c1C)CNCc2ccccn2 270004a_100000210449_100000229941 [0,2,0,0,0,0|2,0,0]=4 23521 B18R2.3922 Cc1cccc(c1C)CNCc2ccccn2 270004a_100011211637_100000209966 [0,2,0,0,0,0|2,0,0]=4 23522 B18R2.3922 Cc1cccc(c1C)CNCc2ccccn2 34a_100011211637_100000721315 [0,2,0,0,0,0|2,0,0]=4 23523 B18R2.3922 Cc1cccc(c1C)CNCc2cccnc2 207a_100000210453_100000229941 [0,2,0,0,0,0|2,0,0]=4 23524 B18R2.3922 Cc1cccc(c1C)CNCc2cccnc2 207a_100011211637_100000209961 [0,2,0,0,0,0|2,0,0]=4 23525 B18R2.3922 Cc1cccc(c1C)CNCc2cccnc2 2230a_100011211637_100000741622 [0,2,0,0,0,0|2,0,0]=4 23526 B18R2.3922 Cc1cccc(c1C)CNCc2cccnc2 270004a_100000210453_100000229941 [0,2,0,0,0,0|2,0,0]=4 23527 B18R2.3922 Cc1cccc(c1C)CNCc2cccnc2 270004a_100011211637_100000209961 [0,2,0,0,0,0|2,0,0]=4 23528 B18R2.3922 Cc1cccc(c1C)CNCc2cccnc2 34a_100011211637_100000733263 [0,2,0,0,0,0|2,0,0]=4 23529 B18R2.3922 Cc1cccc(c1C)CNCc2ccncc2 207a_100011211637_100000186114 [0,2,0,0,0,0|2,0,0]=4 23530 B18R2.3922 Cc1cccc(c1C)CNCc2ccncc2 2230a_100011211637_100015193705 [0,2,0,0,0,0|2,0,0]=4 23531 B18R2.3922 Cc1cccc(c1C)COCc2ccccc2 34a_100000210790_100011273979 [0,2,0,0,0,0|0,0,0]=2 23532 B18R2.3922 Cc1cccc(c1C)COCc2ccccc2 34a_100011219135_100015291786 [0,2,0,0,0,0|0,0,0]=2 23533 B18R2.3922 Cc1cccc(c1C)COCc2ccccc2 7a_100000210790_100011515928 [0,2,0,0,0,0|0,0,0]=2 23534 B18R2.3922 Cc1cccc(c1C)COCc2ccccc2 7a_100011219135_100000211182 [0,2,0,0,0,0|0,0,0]=2 23535 B18R2.3922 Cc1cccc(c1C)COCc2ccccn2 34a_100011219135_100000721315 [0,2,0,0,0,0|1,0,0]=3 23536 B18R2.3922 Cc1cccc(c1C)COCc2ccccn2 7a_100011219135_100000721315 [0,2,0,0,0,0|1,0,0]=3 23537 B18R2.3922 Cc1cccc(c1C)COCc2cccnc2 34a_100011219135_100000733263 [0,2,0,0,0,0|1,0,0]=3 23538 B18R2.3922 Cc1cccc(c1C)COCc2cccnc2 7a_100011219135_100000741622 [0,2,0,0,0,0|1,0,0]=3 23539 B18R2.3922 Cc1cccc(c1C)COCc2cccnn2 34a_100011219135_100016990269 [0,2,0,0,0,0|2,0,0]=4 23540 B18R2.3922 Cc1cccc(c1C)COCc2cccnn2 7a_100011219135_100016990269 [0,2,0,0,0,0|2,0,0]=4 23541 B18R2.3922 Cc1cccc(c1C)COCc2ccncc2 7a_100011219135_100015193705 [0,2,0,0,0,0|1,0,0]=3 23542 B18R2.3922 Cc1cccc(c1C)COCc2cnccn2 34a_100011219135_100016995436 [0,2,0,0,0,0|2,0,0]=4 23543 B18R2.3922 Cc1cccc(c1C)COCc2cnccn2 7a_100011219135_100016995436 [0,2,0,0,0,0|2,0,0]=4 23544 B18R2.3922 Cc1cccc(c1C)COCc2cncnc2 34a_100011219135_100015196519 [0,2,0,0,0,0|2,0,0]=4 23545 B18R2.3922 Cc1cccc(c1C)COCc2cncnc2 7a_100011219135_100015196519 [0,2,0,0,0,0|2,0,0]=4 23546 B18R2.3922 Cc1cccc(c1C)COCc2ncccn2 34a_100011219135_100000703007 [0,2,0,0,0,0|2,0,0]=4 23547 B18R2.3922 Cc1cccc(c1C)COCc2ncccn2 7a_100011219135_100000703007 [0,2,0,0,0,0|2,0,0]=4 23548 B18R2.3922 Cc1cccc(c1C)CSCc2ccccc2 62a_100000211182_100011515928 [0,2,0,0,0,0|0,1,0]=3 23549 B18R2.3922 Cc1cccc(c1C)CSCc2ccccc2 62a_100011515928_100015291786 [0,2,0,0,0,0|0,1,0]=3 23550 B18R2.3922 Cc1cccc(c1C)CSCc2ccccn2 62a_100000721315_100011515928 [0,2,0,0,0,0|1,1,0]=4 23551 B18R2.3922 Cc1cccc(c1C)CSCc2ccccn2 62a_100011515928_100000721315 [0,2,0,0,0,0|1,1,0]=4 23552 B18R2.3922 Cc1cccc(c1C)CSCc2cccnc2 62a_100000741622_100011515928 [0,2,0,0,0,0|1,1,0]=4 23553 B18R2.3922 Cc1cccc(c1C)CSCc2cccnc2 62a_100011515928_100000741622 [0,2,0,0,0,0|1,1,0]=4 23554 B18R2.3922 Cc1cccc(c1C)CSCc2ccncc2 62a_100011515928_100015193705 [0,2,0,0,0,0|1,1,0]=4 23555 B18R2.3922 Cc1cccc(c1C)CSCc2ccncc2 62a_100015193705_100011515928 [0,2,0,0,0,0|1,1,0]=4 23556 B18R2.3922 Cc1cccc(c1C)NCCc2ccccc2 2230a_100000210026_100000765856 [0,2,0,0,0,0|2,0,0]=4 23557 B18R2.3922 Cc1cccc(c1C)NCCc2ccccc2 34a_100000210026_100000765856 [0,2,0,0,0,0|2,0,0]=4 23558 B18R2.3922 Cc1cccc(c1C)NCCc2ccccc2 7a_100000210026_100000765856 [0,2,0,0,0,0|2,0,0]=4 23559 B18R2.3922 Cc1cccc(c1C)OCCc2ccccc2 34a_100000185855_100000765856 [0,2,0,0,0,0|2,0,0]=4 23560 B18R2.3922 Cc1cccc(c1C)OCCc2ccccc2 7a_100000185855_100000765856 [0,2,0,0,0,0|2,0,0]=4 23561 B18R2.3922 Cc1cccc(c1C)SCCc2ccccc2 62a_100000765856_100011214922 [0,2,0,0,0,0|2,0,0]=4 23562 B18R2.3922 Cc1cccc(c1C)SCCc2ccccc2 62a_100011214922_100011218657 [0,2,0,0,0,0|2,0,0]=4 23563 B18R2.3922 Cc1cccc(c1Cl)C=CCc2ccccc2 271570a_200016263579_200012352035 [0,2,0,0,0,0|1,0,1]=4 23564 B18R2.3922 Cc1cccc(c1Cl)CNCc2ccccc2 207a_100015324214_100012017286 [0,2,0,0,0,0|1,0,0]=3 23565 B18R2.3922 Cc1cccc(c1Cl)CNCc2ccccc2 207a_100025705714_100015611070 [0,2,0,0,0,0|1,0,0]=3 23566 B18R2.3922 Cc1cccc(c1Cl)CNCc2ccccc2 2230a_100025705714_100015291786 [0,2,0,0,0,0|1,0,0]=3 23567 B18R2.3922 Cc1cccc(c1Cl)CNCc2ccccc2 270004a_100015324214_100012017286 [0,2,0,0,0,0|1,0,0]=3 23568 B18R2.3922 Cc1cccc(c1Cl)CNCc2ccccc2 270004a_100025705714_100015611070 [0,2,0,0,0,0|1,0,0]=3 23569 B18R2.3922 Cc1cccc(c1Cl)CNCc2ccccc2 34a_100025705714_100015291786 [0,2,0,0,0,0|1,0,0]=3 23570 B18R2.3922 Cc1cccc(c1Cl)CNCc2ccccn2 207a_100025705714_100000209966 [0,2,0,0,0,0|2,0,0]=4 23571 B18R2.3922 Cc1cccc(c1Cl)CNCc2ccccn2 2230a_100025705714_100000721315 [0,2,0,0,0,0|2,0,0]=4 23572 B18R2.3922 Cc1cccc(c1Cl)CNCc2ccccn2 270004a_100000210449_100012017286 [0,2,0,0,0,0|2,0,0]=4 23573 B18R2.3922 Cc1cccc(c1Cl)CNCc2ccccn2 270004a_100025705714_100000209966 [0,2,0,0,0,0|2,0,0]=4 23574 B18R2.3922 Cc1cccc(c1Cl)CNCc2ccccn2 34a_100025705714_100000721315 [0,2,0,0,0,0|2,0,0]=4 23575 B18R2.3922 Cc1cccc(c1Cl)CNCc2cccnc2 207a_100000210453_100012017286 [0,2,0,0,0,0|2,0,0]=4 23576 B18R2.3922 Cc1cccc(c1Cl)CNCc2cccnc2 207a_100025705714_100000209961 [0,2,0,0,0,0|2,0,0]=4 23577 B18R2.3922 Cc1cccc(c1Cl)CNCc2cccnc2 2230a_100025705714_100000741622 [0,2,0,0,0,0|2,0,0]=4 23578 B18R2.3922 Cc1cccc(c1Cl)CNCc2cccnc2 270004a_100000210453_100012017286 [0,2,0,0,0,0|2,0,0]=4 23579 B18R2.3922 Cc1cccc(c1Cl)CNCc2cccnc2 270004a_100025705714_100000209961 [0,2,0,0,0,0|2,0,0]=4 23580 B18R2.3922 Cc1cccc(c1Cl)CNCc2cccnc2 34a_100025705714_100000733263 [0,2,0,0,0,0|2,0,0]=4 23581 B18R2.3922 Cc1cccc(c1Cl)CNCc2ccncc2 207a_100025705714_100000186114 [0,2,0,0,0,0|2,0,0]=4 23582 B18R2.3922 Cc1cccc(c1Cl)CNCc2ccncc2 2230a_100025705714_100015193705 [0,2,0,0,0,0|2,0,0]=4 23583 B18R2.3922 Cc1cccc(c1Cl)COCc2ccccc2 34a_100000710031_100015291786 [0,2,0,0,0,0|0,0,0]=2 23584 B18R2.3922 Cc1cccc(c1Cl)COCc2ccccc2 7a_100000710031_100000211182 [0,2,0,0,0,0|0,0,0]=2 23585 B18R2.3922 Cc1cccc(c1Cl)COCc2ccccn2 34a_100000710031_100000721315 [0,2,0,0,0,0|1,0,0]=3 23586 B18R2.3922 Cc1cccc(c1Cl)COCc2ccccn2 7a_100000710031_100000721315 [0,2,0,0,0,0|1,0,0]=3 23587 B18R2.3922 Cc1cccc(c1Cl)COCc2cccnc2 34a_100000710031_100000733263 [0,2,0,0,0,0|1,0,0]=3 23588 B18R2.3922 Cc1cccc(c1Cl)COCc2cccnc2 7a_100000710031_100000741622 [0,2,0,0,0,0|1,0,0]=3 23589 B18R2.3922 Cc1cccc(c1Cl)COCc2cccnn2 34a_100000710031_100016990269 [0,2,0,0,0,0|2,0,0]=4 23590 B18R2.3922 Cc1cccc(c1Cl)COCc2cccnn2 7a_100000710031_100016990269 [0,2,0,0,0,0|2,0,0]=4 23591 B18R2.3922 Cc1cccc(c1Cl)COCc2ccncc2 7a_100000710031_100015193705 [0,2,0,0,0,0|1,0,0]=3 23592 B18R2.3922 Cc1cccc(c1Cl)COCc2cnccn2 34a_100000710031_100016995436 [0,2,0,0,0,0|2,0,0]=4 23593 B18R2.3922 Cc1cccc(c1Cl)COCc2cnccn2 7a_100000710031_100016995436 [0,2,0,0,0,0|2,0,0]=4 23594 B18R2.3922 Cc1cccc(c1Cl)COCc2cncnc2 34a_100000710031_100015196519 [0,2,0,0,0,0|2,0,0]=4 23595 B18R2.3922 Cc1cccc(c1Cl)COCc2cncnc2 7a_100000710031_100015196519 [0,2,0,0,0,0|2,0,0]=4 23596 B18R2.3922 Cc1cccc(c1Cl)COCc2ncccn2 34a_100000710031_100000703007 [0,2,0,0,0,0|2,0,0]=4 23597 B18R2.3922 Cc1cccc(c1Cl)COCc2ncccn2 7a_100000710031_100000703007 [0,2,0,0,0,0|2,0,0]=4 23598 B18R2.3922 Cc1cccc(c1Cl)NCCc2ccccc2 34a_100000765562_100000765856 [0,2,0,0,0,0|2,0,0]=4 23599 B18R2.3922 Cc1cccc(c1Cl)NCCc2ccccc2 7a_100000765562_100000765856 [0,2,0,0,0,0|2,0,0]=4 23600 B18R2.3922 Cc1cccc(c1Cl)OCCc2ccccc2 34a_100000695629_100000765856 [0,2,0,0,0,0|2,0,0]=4 23601 B18R2.3922 Cc1cccc(c1Cl)OCCc2ccccc2 7a_100000695629_100000765856 [0,2,0,0,0,0|2,0,0]=4 23602 B18R2.3922 Cc1cccc(c1Cl)SCCc2ccccc2 62a_100000765856_200012352035 [0,2,0,0,0,0|2,0,0]=4 23603 B18R2.3922 Cc1cccc(c1Cl)SCCc2ccccc2 62a_200012352035_100011218657 [0,2,0,0,0,0|2,0,0]=4 23604 B18R2.3922 Cc1cccc(c1F)C=CCc2ccccc2 271570a_200016263579_100000717567 [0,2,0,0,0,0|1,0,1]=4 23605 B18R2.3922 Cc1cccc(c1F)CNCc2ccccc2 207a_100012002060_100015611070 [0,2,0,0,0,0|1,0,0]=3 23606 B18R2.3922 Cc1cccc(c1F)CNCc2ccccc2 207a_100015324214_100011219516 [0,2,0,0,0,0|1,0,0]=3 23607 B18R2.3922 Cc1cccc(c1F)CNCc2ccccc2 2230a_100012002060_100015291786 [0,2,0,0,0,0|1,0,0]=3 23608 B18R2.3922 Cc1cccc(c1F)CNCc2ccccc2 2230a_100015324214_100011216058 [0,2,0,0,0,0|1,0,0]=3 23609 B18R2.3922 Cc1cccc(c1F)CNCc2ccccc2 270004a_100012002060_100015611070 [0,2,0,0,0,0|1,0,0]=3 23610 B18R2.3922 Cc1cccc(c1F)CNCc2ccccc2 270004a_100015324214_100011219516 [0,2,0,0,0,0|1,0,0]=3 23611 B18R2.3922 Cc1cccc(c1F)CNCc2ccccc2 34a_100012002060_100015291786 [0,2,0,0,0,0|1,0,0]=3 23612 B18R2.3922 Cc1cccc(c1F)CNCc2ccccc2 34a_100015324214_100011216058 [0,2,0,0,0,0|1,0,0]=3 23613 B18R2.3922 Cc1cccc(c1F)CNCc2ccccn2 207a_100012002060_100000209966 [0,2,0,0,0,0|2,0,0]=4 23614 B18R2.3922 Cc1cccc(c1F)CNCc2ccccn2 2230a_100012002060_100000721315 [0,2,0,0,0,0|2,0,0]=4 23615 B18R2.3922 Cc1cccc(c1F)CNCc2ccccn2 270004a_100000210449_100011219516 [0,2,0,0,0,0|2,0,0]=4 23616 B18R2.3922 Cc1cccc(c1F)CNCc2ccccn2 270004a_100012002060_100000209966 [0,2,0,0,0,0|2,0,0]=4 23617 B18R2.3922 Cc1cccc(c1F)CNCc2ccccn2 34a_100012002060_100000721315 [0,2,0,0,0,0|2,0,0]=4 23618 B18R2.3922 Cc1cccc(c1F)CNCc2cccnc2 207a_100000210453_100011219516 [0,2,0,0,0,0|2,0,0]=4 23619 B18R2.3922 Cc1cccc(c1F)CNCc2cccnc2 207a_100012002060_100000209961 [0,2,0,0,0,0|2,0,0]=4 23620 B18R2.3922 Cc1cccc(c1F)CNCc2cccnc2 2230a_100012002060_100000741622 [0,2,0,0,0,0|2,0,0]=4 23621 B18R2.3922 Cc1cccc(c1F)CNCc2cccnc2 270004a_100000210453_100011219516 [0,2,0,0,0,0|2,0,0]=4 23622 B18R2.3922 Cc1cccc(c1F)CNCc2cccnc2 270004a_100012002060_100000209961 [0,2,0,0,0,0|2,0,0]=4 23623 B18R2.3922 Cc1cccc(c1F)CNCc2cccnc2 34a_100012002060_100000733263 [0,2,0,0,0,0|2,0,0]=4 23624 B18R2.3922 Cc1cccc(c1F)CNCc2ccncc2 207a_100012002060_100000186114 [0,2,0,0,0,0|2,0,0]=4 23625 B18R2.3922 Cc1cccc(c1F)CNCc2ccncc2 2230a_100012002060_100015193705 [0,2,0,0,0,0|2,0,0]=4 23626 B18R2.3922 Cc1cccc(c1F)COCc2ccccc2 34a_100000210790_100011216058 [0,2,0,0,0,0|0,0,0]=2 23627 B18R2.3922 Cc1cccc(c1F)COCc2ccccc2 34a_200011219517_100015291786 [0,2,0,0,0,0|0,0,0]=2 23628 B18R2.3922 Cc1cccc(c1F)COCc2ccccc2 7a_100000210790_100011216058 [0,2,0,0,0,0|0,0,0]=2 23629 B18R2.3922 Cc1cccc(c1F)COCc2ccccc2 7a_200011219517_100000211182 [0,2,0,0,0,0|0,0,0]=2 23630 B18R2.3922 Cc1cccc(c1F)COCc2ccccn2 34a_200011219517_100000721315 [0,2,0,0,0,0|1,0,0]=3 23631 B18R2.3922 Cc1cccc(c1F)COCc2ccccn2 7a_200011219517_100000721315 [0,2,0,0,0,0|1,0,0]=3 23632 B18R2.3922 Cc1cccc(c1F)COCc2cccnc2 34a_200011219517_100000733263 [0,2,0,0,0,0|1,0,0]=3 23633 B18R2.3922 Cc1cccc(c1F)COCc2cccnc2 7a_200011219517_100000741622 [0,2,0,0,0,0|1,0,0]=3 23634 B18R2.3922 Cc1cccc(c1F)COCc2cccnn2 34a_200011219517_100016990269 [0,2,0,0,0,0|2,0,0]=4 23635 B18R2.3922 Cc1cccc(c1F)COCc2cccnn2 7a_200011219517_100016990269 [0,2,0,0,0,0|2,0,0]=4 23636 B18R2.3922 Cc1cccc(c1F)COCc2ccncc2 7a_200011219517_100015193705 [0,2,0,0,0,0|1,0,0]=3 23637 B18R2.3922 Cc1cccc(c1F)COCc2cnccn2 34a_200011219517_100016995436 [0,2,0,0,0,0|2,0,0]=4 23638 B18R2.3922 Cc1cccc(c1F)COCc2cnccn2 7a_200011219517_100016995436 [0,2,0,0,0,0|2,0,0]=4 23639 B18R2.3922 Cc1cccc(c1F)COCc2cncnc2 34a_200011219517_100015196519 [0,2,0,0,0,0|2,0,0]=4 23640 B18R2.3922 Cc1cccc(c1F)COCc2cncnc2 7a_200011219517_100015196519 [0,2,0,0,0,0|2,0,0]=4 23641 B18R2.3922 Cc1cccc(c1F)COCc2ncccn2 34a_200011219517_100000703007 [0,2,0,0,0,0|2,0,0]=4 23642 B18R2.3922 Cc1cccc(c1F)COCc2ncccn2 7a_200011219517_100000703007 [0,2,0,0,0,0|2,0,0]=4 23643 B18R2.3922 Cc1cccc(c1F)CSCc2ccccc2 62a_100000211182_100011216058 [0,2,0,0,0,0|0,1,0]=3 23644 B18R2.3922 Cc1cccc(c1F)CSCc2ccccc2 62a_100011216058_100015291786 [0,2,0,0,0,0|0,1,0]=3 23645 B18R2.3922 Cc1cccc(c1F)CSCc2ccccn2 62a_100000721315_100011216058 [0,2,0,0,0,0|1,1,0]=4 23646 B18R2.3922 Cc1cccc(c1F)CSCc2ccccn2 62a_100011216058_100000721315 [0,2,0,0,0,0|1,1,0]=4 23647 B18R2.3922 Cc1cccc(c1F)CSCc2cccnc2 62a_100000741622_100011216058 [0,2,0,0,0,0|1,1,0]=4 23648 B18R2.3922 Cc1cccc(c1F)CSCc2cccnc2 62a_100011216058_100000741622 [0,2,0,0,0,0|1,1,0]=4 23649 B18R2.3922 Cc1cccc(c1F)CSCc2ccncc2 62a_100011216058_100015193705 [0,2,0,0,0,0|1,1,0]=4 23650 B18R2.3922 Cc1cccc(c1F)CSCc2ccncc2 62a_100015193705_100011216058 [0,2,0,0,0,0|1,1,0]=4 23651 B18R2.3922 Cc1cccc(c1F)NCCc2ccccc2 2230a_100000697159_100000765856 [0,2,0,0,0,0|2,0,0]=4 23652 B18R2.3922 Cc1cccc(c1F)NCCc2ccccc2 34a_100000697159_100000765856 [0,2,0,0,0,0|2,0,0]=4 23653 B18R2.3922 Cc1cccc(c1F)NCCc2ccccc2 7a_100000697159_100000765856 [0,2,0,0,0,0|2,0,0]=4 23654 B18R2.3922 Cc1cccc(c1F)OCCc2ccccc2 34a_100000751311_100000765856 [0,2,0,0,0,0|2,0,0]=4 23655 B18R2.3922 Cc1cccc(c1F)OCCc2ccccc2 7a_100000751311_100000765856 [0,2,0,0,0,0|2,0,0]=4 23656 B18R2.3922 Cc1cccc(c1F)SCCc2ccccc2 62a_100000717567_100011218657 [0,2,0,0,0,0|2,0,0]=4 23657 B18R2.3922 Cc1cccc(c1F)SCCc2ccccc2 62a_100000765856_100000717567 [0,2,0,0,0,0|2,0,0]=4 23658 B18R2.3922 Cc1cccc(c1I)COCc2ccccc2 34a_100012349780_100015291786 [0,2,0,0,0,0|0,0,0]=2 23659 B18R2.3922 Cc1cccc(c1I)COCc2ccccc2 7a_100012349780_100000211182 [0,2,0,0,0,0|0,0,0]=2 23660 B18R2.3922 Cc1cccc(c1I)COCc2ccccn2 34a_100012349780_100000721315 [0,2,0,0,0,0|1,0,0]=3 23661 B18R2.3922 Cc1cccc(c1I)COCc2ccccn2 7a_100012349780_100000721315 [0,2,0,0,0,0|1,0,0]=3 23662 B18R2.3922 Cc1cccc(c1I)COCc2cccnc2 34a_100012349780_100000733263 [0,2,0,0,0,0|1,0,0]=3 23663 B18R2.3922 Cc1cccc(c1I)COCc2cccnc2 7a_100012349780_100000741622 [0,2,0,0,0,0|1,0,0]=3 23664 B18R2.3922 Cc1cccc(c1I)COCc2cccnn2 34a_100012349780_100016990269 [0,2,0,0,0,0|2,0,0]=4 23665 B18R2.3922 Cc1cccc(c1I)COCc2cccnn2 7a_100012349780_100016990269 [0,2,0,0,0,0|2,0,0]=4 23666 B18R2.3922 Cc1cccc(c1I)COCc2ccncc2 7a_100012349780_100015193705 [0,2,0,0,0,0|1,0,0]=3 23667 B18R2.3922 Cc1cccc(c1I)COCc2cnccn2 34a_100012349780_100016995436 [0,2,0,0,0,0|2,0,0]=4 23668 B18R2.3922 Cc1cccc(c1I)COCc2cnccn2 7a_100012349780_100016995436 [0,2,0,0,0,0|2,0,0]=4 23669 B18R2.3922 Cc1cccc(c1I)COCc2cncnc2 34a_100012349780_100015196519 [0,2,0,0,0,0|2,0,0]=4 23670 B18R2.3922 Cc1cccc(c1I)COCc2cncnc2 7a_100012349780_100015196519 [0,2,0,0,0,0|2,0,0]=4 23671 B18R2.3922 Cc1cccc(c1I)COCc2ncccn2 34a_100012349780_100000703007 [0,2,0,0,0,0|2,0,0]=4 23672 B18R2.3922 Cc1cccc(c1I)COCc2ncccn2 7a_100012349780_100000703007 [0,2,0,0,0,0|2,0,0]=4 23673 B18R2.3922 Cc1cccc(c1I)NCCc2ccccc2 34a_100000761888_100000765856 [0,2,0,0,0,0|2,0,0]=4 23674 B18R2.3922 Cc1cccc(c1I)OCCc2ccccc2 34a_100010083724_100000765856 [0,2,0,0,0,0|2,0,0]=4 23675 B18R2.3922 Cc1cccc(c1I)OCCc2ccccc2 7a_100010083724_100000765856 [0,2,0,0,0,0|2,0,0]=4 23676 B18R2.3922 Cc1cccc(c1N)C=CCc2ccccc2 271570a_200016263579_100011834072 [0,2,0,0,0,0|1,0,1]=4 23677 B18R2.3922 Cc1cccc(c1N)COCc2ccccc2 34a_100011215590_100015291786 [0,2,0,0,0,0|0,0,0]=2 23678 B18R2.3922 Cc1cccc(c1N)COCc2ccccn2 34a_100011215590_100000721315 [0,2,0,0,0,0|1,0,0]=3 23679 B18R2.3922 Cc1cccc(c1N)COCc2cccnc2 34a_100011215590_100000733263 [0,2,0,0,0,0|1,0,0]=3 23680 B18R2.3922 Cc1cccc(c1N)COCc2cccnn2 34a_100011215590_100016990269 [0,2,0,0,0,0|2,0,0]=4 23681 B18R2.3922 Cc1cccc(c1N)COCc2cnccn2 34a_100011215590_100016995436 [0,2,0,0,0,0|2,0,0]=4 23682 B18R2.3922 Cc1cccc(c1N)COCc2cncnc2 34a_100011215590_100015196519 [0,2,0,0,0,0|2,0,0]=4 23683 B18R2.3922 Cc1cccc(c1N)COCc2ncccn2 34a_100011215590_100000703007 [0,2,0,0,0,0|2,0,0]=4 23684 B18R2.3922 Cc1cccc(c1N)OCCc2ccccc2 34a_100000743429_100000765856 [0,2,0,0,0,0|2,0,0]=4 23685 B18R2.3922 Cc1cccc(c1N)OCCc2ccccc2 7a_100000743429_100000765856 [0,2,0,0,0,0|2,0,0]=4 23686 B18R2.3922 Cc1cccc(c1N)SCCc2ccccc2 62a_100000765856_100011834072 [0,2,0,0,0,0|2,0,0]=4 23687 B18R2.3922 Cc1cccc(c1N)SCCc2ccccc2 62a_100011834072_100011218657 [0,2,0,0,0,0|2,0,0]=4 23688 B18R2.3922 Cc1cccc(c1O)C=CCc2ccccc2 271570a_200016263579_100009817157 [0,2,0,0,0,0|1,0,1]=4 23689 B18R2.3922 Cc1cccc(c1O)CNCc2ccccc2 34a_100020639391_100015291786 [0,2,0,0,0,0|1,0,0]=3 23690 B18R2.3922 Cc1cccc(c1O)CNCc2ccccn2 34a_100020639391_100000721315 [0,2,0,0,0,0|2,0,0]=4 23691 B18R2.3922 Cc1cccc(c1O)CNCc2cccnc2 34a_100020639391_100000733263 [0,2,0,0,0,0|2,0,0]=4 23692 B18R2.3922 Cc1cccc(c1O)NCCc2ccccc2 34a_100000756359_100000765856 [0,2,0,0,0,0|2,0,0]=4 23693 B18R2.3922 Cc1cccc(c1O)SCCc2ccccc2 62a_100000765856_100009817157 [0,2,0,0,0,0|2,0,0]=4 23694 B18R2.3922 Cc1cccc(c1O)SCCc2ccccc2 62a_100009817157_100011218657 [0,2,0,0,0,0|2,0,0]=4 23695 B18R2.3922 Clc1c(cccc1C=CCc2ccccc2)Br 271570a_200016263579_100010142854 [0,2,0,0,0,0|1,0,1]=4 23696 B18R2.3922 Clc1c(cccc1CNCc2ccccc2)Br 207a_100015324214_100012362481 [0,2,0,0,0,0|1,0,0]=3 23697 B18R2.3922 Clc1c(cccc1CNCc2ccccc2)Br 2230a_100015324214_100012349491 [0,2,0,0,0,0|1,0,0]=3 23698 B18R2.3922 Clc1c(cccc1CNCc2ccccc2)Br 270004a_100015324214_100012362481 [0,2,0,0,0,0|1,0,0]=3 23699 B18R2.3922 Clc1c(cccc1CNCc2ccccc2)Br 34a_100015324214_100012349491 [0,2,0,0,0,0|1,0,0]=3 23700 B18R2.3922 Clc1c(cccc1CNCc2ccccn2)Br 270004a_100000210449_100012362481 [0,2,0,0,0,0|2,0,0]=4 23701 B18R2.3922 Clc1c(cccc1CNCc2cccnc2)Br 207a_100000210453_100012362481 [0,2,0,0,0,0|2,0,0]=4 23702 B18R2.3922 Clc1c(cccc1CNCc2cccnc2)Br 270004a_100000210453_100012362481 [0,2,0,0,0,0|2,0,0]=4 23703 B18R2.3922 Clc1c(cccc1COCc2ccccc2)Br 34a_100000210790_100012349491 [0,2,0,0,0,0|0,0,0]=2 23704 B18R2.3922 Clc1c(cccc1COCc2ccccc2)Br 34a_100012351182_100015291786 [0,2,0,0,0,0|0,0,0]=2 23705 B18R2.3922 Clc1c(cccc1COCc2ccccc2)Br 7a_100000210790_100012349491 [0,2,0,0,0,0|0,0,0]=2 23706 B18R2.3922 Clc1c(cccc1COCc2ccccc2)Br 7a_100012351182_100000211182 [0,2,0,0,0,0|0,0,0]=2 23707 B18R2.3922 Clc1c(cccc1COCc2ccccn2)Br 34a_100012351182_100000721315 [0,2,0,0,0,0|1,0,0]=3 23708 B18R2.3922 Clc1c(cccc1COCc2ccccn2)Br 7a_100012351182_100000721315 [0,2,0,0,0,0|1,0,0]=3 23709 B18R2.3922 Clc1c(cccc1COCc2cccnc2)Br 34a_100012351182_100000733263 [0,2,0,0,0,0|1,0,0]=3 23710 B18R2.3922 Clc1c(cccc1COCc2cccnc2)Br 7a_100012351182_100000741622 [0,2,0,0,0,0|1,0,0]=3 23711 B18R2.3922 Clc1c(cccc1COCc2cccnn2)Br 34a_100012351182_100016990269 [0,2,0,0,0,0|2,0,0]=4 23712 B18R2.3922 Clc1c(cccc1COCc2cccnn2)Br 7a_100012351182_100016990269 [0,2,0,0,0,0|2,0,0]=4 23713 B18R2.3922 Clc1c(cccc1COCc2ccncc2)Br 7a_100012351182_100015193705 [0,2,0,0,0,0|1,0,0]=3 23714 B18R2.3922 Clc1c(cccc1COCc2cnccn2)Br 34a_100012351182_100016995436 [0,2,0,0,0,0|2,0,0]=4 23715 B18R2.3922 Clc1c(cccc1COCc2cnccn2)Br 7a_100012351182_100016995436 [0,2,0,0,0,0|2,0,0]=4 23716 B18R2.3922 Clc1c(cccc1COCc2cncnc2)Br 34a_100012351182_100015196519 [0,2,0,0,0,0|2,0,0]=4 23717 B18R2.3922 Clc1c(cccc1COCc2cncnc2)Br 7a_100012351182_100015196519 [0,2,0,0,0,0|2,0,0]=4 23718 B18R2.3922 Clc1c(cccc1COCc2ncccn2)Br 34a_100012351182_100000703007 [0,2,0,0,0,0|2,0,0]=4 23719 B18R2.3922 Clc1c(cccc1COCc2ncccn2)Br 7a_100012351182_100000703007 [0,2,0,0,0,0|2,0,0]=4 23720 B18R2.3922 Clc1c(cccc1CSCc2ccccc2)Br 62a_100000211182_100012349491 [0,2,0,0,0,0|0,1,0]=3 23721 B18R2.3922 Clc1c(cccc1CSCc2ccccc2)Br 62a_100012349491_100015291786 [0,2,0,0,0,0|0,1,0]=3 23722 B18R2.3922 Clc1c(cccc1CSCc2ccccn2)Br 62a_100000721315_100012349491 [0,2,0,0,0,0|1,1,0]=4 23723 B18R2.3922 Clc1c(cccc1CSCc2ccccn2)Br 62a_100012349491_100000721315 [0,2,0,0,0,0|1,1,0]=4 23724 B18R2.3922 Clc1c(cccc1CSCc2cccnc2)Br 62a_100000741622_100012349491 [0,2,0,0,0,0|1,1,0]=4 23725 B18R2.3922 Clc1c(cccc1CSCc2cccnc2)Br 62a_100012349491_100000741622 [0,2,0,0,0,0|1,1,0]=4 23726 B18R2.3922 Clc1c(cccc1CSCc2ccncc2)Br 62a_100012349491_100015193705 [0,2,0,0,0,0|1,1,0]=4 23727 B18R2.3922 Clc1c(cccc1CSCc2ccncc2)Br 62a_100015193705_100012349491 [0,2,0,0,0,0|1,1,0]=4 23728 B18R2.3922 Clc1c(cccc1NCCc2ccccc2)Br 34a_100000687075_100000765856 [0,2,0,0,0,0|2,0,0]=4 23729 B18R2.3922 Clc1c(cccc1OCCc2ccccc2)Br 34a_100010187913_100000765856 [0,2,0,0,0,0|2,0,0]=4 23730 B18R2.3922 Clc1c(cccc1OCCc2ccccc2)Br 7a_100010187913_100000765856 [0,2,0,0,0,0|2,0,0]=4 23731 B18R2.3922 Clc1c(cccc1OCCc2ccccc2)I 34a_100000049636_100000765856 [0,2,0,0,0,0|2,0,0]=4 23732 B18R2.3922 Clc1c(cccc1OCCc2ccccc2)I 7a_100000049636_100000765856 [0,2,0,0,0,0|2,0,0]=4 23733 B18R2.3922 Clc1c(cccc1SCCc2ccccc2)Br 62a_100000765856_100010142854 [0,2,0,0,0,0|2,0,0]=4 23734 B18R2.3922 Clc1c(cccc1SCCc2ccccc2)Br 62a_100010142854_100011218657 [0,2,0,0,0,0|2,0,0]=4 23735 B18R2.3922 Clc1c(ccnc1Br)CNCc2ccccc2 270004a_100015324214_100010171661 [0,2,0,0,0,0|2,0,0]=4 23736 B18R2.3922 Clc1c(cncc1CNCc2ccccc2)Br 207a_100015324214_100010173560 [0,2,0,0,0,0|2,0,0]=4 23737 B18R2.3922 Clc1cccc(c1Br)CNCc2ccccc2 207a_100015324214_100010232083 [0,2,0,0,0,0|1,0,0]=3 23738 B18R2.3922 Clc1cccc(c1Br)CNCc2ccccc2 2230a_100015324214_100010145525 [0,2,0,0,0,0|1,0,0]=3 23739 B18R2.3922 Clc1cccc(c1Br)CNCc2ccccc2 270004a_100015324214_100010232083 [0,2,0,0,0,0|1,0,0]=3 23740 B18R2.3922 Clc1cccc(c1Br)CNCc2ccccc2 34a_100015324214_100010145525 [0,2,0,0,0,0|1,0,0]=3 23741 B18R2.3922 Clc1cccc(c1Br)CNCc2ccccn2 270004a_100000210449_100010232083 [0,2,0,0,0,0|2,0,0]=4 23742 B18R2.3922 Clc1cccc(c1Br)CNCc2cccnc2 207a_100000210453_100010232083 [0,2,0,0,0,0|2,0,0]=4 23743 B18R2.3922 Clc1cccc(c1Br)CNCc2cccnc2 270004a_100000210453_100010232083 [0,2,0,0,0,0|2,0,0]=4 23744 B18R2.3922 Clc1cccc(c1Br)COCc2ccccc2 34a_100000210790_100010145525 [0,2,0,0,0,0|0,0,0]=2 23745 B18R2.3922 Clc1cccc(c1Br)COCc2ccccc2 34a_100010168166_100015291786 [0,2,0,0,0,0|0,0,0]=2 23746 B18R2.3922 Clc1cccc(c1Br)COCc2ccccc2 7a_100000210790_100010145525 [0,2,0,0,0,0|0,0,0]=2 23747 B18R2.3922 Clc1cccc(c1Br)COCc2ccccc2 7a_100010168166_100000211182 [0,2,0,0,0,0|0,0,0]=2 23748 B18R2.3922 Clc1cccc(c1Br)COCc2ccccn2 34a_100010168166_100000721315 [0,2,0,0,0,0|1,0,0]=3 23749 B18R2.3922 Clc1cccc(c1Br)COCc2ccccn2 7a_100010168166_100000721315 [0,2,0,0,0,0|1,0,0]=3 23750 B18R2.3922 Clc1cccc(c1Br)COCc2cccnc2 34a_100010168166_100000733263 [0,2,0,0,0,0|1,0,0]=3 23751 B18R2.3922 Clc1cccc(c1Br)COCc2cccnc2 7a_100010168166_100000741622 [0,2,0,0,0,0|1,0,0]=3 23752 B18R2.3922 Clc1cccc(c1Br)COCc2cccnn2 34a_100010168166_100016990269 [0,2,0,0,0,0|2,0,0]=4 23753 B18R2.3922 Clc1cccc(c1Br)COCc2cccnn2 7a_100010168166_100016990269 [0,2,0,0,0,0|2,0,0]=4 23754 B18R2.3922 Clc1cccc(c1Br)COCc2ccncc2 7a_100010168166_100015193705 [0,2,0,0,0,0|1,0,0]=3 23755 B18R2.3922 Clc1cccc(c1Br)COCc2cnccn2 34a_100010168166_100016995436 [0,2,0,0,0,0|2,0,0]=4 23756 B18R2.3922 Clc1cccc(c1Br)COCc2cnccn2 7a_100010168166_100016995436 [0,2,0,0,0,0|2,0,0]=4 23757 B18R2.3922 Clc1cccc(c1Br)COCc2cncnc2 34a_100010168166_100015196519 [0,2,0,0,0,0|2,0,0]=4 23758 B18R2.3922 Clc1cccc(c1Br)COCc2cncnc2 7a_100010168166_100015196519 [0,2,0,0,0,0|2,0,0]=4 23759 B18R2.3922 Clc1cccc(c1Br)COCc2ncccn2 34a_100010168166_100000703007 [0,2,0,0,0,0|2,0,0]=4 23760 B18R2.3922 Clc1cccc(c1Br)COCc2ncccn2 7a_100010168166_100000703007 [0,2,0,0,0,0|2,0,0]=4 23761 B18R2.3922 Clc1cccc(c1Br)CSCc2ccccc2 62a_100000211182_100010145525 [0,2,0,0,0,0|0,1,0]=3 23762 B18R2.3922 Clc1cccc(c1Br)CSCc2ccccc2 62a_100010145525_100015291786 [0,2,0,0,0,0|0,1,0]=3 23763 B18R2.3922 Clc1cccc(c1Br)CSCc2ccccn2 62a_100000721315_100010145525 [0,2,0,0,0,0|1,1,0]=4 23764 B18R2.3922 Clc1cccc(c1Br)CSCc2ccccn2 62a_100010145525_100000721315 [0,2,0,0,0,0|1,1,0]=4 23765 B18R2.3922 Clc1cccc(c1Br)CSCc2cccnc2 62a_100000741622_100010145525 [0,2,0,0,0,0|1,1,0]=4 23766 B18R2.3922 Clc1cccc(c1Br)CSCc2cccnc2 62a_100010145525_100000741622 [0,2,0,0,0,0|1,1,0]=4 23767 B18R2.3922 Clc1cccc(c1Br)CSCc2ccncc2 62a_100010145525_100015193705 [0,2,0,0,0,0|1,1,0]=4 23768 B18R2.3922 Clc1cccc(c1Br)CSCc2ccncc2 62a_100015193705_100010145525 [0,2,0,0,0,0|1,1,0]=4 23769 B18R2.3922 Clc1cccc(c1Br)NCCc2ccccc2 34a_100000687072_100000765856 [0,2,0,0,0,0|2,0,0]=4 23770 B18R2.3922 Clc1cccc(c1Br)OCCc2ccccc2 34a_100012348804_100000765856 [0,2,0,0,0,0|2,0,0]=4 23771 B18R2.3922 Clc1cccc(c1Br)OCCc2ccccc2 7a_100012348804_100000765856 [0,2,0,0,0,0|2,0,0]=4 23772 B18R2.3922 Clc1cccc(c1Br)SCCc2ccccc2 62a_100000765856_100014021842 [0,2,0,0,0,0|2,0,0]=4 23773 B18R2.3922 Clc1cccc(c1Br)SCCc2ccccc2 62a_100014021842_100011218657 [0,2,0,0,0,0|2,0,0]=4 23774 B18R2.3922 Clc1cccc(c1Cl)C=CCc2ccccc2 271570a_200016263579_100011215384 [0,2,0,0,0,0|1,0,1]=4 23775 B18R2.3922 Clc1cccc(c1Cl)CCNc2ccccc2 34a_100000106764_100000723033 [0,2,0,0,0,0|2,0,0]=4 23776 B18R2.3922 Clc1cccc(c1Cl)CCOc2ccccc2 34a_100000210340_100000723033 [0,2,0,0,0,0|2,0,0]=4 23777 B18R2.3922 Clc1cccc(c1Cl)CCOc2ccccc2 7a_100000210340_100000723033 [0,2,0,0,0,0|2,0,0]=4 23778 B18R2.3922 Clc1cccc(c1Cl)CCSc2ccccc2 62a_100000719477_100000723033 [0,2,0,0,0,0|2,0,0]=4 23779 B18R2.3922 Clc1cccc(c1Cl)CCSc2ccccc2 62a_100000723033_100000041952 [0,2,0,0,0,0|2,0,0]=4 23780 B18R2.3922 Clc1cccc(c1Cl)CNCc2ccccc2 207a_100011211633_100015611070 [0,2,0,0,0,0|1,0,0]=3 23781 B18R2.3922 Clc1cccc(c1Cl)CNCc2ccccc2 207a_100015324214_100000210504 [0,2,0,0,0,0|1,0,0]=3 23782 B18R2.3922 Clc1cccc(c1Cl)CNCc2ccccc2 2230a_100011211633_100015291786 [0,2,0,0,0,0|1,0,0]=3 23783 B18R2.3922 Clc1cccc(c1Cl)CNCc2ccccc2 2230a_100015324214_100000723366 [0,2,0,0,0,0|1,0,0]=3 23784 B18R2.3922 Clc1cccc(c1Cl)CNCc2ccccc2 270004a_100011211633_100015611070 [0,2,0,0,0,0|1,0,0]=3 23785 B18R2.3922 Clc1cccc(c1Cl)CNCc2ccccc2 270004a_100015324214_100000210504 [0,2,0,0,0,0|1,0,0]=3 23786 B18R2.3922 Clc1cccc(c1Cl)CNCc2ccccc2 34a_100011211633_100015291786 [0,2,0,0,0,0|1,0,0]=3 23787 B18R2.3922 Clc1cccc(c1Cl)CNCc2ccccc2 34a_100015324214_100000723366 [0,2,0,0,0,0|1,0,0]=3 23788 B18R2.3922 Clc1cccc(c1Cl)CNCc2ccccn2 207a_100011211633_100000209966 [0,2,0,0,0,0|2,0,0]=4 23789 B18R2.3922 Clc1cccc(c1Cl)CNCc2ccccn2 2230a_100011211633_100000721315 [0,2,0,0,0,0|2,0,0]=4 23790 B18R2.3922 Clc1cccc(c1Cl)CNCc2ccccn2 270004a_100000210449_100000210504 [0,2,0,0,0,0|2,0,0]=4 23791 B18R2.3922 Clc1cccc(c1Cl)CNCc2ccccn2 270004a_100011211633_100000209966 [0,2,0,0,0,0|2,0,0]=4 23792 B18R2.3922 Clc1cccc(c1Cl)CNCc2ccccn2 34a_100011211633_100000721315 [0,2,0,0,0,0|2,0,0]=4 23793 B18R2.3922 Clc1cccc(c1Cl)CNCc2cccnc2 207a_100000210453_100000210504 [0,2,0,0,0,0|2,0,0]=4 23794 B18R2.3922 Clc1cccc(c1Cl)CNCc2cccnc2 207a_100011211633_100000209961 [0,2,0,0,0,0|2,0,0]=4 23795 B18R2.3922 Clc1cccc(c1Cl)CNCc2cccnc2 2230a_100011211633_100000741622 [0,2,0,0,0,0|2,0,0]=4 23796 B18R2.3922 Clc1cccc(c1Cl)CNCc2cccnc2 270004a_100000210453_100000210504 [0,2,0,0,0,0|2,0,0]=4 23797 B18R2.3922 Clc1cccc(c1Cl)CNCc2cccnc2 270004a_100011211633_100000209961 [0,2,0,0,0,0|2,0,0]=4 23798 B18R2.3922 Clc1cccc(c1Cl)CNCc2cccnc2 34a_100011211633_100000733263 [0,2,0,0,0,0|2,0,0]=4 23799 B18R2.3922 Clc1cccc(c1Cl)CNCc2ccncc2 207a_100011211633_100000186114 [0,2,0,0,0,0|2,0,0]=4 23800 B18R2.3922 Clc1cccc(c1Cl)CNCc2ccncc2 2230a_100011211633_100015193705 [0,2,0,0,0,0|2,0,0]=4 23801 B18R2.3922 Clc1cccc(c1Cl)COCc2ccccc2 34a_100000210790_100000723366 [0,2,0,0,0,0|0,0,0]=2 23802 B18R2.3922 Clc1cccc(c1Cl)COCc2ccccc2 34a_100000720469_100015291786 [0,2,0,0,0,0|0,0,0]=2 23803 B18R2.3922 Clc1cccc(c1Cl)COCc2ccccc2 7a_100000210790_100000723366 [0,2,0,0,0,0|0,0,0]=2 23804 B18R2.3922 Clc1cccc(c1Cl)COCc2ccccc2 7a_100000720469_100000211182 [0,2,0,0,0,0|0,0,0]=2 23805 B18R2.3922 Clc1cccc(c1Cl)COCc2ccccn2 34a_100000720469_100000721315 [0,2,0,0,0,0|1,0,0]=3 23806 B18R2.3922 Clc1cccc(c1Cl)COCc2ccccn2 7a_100000720469_100000721315 [0,2,0,0,0,0|1,0,0]=3 23807 B18R2.3922 Clc1cccc(c1Cl)COCc2cccnc2 34a_100000720469_100000733263 [0,2,0,0,0,0|1,0,0]=3 23808 B18R2.3922 Clc1cccc(c1Cl)COCc2cccnc2 7a_100000720469_100000741622 [0,2,0,0,0,0|1,0,0]=3 23809 B18R2.3922 Clc1cccc(c1Cl)COCc2cccnn2 34a_100000720469_100016990269 [0,2,0,0,0,0|2,0,0]=4 23810 B18R2.3922 Clc1cccc(c1Cl)COCc2cccnn2 7a_100000720469_100016990269 [0,2,0,0,0,0|2,0,0]=4 23811 B18R2.3922 Clc1cccc(c1Cl)COCc2ccncc2 7a_100000720469_100015193705 [0,2,0,0,0,0|1,0,0]=3 23812 B18R2.3922 Clc1cccc(c1Cl)COCc2cnccn2 34a_100000720469_100016995436 [0,2,0,0,0,0|2,0,0]=4 23813 B18R2.3922 Clc1cccc(c1Cl)COCc2cnccn2 7a_100000720469_100016995436 [0,2,0,0,0,0|2,0,0]=4 23814 B18R2.3922 Clc1cccc(c1Cl)COCc2cncnc2 34a_100000720469_100015196519 [0,2,0,0,0,0|2,0,0]=4 23815 B18R2.3922 Clc1cccc(c1Cl)COCc2cncnc2 7a_100000720469_100015196519 [0,2,0,0,0,0|2,0,0]=4 23816 B18R2.3922 Clc1cccc(c1Cl)COCc2ncccn2 34a_100000720469_100000703007 [0,2,0,0,0,0|2,0,0]=4 23817 B18R2.3922 Clc1cccc(c1Cl)COCc2ncccn2 7a_100000720469_100000703007 [0,2,0,0,0,0|2,0,0]=4 23818 B18R2.3922 Clc1cccc(c1Cl)CSCc2ccccc2 62a_100000211182_100000723366 [0,2,0,0,0,0|0,1,0]=3 23819 B18R2.3922 Clc1cccc(c1Cl)CSCc2ccccc2 62a_100000720918_100015291786 [0,2,0,0,0,0|0,1,0]=3 23820 B18R2.3922 Clc1cccc(c1Cl)CSCc2ccccn2 62a_100000720918_100000721315 [0,2,0,0,0,0|1,1,0]=4 23821 B18R2.3922 Clc1cccc(c1Cl)CSCc2ccccn2 62a_100000721315_100000723366 [0,2,0,0,0,0|1,1,0]=4 23822 B18R2.3922 Clc1cccc(c1Cl)CSCc2cccnc2 62a_100000720918_100000741622 [0,2,0,0,0,0|1,1,0]=4 23823 B18R2.3922 Clc1cccc(c1Cl)CSCc2cccnc2 62a_100000741622_100000723366 [0,2,0,0,0,0|1,1,0]=4 23824 B18R2.3922 Clc1cccc(c1Cl)CSCc2ccncc2 62a_100000720918_100015193705 [0,2,0,0,0,0|1,1,0]=4 23825 B18R2.3922 Clc1cccc(c1Cl)CSCc2ccncc2 62a_100015193705_100000723366 [0,2,0,0,0,0|1,1,0]=4 23826 B18R2.3922 Clc1cccc(c1Cl)NCCc2ccccc2 34a_100000185733_100000765856 [0,2,0,0,0,0|2,0,0]=4 23827 B18R2.3922 Clc1cccc(c1Cl)OCCc2ccccc2 34a_100000211076_100000765856 [0,2,0,0,0,0|2,0,0]=4 23828 B18R2.3922 Clc1cccc(c1Cl)OCCc2ccccc2 7a_100000211076_100000765856 [0,2,0,0,0,0|2,0,0]=4 23829 B18R2.3922 Clc1cccc(c1Cl)SCCc2ccccc2 62a_100000765856_100011215384 [0,2,0,0,0,0|2,0,0]=4 23830 B18R2.3922 Clc1cccc(c1Cl)SCCc2ccccc2 62a_100011215384_100011218657 [0,2,0,0,0,0|2,0,0]=4 23831 B18R2.3922 Clc1cccc(c1I)NCCc2ccccc2 34a_100000049713_100000765856 [0,2,0,0,0,0|2,0,0]=4 23832 B18R2.3922 Clc1cccc(c1I)OCCc2ccccc2 34a_100000050174_100000765856 [0,2,0,0,0,0|2,0,0]=4 23833 B18R2.3922 Clc1cccc(c1I)OCCc2ccccc2 7a_100000050174_100000765856 [0,2,0,0,0,0|2,0,0]=4 23834 B18R2.3922 Clc1nccc(c1Br)CNCc2ccccc2 207a_100015324214_200010064870 [0,2,0,0,0,0|2,0,0]=4 23835 B18R2.3922 Cn1cccc(c1=O)CNCc2ccccc2 207a_100015324214_100010354164 [0,2,0,0,0,0|2,0,0]=4 23836 B18R2.3922 Cn1cccc(c1=O)CNCc2ccccc2 270004a_100015324214_100010354164 [0,2,0,0,0,0|2,0,0]=4 23837 B18R2.3922 Fc1c(cccc1C=CCc2ccccc2)Br 271570a_200016263579_100000702267 [0,2,0,0,0,0|1,0,1]=4 23838 B18R2.3922 Fc1c(cccc1C=CCc2ccccc2)Cl 271570a_200016263579_100011217346 [0,2,0,0,0,0|1,0,1]=4 23839 B18R2.3922 Fc1c(cccc1CNCc2ccccc2)Br 207a_100015189953_100015611070 [0,2,0,0,0,0|1,0,0]=3 23840 B18R2.3922 Fc1c(cccc1CNCc2ccccc2)Br 207a_100015324214_100011361543 [0,2,0,0,0,0|1,0,0]=3 23841 B18R2.3922 Fc1c(cccc1CNCc2ccccc2)Br 2230a_100015189953_100015291786 [0,2,0,0,0,0|1,0,0]=3 23842 B18R2.3922 Fc1c(cccc1CNCc2ccccc2)Br 2230a_100015324214_100012356506 [0,2,0,0,0,0|1,0,0]=3 23843 B18R2.3922 Fc1c(cccc1CNCc2ccccc2)Br 270004a_100015189953_100015611070 [0,2,0,0,0,0|1,0,0]=3 23844 B18R2.3922 Fc1c(cccc1CNCc2ccccc2)Br 270004a_100015324214_100011361543 [0,2,0,0,0,0|1,0,0]=3 23845 B18R2.3922 Fc1c(cccc1CNCc2ccccc2)Br 34a_100015189953_100015291786 [0,2,0,0,0,0|1,0,0]=3 23846 B18R2.3922 Fc1c(cccc1CNCc2ccccc2)Br 34a_100015324214_100012356506 [0,2,0,0,0,0|1,0,0]=3 23847 B18R2.3922 Fc1c(cccc1CNCc2ccccc2)Cl 207a_100000764326_100015611070 [0,2,0,0,0,0|1,0,0]=3 23848 B18R2.3922 Fc1c(cccc1CNCc2ccccc2)Cl 207a_100015324214_100000766533 [0,2,0,0,0,0|1,0,0]=3 23849 B18R2.3922 Fc1c(cccc1CNCc2ccccc2)Cl 2230a_100000764326_100015291786 [0,2,0,0,0,0|1,0,0]=3 23850 B18R2.3922 Fc1c(cccc1CNCc2ccccc2)Cl 2230a_100015324214_100000716733 [0,2,0,0,0,0|1,0,0]=3 23851 B18R2.3922 Fc1c(cccc1CNCc2ccccc2)Cl 270004a_100000764326_100015611070 [0,2,0,0,0,0|1,0,0]=3 23852 B18R2.3922 Fc1c(cccc1CNCc2ccccc2)Cl 270004a_100015324214_100000766533 [0,2,0,0,0,0|1,0,0]=3 23853 B18R2.3922 Fc1c(cccc1CNCc2ccccc2)Cl 34a_100000764326_100015291786 [0,2,0,0,0,0|1,0,0]=3 23854 B18R2.3922 Fc1c(cccc1CNCc2ccccc2)Cl 34a_100015324214_100000716733 [0,2,0,0,0,0|1,0,0]=3 23855 B18R2.3922 Fc1c(cccc1CNCc2ccccc2)I 207a_100015324214_100010202174 [0,2,0,0,0,0|1,0,0]=3 23856 B18R2.3922 Fc1c(cccc1CNCc2ccccc2)I 270004a_100015324214_100010202174 [0,2,0,0,0,0|1,0,0]=3 23857 B18R2.3922 Fc1c(cccc1CNCc2ccccn2)Br 207a_100015189953_100000209966 [0,2,0,0,0,0|2,0,0]=4 23858 B18R2.3922 Fc1c(cccc1CNCc2ccccn2)Br 2230a_100015189953_100000721315 [0,2,0,0,0,0|2,0,0]=4 23859 B18R2.3922 Fc1c(cccc1CNCc2ccccn2)Br 270004a_100000210449_100011361543 [0,2,0,0,0,0|2,0,0]=4 23860 B18R2.3922 Fc1c(cccc1CNCc2ccccn2)Br 270004a_100015189953_100000209966 [0,2,0,0,0,0|2,0,0]=4 23861 B18R2.3922 Fc1c(cccc1CNCc2ccccn2)Br 34a_100015189953_100000721315 [0,2,0,0,0,0|2,0,0]=4 23862 B18R2.3922 Fc1c(cccc1CNCc2ccccn2)Cl 207a_100000764326_100000209966 [0,2,0,0,0,0|2,0,0]=4 23863 B18R2.3922 Fc1c(cccc1CNCc2ccccn2)Cl 2230a_100000764326_100000721315 [0,2,0,0,0,0|2,0,0]=4 23864 B18R2.3922 Fc1c(cccc1CNCc2ccccn2)Cl 270004a_100000210449_100000766533 [0,2,0,0,0,0|2,0,0]=4 23865 B18R2.3922 Fc1c(cccc1CNCc2ccccn2)Cl 270004a_100000764326_100000209966 [0,2,0,0,0,0|2,0,0]=4 23866 B18R2.3922 Fc1c(cccc1CNCc2ccccn2)Cl 34a_100000764326_100000721315 [0,2,0,0,0,0|2,0,0]=4 23867 B18R2.3922 Fc1c(cccc1CNCc2ccccn2)I 270004a_100000210449_100010202174 [0,2,0,0,0,0|2,0,0]=4 23868 B18R2.3922 Fc1c(cccc1CNCc2cccnc2)Br 207a_100000210453_100011361543 [0,2,0,0,0,0|2,0,0]=4 23869 B18R2.3922 Fc1c(cccc1CNCc2cccnc2)Br 207a_100015189953_100000209961 [0,2,0,0,0,0|2,0,0]=4 23870 B18R2.3922 Fc1c(cccc1CNCc2cccnc2)Br 2230a_100015189953_100000741622 [0,2,0,0,0,0|2,0,0]=4 23871 B18R2.3922 Fc1c(cccc1CNCc2cccnc2)Br 270004a_100000210453_100011361543 [0,2,0,0,0,0|2,0,0]=4 23872 B18R2.3922 Fc1c(cccc1CNCc2cccnc2)Br 270004a_100015189953_100000209961 [0,2,0,0,0,0|2,0,0]=4 23873 B18R2.3922 Fc1c(cccc1CNCc2cccnc2)Br 34a_100015189953_100000733263 [0,2,0,0,0,0|2,0,0]=4 23874 B18R2.3922 Fc1c(cccc1CNCc2cccnc2)Cl 207a_100000210453_100000766533 [0,2,0,0,0,0|2,0,0]=4 23875 B18R2.3922 Fc1c(cccc1CNCc2cccnc2)Cl 207a_100000764326_100000209961 [0,2,0,0,0,0|2,0,0]=4 23876 B18R2.3922 Fc1c(cccc1CNCc2cccnc2)Cl 2230a_100000764326_100000741622 [0,2,0,0,0,0|2,0,0]=4 23877 B18R2.3922 Fc1c(cccc1CNCc2cccnc2)Cl 270004a_100000210453_100000766533 [0,2,0,0,0,0|2,0,0]=4 23878 B18R2.3922 Fc1c(cccc1CNCc2cccnc2)Cl 270004a_100000764326_100000209961 [0,2,0,0,0,0|2,0,0]=4 23879 B18R2.3922 Fc1c(cccc1CNCc2cccnc2)Cl 34a_100000764326_100000733263 [0,2,0,0,0,0|2,0,0]=4 23880 B18R2.3922 Fc1c(cccc1CNCc2cccnc2)I 207a_100000210453_100010202174 [0,2,0,0,0,0|2,0,0]=4 23881 B18R2.3922 Fc1c(cccc1CNCc2cccnc2)I 270004a_100000210453_100010202174 [0,2,0,0,0,0|2,0,0]=4 23882 B18R2.3922 Fc1c(cccc1CNCc2ccncc2)Br 207a_100015189953_100000186114 [0,2,0,0,0,0|2,0,0]=4 23883 B18R2.3922 Fc1c(cccc1CNCc2ccncc2)Br 2230a_100015189953_100015193705 [0,2,0,0,0,0|2,0,0]=4 23884 B18R2.3922 Fc1c(cccc1CNCc2ccncc2)Cl 207a_100000764326_100000186114 [0,2,0,0,0,0|2,0,0]=4 23885 B18R2.3922 Fc1c(cccc1CNCc2ccncc2)Cl 2230a_100000764326_100015193705 [0,2,0,0,0,0|2,0,0]=4 23886 B18R2.3922 Fc1c(cccc1COCc2ccccc2)Br 34a_100000210790_100012356506 [0,2,0,0,0,0|0,0,0]=2 23887 B18R2.3922 Fc1c(cccc1COCc2ccccc2)Br 34a_100011935076_100015291786 [0,2,0,0,0,0|0,0,0]=2 23888 B18R2.3922 Fc1c(cccc1COCc2ccccc2)Br 7a_100000210790_100012356506 [0,2,0,0,0,0|0,0,0]=2 23889 B18R2.3922 Fc1c(cccc1COCc2ccccc2)Br 7a_100011935076_100000211182 [0,2,0,0,0,0|0,0,0]=2 23890 B18R2.3922 Fc1c(cccc1COCc2ccccc2)Cl 34a_100000210790_100000716733 [0,2,0,0,0,0|0,0,0]=2 23891 B18R2.3922 Fc1c(cccc1COCc2ccccc2)Cl 34a_100011216988_100015291786 [0,2,0,0,0,0|0,0,0]=2 23892 B18R2.3922 Fc1c(cccc1COCc2ccccc2)Cl 7a_100000210790_100000716733 [0,2,0,0,0,0|0,0,0]=2 23893 B18R2.3922 Fc1c(cccc1COCc2ccccc2)Cl 7a_100011216988_100000211182 [0,2,0,0,0,0|0,0,0]=2 23894 B18R2.3922 Fc1c(cccc1COCc2ccccc2)I 34a_200010235739_100015291786 [0,2,0,0,0,0|0,0,0]=2 23895 B18R2.3922 Fc1c(cccc1COCc2ccccc2)I 7a_200010235739_100000211182 [0,2,0,0,0,0|0,0,0]=2 23896 B18R2.3922 Fc1c(cccc1COCc2ccccn2)Br 34a_100011935076_100000721315 [0,2,0,0,0,0|1,0,0]=3 23897 B18R2.3922 Fc1c(cccc1COCc2ccccn2)Br 7a_100011935076_100000721315 [0,2,0,0,0,0|1,0,0]=3 23898 B18R2.3922 Fc1c(cccc1COCc2ccccn2)Cl 34a_100011216988_100000721315 [0,2,0,0,0,0|1,0,0]=3 23899 B18R2.3922 Fc1c(cccc1COCc2ccccn2)Cl 7a_100011216988_100000721315 [0,2,0,0,0,0|1,0,0]=3 23900 B18R2.3922 Fc1c(cccc1COCc2ccccn2)I 34a_200010235739_100000721315 [0,2,0,0,0,0|1,0,0]=3 23901 B18R2.3922 Fc1c(cccc1COCc2ccccn2)I 7a_200010235739_100000721315 [0,2,0,0,0,0|1,0,0]=3 23902 B18R2.3922 Fc1c(cccc1COCc2cccnc2)Br 34a_100011935076_100000733263 [0,2,0,0,0,0|1,0,0]=3 23903 B18R2.3922 Fc1c(cccc1COCc2cccnc2)Br 7a_100011935076_100000741622 [0,2,0,0,0,0|1,0,0]=3 23904 B18R2.3922 Fc1c(cccc1COCc2cccnc2)Cl 34a_100011216988_100000733263 [0,2,0,0,0,0|1,0,0]=3 23905 B18R2.3922 Fc1c(cccc1COCc2cccnc2)Cl 7a_100011216988_100000741622 [0,2,0,0,0,0|1,0,0]=3 23906 B18R2.3922 Fc1c(cccc1COCc2cccnc2)I 34a_200010235739_100000733263 [0,2,0,0,0,0|1,0,0]=3 23907 B18R2.3922 Fc1c(cccc1COCc2cccnc2)I 7a_200010235739_100000741622 [0,2,0,0,0,0|1,0,0]=3 23908 B18R2.3922 Fc1c(cccc1COCc2cccnn2)Br 34a_100011935076_100016990269 [0,2,0,0,0,0|2,0,0]=4 23909 B18R2.3922 Fc1c(cccc1COCc2cccnn2)Br 7a_100011935076_100016990269 [0,2,0,0,0,0|2,0,0]=4 23910 B18R2.3922 Fc1c(cccc1COCc2cccnn2)Cl 34a_100011216988_100016990269 [0,2,0,0,0,0|2,0,0]=4 23911 B18R2.3922 Fc1c(cccc1COCc2cccnn2)Cl 7a_100011216988_100016990269 [0,2,0,0,0,0|2,0,0]=4 23912 B18R2.3922 Fc1c(cccc1COCc2cccnn2)I 34a_200010235739_100016990269 [0,2,0,0,0,0|2,0,0]=4 23913 B18R2.3922 Fc1c(cccc1COCc2cccnn2)I 7a_200010235739_100016990269 [0,2,0,0,0,0|2,0,0]=4 23914 B18R2.3922 Fc1c(cccc1COCc2ccncc2)Br 7a_100011935076_100015193705 [0,2,0,0,0,0|1,0,0]=3 23915 B18R2.3922 Fc1c(cccc1COCc2ccncc2)Cl 7a_100011216988_100015193705 [0,2,0,0,0,0|1,0,0]=3 23916 B18R2.3922 Fc1c(cccc1COCc2ccncc2)I 7a_200010235739_100015193705 [0,2,0,0,0,0|1,0,0]=3 23917 B18R2.3922 Fc1c(cccc1COCc2cnccn2)Br 34a_100011935076_100016995436 [0,2,0,0,0,0|2,0,0]=4 23918 B18R2.3922 Fc1c(cccc1COCc2cnccn2)Br 7a_100011935076_100016995436 [0,2,0,0,0,0|2,0,0]=4 23919 B18R2.3922 Fc1c(cccc1COCc2cnccn2)Cl 34a_100011216988_100016995436 [0,2,0,0,0,0|2,0,0]=4 23920 B18R2.3922 Fc1c(cccc1COCc2cnccn2)Cl 7a_100011216988_100016995436 [0,2,0,0,0,0|2,0,0]=4 23921 B18R2.3922 Fc1c(cccc1COCc2cnccn2)I 34a_200010235739_100016995436 [0,2,0,0,0,0|2,0,0]=4 23922 B18R2.3922 Fc1c(cccc1COCc2cnccn2)I 7a_200010235739_100016995436 [0,2,0,0,0,0|2,0,0]=4 23923 B18R2.3922 Fc1c(cccc1COCc2cncnc2)Br 34a_100011935076_100015196519 [0,2,0,0,0,0|2,0,0]=4 23924 B18R2.3922 Fc1c(cccc1COCc2cncnc2)Br 7a_100011935076_100015196519 [0,2,0,0,0,0|2,0,0]=4 23925 B18R2.3922 Fc1c(cccc1COCc2cncnc2)Cl 34a_100011216988_100015196519 [0,2,0,0,0,0|2,0,0]=4 23926 B18R2.3922 Fc1c(cccc1COCc2cncnc2)Cl 7a_100011216988_100015196519 [0,2,0,0,0,0|2,0,0]=4 23927 B18R2.3922 Fc1c(cccc1COCc2cncnc2)I 34a_200010235739_100015196519 [0,2,0,0,0,0|2,0,0]=4 23928 B18R2.3922 Fc1c(cccc1COCc2cncnc2)I 7a_200010235739_100015196519 [0,2,0,0,0,0|2,0,0]=4 23929 B18R2.3922 Fc1c(cccc1COCc2ncccn2)Br 34a_100011935076_100000703007 [0,2,0,0,0,0|2,0,0]=4 23930 B18R2.3922 Fc1c(cccc1COCc2ncccn2)Br 7a_100011935076_100000703007 [0,2,0,0,0,0|2,0,0]=4 23931 B18R2.3922 Fc1c(cccc1COCc2ncccn2)Cl 34a_100011216988_100000703007 [0,2,0,0,0,0|2,0,0]=4 23932 B18R2.3922 Fc1c(cccc1COCc2ncccn2)Cl 7a_100011216988_100000703007 [0,2,0,0,0,0|2,0,0]=4 23933 B18R2.3922 Fc1c(cccc1COCc2ncccn2)I 34a_200010235739_100000703007 [0,2,0,0,0,0|2,0,0]=4 23934 B18R2.3922 Fc1c(cccc1COCc2ncccn2)I 7a_200010235739_100000703007 [0,2,0,0,0,0|2,0,0]=4 23935 B18R2.3922 Fc1c(cccc1CSCc2ccccc2)Br 62a_100000211182_100012356506 [0,2,0,0,0,0|0,1,0]=3 23936 B18R2.3922 Fc1c(cccc1CSCc2ccccc2)Br 62a_100012356506_100015291786 [0,2,0,0,0,0|0,1,0]=3 23937 B18R2.3922 Fc1c(cccc1CSCc2ccccc2)Cl 62a_100000211182_100000716733 [0,2,0,0,0,0|0,1,0]=3 23938 B18R2.3922 Fc1c(cccc1CSCc2ccccc2)Cl 62a_100000716733_100015291786 [0,2,0,0,0,0|0,1,0]=3 23939 B18R2.3922 Fc1c(cccc1CSCc2ccccn2)Br 62a_100000721315_100012356506 [0,2,0,0,0,0|1,1,0]=4 23940 B18R2.3922 Fc1c(cccc1CSCc2ccccn2)Br 62a_100012356506_100000721315 [0,2,0,0,0,0|1,1,0]=4 23941 B18R2.3922 Fc1c(cccc1CSCc2ccccn2)Cl 62a_100000716733_100000721315 [0,2,0,0,0,0|1,1,0]=4 23942 B18R2.3922 Fc1c(cccc1CSCc2ccccn2)Cl 62a_100000721315_100000716733 [0,2,0,0,0,0|1,1,0]=4 23943 B18R2.3922 Fc1c(cccc1CSCc2cccnc2)Br 62a_100000741622_100012356506 [0,2,0,0,0,0|1,1,0]=4 23944 B18R2.3922 Fc1c(cccc1CSCc2cccnc2)Br 62a_100012356506_100000741622 [0,2,0,0,0,0|1,1,0]=4 23945 B18R2.3922 Fc1c(cccc1CSCc2cccnc2)Cl 62a_100000716733_100000741622 [0,2,0,0,0,0|1,1,0]=4 23946 B18R2.3922 Fc1c(cccc1CSCc2cccnc2)Cl 62a_100000741622_100000716733 [0,2,0,0,0,0|1,1,0]=4 23947 B18R2.3922 Fc1c(cccc1CSCc2ccncc2)Br 62a_100012356506_100015193705 [0,2,0,0,0,0|1,1,0]=4 23948 B18R2.3922 Fc1c(cccc1CSCc2ccncc2)Br 62a_100015193705_100012356506 [0,2,0,0,0,0|1,1,0]=4 23949 B18R2.3922 Fc1c(cccc1CSCc2ccncc2)Cl 62a_100000716733_100015193705 [0,2,0,0,0,0|1,1,0]=4 23950 B18R2.3922 Fc1c(cccc1CSCc2ccncc2)Cl 62a_100015193705_100000716733 [0,2,0,0,0,0|1,1,0]=4 23951 B18R2.3922 Fc1c(cccc1NCCc2ccccc2)Br 2230a_100011935091_100000765856 [0,2,0,0,0,0|2,0,0]=4 23952 B18R2.3922 Fc1c(cccc1NCCc2ccccc2)Br 34a_100011935091_100000765856 [0,2,0,0,0,0|2,0,0]=4 23953 B18R2.3922 Fc1c(cccc1NCCc2ccccc2)Cl 2230a_100000199060_100000765856 [0,2,0,0,0,0|2,0,0]=4 23954 B18R2.3922 Fc1c(cccc1NCCc2ccccc2)Cl 34a_100000199060_100000765856 [0,2,0,0,0,0|2,0,0]=4 23955 B18R2.3922 Fc1c(cccc1OCCc2ccccc2)Br 34a_100009817021_100000765856 [0,2,0,0,0,0|2,0,0]=4 23956 B18R2.3922 Fc1c(cccc1OCCc2ccccc2)Br 7a_100009817021_100000765856 [0,2,0,0,0,0|2,0,0]=4 23957 B18R2.3922 Fc1c(cccc1OCCc2ccccc2)Cl 34a_100000687438_100000765856 [0,2,0,0,0,0|2,0,0]=4 23958 B18R2.3922 Fc1c(cccc1OCCc2ccccc2)Cl 7a_100000687438_100000765856 [0,2,0,0,0,0|2,0,0]=4 23959 B18R2.3922 Fc1c(cccc1SCCc2ccccc2)Br 62a_100000702267_100011218657 [0,2,0,0,0,0|2,0,0]=4 23960 B18R2.3922 Fc1c(cccc1SCCc2ccccc2)Br 62a_100000765856_100000702267 [0,2,0,0,0,0|2,0,0]=4 23961 B18R2.3922 Fc1c(cccc1SCCc2ccccc2)Cl 62a_100000765856_100011217346 [0,2,0,0,0,0|2,0,0]=4 23962 B18R2.3922 Fc1c(cccc1SCCc2ccccc2)Cl 62a_100011217346_100011218657 [0,2,0,0,0,0|2,0,0]=4 23963 B18R2.3922 Fc1c(ccnc1Br)COCc2ccccc2 34a_100010065242_100015291786 [0,2,0,0,0,0|1,0,0]=3 23964 B18R2.3922 Fc1c(ccnc1Br)COCc2ccccc2 7a_100010065242_100000211182 [0,2,0,0,0,0|1,0,0]=3 23965 B18R2.3922 Fc1c(ccnc1Br)COCc2ccccn2 34a_100010065242_100000721315 [0,2,0,0,0,0|2,0,0]=4 23966 B18R2.3922 Fc1c(ccnc1Br)COCc2ccccn2 7a_100010065242_100000721315 [0,2,0,0,0,0|2,0,0]=4 23967 B18R2.3922 Fc1c(ccnc1Br)COCc2cccnc2 34a_100010065242_100000733263 [0,2,0,0,0,0|2,0,0]=4 23968 B18R2.3922 Fc1c(ccnc1Br)COCc2cccnc2 7a_100010065242_100000741622 [0,2,0,0,0,0|2,0,0]=4 23969 B18R2.3922 Fc1c(ccnc1Br)COCc2ccncc2 7a_100010065242_100015193705 [0,2,0,0,0,0|2,0,0]=4 23970 B18R2.3922 Fc1c(ccnc1CNCc2ccccc2)Br 270004a_100015324214_100015713984 [0,2,0,0,0,0|2,0,0]=4 23971 B18R2.3922 Fc1c(ccnc1Cl)COCc2ccccc2 34a_100000101314_100015291786 [0,2,0,0,0,0|1,0,0]=3 23972 B18R2.3922 Fc1c(ccnc1Cl)COCc2ccccc2 7a_100000101314_100000211182 [0,2,0,0,0,0|1,0,0]=3 23973 B18R2.3922 Fc1c(ccnc1Cl)COCc2ccccn2 34a_100000101314_100000721315 [0,2,0,0,0,0|2,0,0]=4 23974 B18R2.3922 Fc1c(ccnc1Cl)COCc2ccccn2 7a_100000101314_100000721315 [0,2,0,0,0,0|2,0,0]=4 23975 B18R2.3922 Fc1c(ccnc1Cl)COCc2cccnc2 34a_100000101314_100000733263 [0,2,0,0,0,0|2,0,0]=4 23976 B18R2.3922 Fc1c(ccnc1Cl)COCc2cccnc2 7a_100000101314_100000741622 [0,2,0,0,0,0|2,0,0]=4 23977 B18R2.3922 Fc1c(ccnc1Cl)COCc2ccncc2 7a_100000101314_100015193705 [0,2,0,0,0,0|2,0,0]=4 23978 B18R2.3922 Fc1cccc(c1Br)CNCc2ccccc2 207a_100015324214_100011934749 [0,2,0,0,0,0|1,0,0]=3 23979 B18R2.3922 Fc1cccc(c1Br)CNCc2ccccc2 207a_100020638964_100015611070 [0,2,0,0,0,0|1,0,0]=3 23980 B18R2.3922 Fc1cccc(c1Br)CNCc2ccccc2 2230a_100015324214_100012351116 [0,2,0,0,0,0|1,0,0]=3 23981 B18R2.3922 Fc1cccc(c1Br)CNCc2ccccc2 2230a_100020638964_100015291786 [0,2,0,0,0,0|1,0,0]=3 23982 B18R2.3922 Fc1cccc(c1Br)CNCc2ccccc2 270004a_100015324214_100011934749 [0,2,0,0,0,0|1,0,0]=3 23983 B18R2.3922 Fc1cccc(c1Br)CNCc2ccccc2 270004a_100020638964_100015611070 [0,2,0,0,0,0|1,0,0]=3 23984 B18R2.3922 Fc1cccc(c1Br)CNCc2ccccc2 34a_100015324214_100012351116 [0,2,0,0,0,0|1,0,0]=3 23985 B18R2.3922 Fc1cccc(c1Br)CNCc2ccccc2 34a_100020638964_100015291786 [0,2,0,0,0,0|1,0,0]=3 23986 B18R2.3922 Fc1cccc(c1Br)CNCc2ccccn2 207a_100020638964_100000209966 [0,2,0,0,0,0|2,0,0]=4 23987 B18R2.3922 Fc1cccc(c1Br)CNCc2ccccn2 2230a_100020638964_100000721315 [0,2,0,0,0,0|2,0,0]=4 23988 B18R2.3922 Fc1cccc(c1Br)CNCc2ccccn2 270004a_100000210449_100011934749 [0,2,0,0,0,0|2,0,0]=4 23989 B18R2.3922 Fc1cccc(c1Br)CNCc2ccccn2 270004a_100020638964_100000209966 [0,2,0,0,0,0|2,0,0]=4 23990 B18R2.3922 Fc1cccc(c1Br)CNCc2ccccn2 34a_100020638964_100000721315 [0,2,0,0,0,0|2,0,0]=4 23991 B18R2.3922 Fc1cccc(c1Br)CNCc2cccnc2 207a_100000210453_100011934749 [0,2,0,0,0,0|2,0,0]=4 23992 B18R2.3922 Fc1cccc(c1Br)CNCc2cccnc2 207a_100020638964_100000209961 [0,2,0,0,0,0|2,0,0]=4 23993 B18R2.3922 Fc1cccc(c1Br)CNCc2cccnc2 2230a_100020638964_100000741622 [0,2,0,0,0,0|2,0,0]=4 23994 B18R2.3922 Fc1cccc(c1Br)CNCc2cccnc2 270004a_100000210453_100011934749 [0,2,0,0,0,0|2,0,0]=4 23995 B18R2.3922 Fc1cccc(c1Br)CNCc2cccnc2 270004a_100020638964_100000209961 [0,2,0,0,0,0|2,0,0]=4 23996 B18R2.3922 Fc1cccc(c1Br)CNCc2cccnc2 34a_100020638964_100000733263 [0,2,0,0,0,0|2,0,0]=4 23997 B18R2.3922 Fc1cccc(c1Br)CNCc2ccncc2 207a_100020638964_100000186114 [0,2,0,0,0,0|2,0,0]=4 23998 B18R2.3922 Fc1cccc(c1Br)CNCc2ccncc2 2230a_100020638964_100015193705 [0,2,0,0,0,0|2,0,0]=4 23999 B18R2.3922 Fc1cccc(c1Br)COCc2ccccc2 34a_100000210790_100012351116 [0,2,0,0,0,0|0,0,0]=2 24000 B18R2.3922 Fc1cccc(c1Br)COCc2ccccc2 34a_100012351117_100015291786 [0,2,0,0,0,0|0,0,0]=2 24001 B18R2.3922 Fc1cccc(c1Br)COCc2ccccc2 7a_100000210790_100012351116 [0,2,0,0,0,0|0,0,0]=2 24002 B18R2.3922 Fc1cccc(c1Br)COCc2ccccc2 7a_100012351117_100000211182 [0,2,0,0,0,0|0,0,0]=2 24003 B18R2.3922 Fc1cccc(c1Br)COCc2ccccn2 34a_100012351117_100000721315 [0,2,0,0,0,0|1,0,0]=3 24004 B18R2.3922 Fc1cccc(c1Br)COCc2ccccn2 7a_100012351117_100000721315 [0,2,0,0,0,0|1,0,0]=3 24005 B18R2.3922 Fc1cccc(c1Br)COCc2cccnc2 34a_100012351117_100000733263 [0,2,0,0,0,0|1,0,0]=3 24006 B18R2.3922 Fc1cccc(c1Br)COCc2cccnc2 7a_100012351117_100000741622 [0,2,0,0,0,0|1,0,0]=3 24007 B18R2.3922 Fc1cccc(c1Br)COCc2cccnn2 34a_100012351117_100016990269 [0,2,0,0,0,0|2,0,0]=4 24008 B18R2.3922 Fc1cccc(c1Br)COCc2cccnn2 7a_100012351117_100016990269 [0,2,0,0,0,0|2,0,0]=4 24009 B18R2.3922 Fc1cccc(c1Br)COCc2ccncc2 7a_100012351117_100015193705 [0,2,0,0,0,0|1,0,0]=3 24010 B18R2.3922 Fc1cccc(c1Br)COCc2cnccn2 34a_100012351117_100016995436 [0,2,0,0,0,0|2,0,0]=4 24011 B18R2.3922 Fc1cccc(c1Br)COCc2cnccn2 7a_100012351117_100016995436 [0,2,0,0,0,0|2,0,0]=4 24012 B18R2.3922 Fc1cccc(c1Br)COCc2cncnc2 34a_100012351117_100015196519 [0,2,0,0,0,0|2,0,0]=4 24013 B18R2.3922 Fc1cccc(c1Br)COCc2cncnc2 7a_100012351117_100015196519 [0,2,0,0,0,0|2,0,0]=4 24014 B18R2.3922 Fc1cccc(c1Br)COCc2ncccn2 34a_100012351117_100000703007 [0,2,0,0,0,0|2,0,0]=4 24015 B18R2.3922 Fc1cccc(c1Br)COCc2ncccn2 7a_100012351117_100000703007 [0,2,0,0,0,0|2,0,0]=4 24016 B18R2.3922 Fc1cccc(c1Br)CSCc2ccccc2 62a_100000211182_100012351116 [0,2,0,0,0,0|0,1,0]=3 24017 B18R2.3922 Fc1cccc(c1Br)CSCc2ccccc2 62a_100012351116_100015291786 [0,2,0,0,0,0|0,1,0]=3 24018 B18R2.3922 Fc1cccc(c1Br)CSCc2ccccn2 62a_100000721315_100012351116 [0,2,0,0,0,0|1,1,0]=4 24019 B18R2.3922 Fc1cccc(c1Br)CSCc2ccccn2 62a_100012351116_100000721315 [0,2,0,0,0,0|1,1,0]=4 24020 B18R2.3922 Fc1cccc(c1Br)CSCc2cccnc2 62a_100000741622_100012351116 [0,2,0,0,0,0|1,1,0]=4 24021 B18R2.3922 Fc1cccc(c1Br)CSCc2cccnc2 62a_100012351116_100000741622 [0,2,0,0,0,0|1,1,0]=4 24022 B18R2.3922 Fc1cccc(c1Br)CSCc2ccncc2 62a_100012351116_100015193705 [0,2,0,0,0,0|1,1,0]=4 24023 B18R2.3922 Fc1cccc(c1Br)CSCc2ccncc2 62a_100015193705_100012351116 [0,2,0,0,0,0|1,1,0]=4 24024 B18R2.3922 Fc1cccc(c1Br)NCCc2ccccc2 34a_100011934729_100000765856 [0,2,0,0,0,0|2,0,0]=4 24025 B18R2.3922 Fc1cccc(c1Br)OCCc2ccccc2 34a_100009820682_100000765856 [0,2,0,0,0,0|2,0,0]=4 24026 B18R2.3922 Fc1cccc(c1Br)OCCc2ccccc2 7a_100009820682_100000765856 [0,2,0,0,0,0|2,0,0]=4 24027 B18R2.3922 Fc1cccc(c1Br)SCCc2ccccc2 62a_100000765856_100010202630 [0,2,0,0,0,0|2,0,0]=4 24028 B18R2.3922 Fc1cccc(c1Br)SCCc2ccccc2 62a_100010202630_100011218657 [0,2,0,0,0,0|2,0,0]=4 24029 B18R2.3922 Fc1cccc(c1Cl)C=CCc2ccccc2 271570a_200016263579_200010234923 [0,2,0,0,0,0|1,0,1]=4 24030 B18R2.3922 Fc1cccc(c1Cl)CNCc2ccccc2 207a_100012001614_100015611070 [0,2,0,0,0,0|1,0,0]=3 24031 B18R2.3922 Fc1cccc(c1Cl)CNCc2ccccc2 207a_100015324214_100011998484 [0,2,0,0,0,0|1,0,0]=3 24032 B18R2.3922 Fc1cccc(c1Cl)CNCc2ccccc2 2230a_100012001614_100015291786 [0,2,0,0,0,0|1,0,0]=3 24033 B18R2.3922 Fc1cccc(c1Cl)CNCc2ccccc2 2230a_100015324214_100000696688 [0,2,0,0,0,0|1,0,0]=3 24034 B18R2.3922 Fc1cccc(c1Cl)CNCc2ccccc2 270004a_100012001614_100015611070 [0,2,0,0,0,0|1,0,0]=3 24035 B18R2.3922 Fc1cccc(c1Cl)CNCc2ccccc2 270004a_100015324214_100011998484 [0,2,0,0,0,0|1,0,0]=3 24036 B18R2.3922 Fc1cccc(c1Cl)CNCc2ccccc2 34a_100012001614_100015291786 [0,2,0,0,0,0|1,0,0]=3 24037 B18R2.3922 Fc1cccc(c1Cl)CNCc2ccccc2 34a_100015324214_100000696688 [0,2,0,0,0,0|1,0,0]=3 24038 B18R2.3922 Fc1cccc(c1Cl)CNCc2ccccn2 207a_100012001614_100000209966 [0,2,0,0,0,0|2,0,0]=4 24039 B18R2.3922 Fc1cccc(c1Cl)CNCc2ccccn2 2230a_100012001614_100000721315 [0,2,0,0,0,0|2,0,0]=4 24040 B18R2.3922 Fc1cccc(c1Cl)CNCc2ccccn2 270004a_100000210449_100011998484 [0,2,0,0,0,0|2,0,0]=4 24041 B18R2.3922 Fc1cccc(c1Cl)CNCc2ccccn2 270004a_100012001614_100000209966 [0,2,0,0,0,0|2,0,0]=4 24042 B18R2.3922 Fc1cccc(c1Cl)CNCc2ccccn2 34a_100012001614_100000721315 [0,2,0,0,0,0|2,0,0]=4 24043 B18R2.3922 Fc1cccc(c1Cl)CNCc2cccnc2 207a_100000210453_100011998484 [0,2,0,0,0,0|2,0,0]=4 24044 B18R2.3922 Fc1cccc(c1Cl)CNCc2cccnc2 207a_100012001614_100000209961 [0,2,0,0,0,0|2,0,0]=4 24045 B18R2.3922 Fc1cccc(c1Cl)CNCc2cccnc2 2230a_100012001614_100000741622 [0,2,0,0,0,0|2,0,0]=4 24046 B18R2.3922 Fc1cccc(c1Cl)CNCc2cccnc2 270004a_100000210453_100011998484 [0,2,0,0,0,0|2,0,0]=4 24047 B18R2.3922 Fc1cccc(c1Cl)CNCc2cccnc2 270004a_100012001614_100000209961 [0,2,0,0,0,0|2,0,0]=4 24048 B18R2.3922 Fc1cccc(c1Cl)CNCc2cccnc2 34a_100012001614_100000733263 [0,2,0,0,0,0|2,0,0]=4 24049 B18R2.3922 Fc1cccc(c1Cl)CNCc2ccncc2 207a_100012001614_100000186114 [0,2,0,0,0,0|2,0,0]=4 24050 B18R2.3922 Fc1cccc(c1Cl)CNCc2ccncc2 2230a_100012001614_100015193705 [0,2,0,0,0,0|2,0,0]=4 24051 B18R2.3922 Fc1cccc(c1Cl)COCc2ccccc2 34a_100000210790_100000696688 [0,2,0,0,0,0|0,0,0]=2 24052 B18R2.3922 Fc1cccc(c1Cl)COCc2ccccc2 34a_100000696319_100015291786 [0,2,0,0,0,0|0,0,0]=2 24053 B18R2.3922 Fc1cccc(c1Cl)COCc2ccccc2 7a_100000210790_100000696688 [0,2,0,0,0,0|0,0,0]=2 24054 B18R2.3922 Fc1cccc(c1Cl)COCc2ccccc2 7a_100000696319_100000211182 [0,2,0,0,0,0|0,0,0]=2 24055 B18R2.3922 Fc1cccc(c1Cl)COCc2ccccn2 34a_100000696319_100000721315 [0,2,0,0,0,0|1,0,0]=3 24056 B18R2.3922 Fc1cccc(c1Cl)COCc2ccccn2 7a_100000696319_100000721315 [0,2,0,0,0,0|1,0,0]=3 24057 B18R2.3922 Fc1cccc(c1Cl)COCc2cccnc2 34a_100000696319_100000733263 [0,2,0,0,0,0|1,0,0]=3 24058 B18R2.3922 Fc1cccc(c1Cl)COCc2cccnc2 7a_100000696319_100000741622 [0,2,0,0,0,0|1,0,0]=3 24059 B18R2.3922 Fc1cccc(c1Cl)COCc2cccnn2 34a_100000696319_100016990269 [0,2,0,0,0,0|2,0,0]=4 24060 B18R2.3922 Fc1cccc(c1Cl)COCc2cccnn2 7a_100000696319_100016990269 [0,2,0,0,0,0|2,0,0]=4 24061 B18R2.3922 Fc1cccc(c1Cl)COCc2ccncc2 7a_100000696319_100015193705 [0,2,0,0,0,0|1,0,0]=3 24062 B18R2.3922 Fc1cccc(c1Cl)COCc2cnccn2 34a_100000696319_100016995436 [0,2,0,0,0,0|2,0,0]=4 24063 B18R2.3922 Fc1cccc(c1Cl)COCc2cnccn2 7a_100000696319_100016995436 [0,2,0,0,0,0|2,0,0]=4 24064 B18R2.3922 Fc1cccc(c1Cl)COCc2cncnc2 34a_100000696319_100015196519 [0,2,0,0,0,0|2,0,0]=4 24065 B18R2.3922 Fc1cccc(c1Cl)COCc2cncnc2 7a_100000696319_100015196519 [0,2,0,0,0,0|2,0,0]=4 24066 B18R2.3922 Fc1cccc(c1Cl)COCc2ncccn2 34a_100000696319_100000703007 [0,2,0,0,0,0|2,0,0]=4 24067 B18R2.3922 Fc1cccc(c1Cl)COCc2ncccn2 7a_100000696319_100000703007 [0,2,0,0,0,0|2,0,0]=4 24068 B18R2.3922 Fc1cccc(c1Cl)CSCc2ccccc2 62a_100000211182_100000696688 [0,2,0,0,0,0|0,1,0]=3 24069 B18R2.3922 Fc1cccc(c1Cl)CSCc2ccccc2 62a_100000696688_100015291786 [0,2,0,0,0,0|0,1,0]=3 24070 B18R2.3922 Fc1cccc(c1Cl)CSCc2ccccn2 62a_100000696688_100000721315 [0,2,0,0,0,0|1,1,0]=4 24071 B18R2.3922 Fc1cccc(c1Cl)CSCc2ccccn2 62a_100000721315_100000696688 [0,2,0,0,0,0|1,1,0]=4 24072 B18R2.3922 Fc1cccc(c1Cl)CSCc2cccnc2 62a_100000696688_100000741622 [0,2,0,0,0,0|1,1,0]=4 24073 B18R2.3922 Fc1cccc(c1Cl)CSCc2cccnc2 62a_100000741622_100000696688 [0,2,0,0,0,0|1,1,0]=4 24074 B18R2.3922 Fc1cccc(c1Cl)CSCc2ccncc2 62a_100000696688_100015193705 [0,2,0,0,0,0|1,1,0]=4 24075 B18R2.3922 Fc1cccc(c1Cl)CSCc2ccncc2 62a_100015193705_100000696688 [0,2,0,0,0,0|1,1,0]=4 24076 B18R2.3922 Fc1cccc(c1Cl)NCCc2ccccc2 34a_100000692321_100000765856 [0,2,0,0,0,0|2,0,0]=4 24077 B18R2.3922 Fc1cccc(c1Cl)OCCc2ccccc2 34a_100000087408_100000765856 [0,2,0,0,0,0|2,0,0]=4 24078 B18R2.3922 Fc1cccc(c1Cl)OCCc2ccccc2 7a_100000087408_100000765856 [0,2,0,0,0,0|2,0,0]=4 24079 B18R2.3922 Fc1cccc(c1Cl)SCCc2ccccc2 62a_100000765856_200010234923 [0,2,0,0,0,0|2,0,0]=4 24080 B18R2.3922 Fc1cccc(c1Cl)SCCc2ccccc2 62a_200010234923_100011218657 [0,2,0,0,0,0|2,0,0]=4 24081 B18R2.3922 Fc1cccc(c1F)C=CCc2ccccc2 271570a_200016263579_100000694657 [0,2,0,0,0,0|1,0,1]=4 24082 B18R2.3922 Fc1cccc(c1F)CNCc2ccccc2 207a_100011199105_100015611070 [0,2,0,0,0,0|1,0,0]=3 24083 B18R2.3922 Fc1cccc(c1F)CNCc2ccccc2 207a_100015324214_100000753312 [0,2,0,0,0,0|1,0,0]=3 24084 B18R2.3922 Fc1cccc(c1F)CNCc2ccccc2 2230a_100011199105_100015291786 [0,2,0,0,0,0|1,0,0]=3 24085 B18R2.3922 Fc1cccc(c1F)CNCc2ccccc2 2230a_100015324214_100000217499 [0,2,0,0,0,0|1,0,0]=3 24086 B18R2.3922 Fc1cccc(c1F)CNCc2ccccc2 270004a_100011199105_100015611070 [0,2,0,0,0,0|1,0,0]=3 24087 B18R2.3922 Fc1cccc(c1F)CNCc2ccccc2 270004a_100015324214_100000753312 [0,2,0,0,0,0|1,0,0]=3 24088 B18R2.3922 Fc1cccc(c1F)CNCc2ccccc2 34a_100011199105_100015291786 [0,2,0,0,0,0|1,0,0]=3 24089 B18R2.3922 Fc1cccc(c1F)CNCc2ccccc2 34a_100015324214_100000217499 [0,2,0,0,0,0|1,0,0]=3 24090 B18R2.3922 Fc1cccc(c1F)CNCc2ccccn2 207a_100011199105_100000209966 [0,2,0,0,0,0|2,0,0]=4 24091 B18R2.3922 Fc1cccc(c1F)CNCc2ccccn2 2230a_100011199105_100000721315 [0,2,0,0,0,0|2,0,0]=4 24092 B18R2.3922 Fc1cccc(c1F)CNCc2ccccn2 270004a_100000210449_100000753312 [0,2,0,0,0,0|2,0,0]=4 24093 B18R2.3922 Fc1cccc(c1F)CNCc2ccccn2 270004a_100011199105_100000209966 [0,2,0,0,0,0|2,0,0]=4 24094 B18R2.3922 Fc1cccc(c1F)CNCc2ccccn2 34a_100011199105_100000721315 [0,2,0,0,0,0|2,0,0]=4 24095 B18R2.3922 Fc1cccc(c1F)CNCc2cccnc2 207a_100000210453_100000753312 [0,2,0,0,0,0|2,0,0]=4 24096 B18R2.3922 Fc1cccc(c1F)CNCc2cccnc2 207a_100011199105_100000209961 [0,2,0,0,0,0|2,0,0]=4 24097 B18R2.3922 Fc1cccc(c1F)CNCc2cccnc2 2230a_100011199105_100000741622 [0,2,0,0,0,0|2,0,0]=4 24098 B18R2.3922 Fc1cccc(c1F)CNCc2cccnc2 270004a_100000210453_100000753312 [0,2,0,0,0,0|2,0,0]=4 24099 B18R2.3922 Fc1cccc(c1F)CNCc2cccnc2 270004a_100011199105_100000209961 [0,2,0,0,0,0|2,0,0]=4 24100 B18R2.3922 Fc1cccc(c1F)CNCc2cccnc2 34a_100011199105_100000733263 [0,2,0,0,0,0|2,0,0]=4 24101 B18R2.3922 Fc1cccc(c1F)CNCc2ccncc2 207a_100011199105_100000186114 [0,2,0,0,0,0|2,0,0]=4 24102 B18R2.3922 Fc1cccc(c1F)CNCc2ccncc2 2230a_100011199105_100015193705 [0,2,0,0,0,0|2,0,0]=4 24103 B18R2.3922 Fc1cccc(c1F)COCc2ccccc2 34a_100000210790_100000217499 [0,2,0,0,0,0|0,0,0]=2 24104 B18R2.3922 Fc1cccc(c1F)COCc2ccccc2 34a_100011218644_100015291786 [0,2,0,0,0,0|0,0,0]=2 24105 B18R2.3922 Fc1cccc(c1F)COCc2ccccc2 7a_100000210790_100000217499 [0,2,0,0,0,0|0,0,0]=2 24106 B18R2.3922 Fc1cccc(c1F)COCc2ccccc2 7a_100011218644_100000211182 [0,2,0,0,0,0|0,0,0]=2 24107 B18R2.3922 Fc1cccc(c1F)COCc2ccccn2 34a_100011218644_100000721315 [0,2,0,0,0,0|1,0,0]=3 24108 B18R2.3922 Fc1cccc(c1F)COCc2ccccn2 7a_100011218644_100000721315 [0,2,0,0,0,0|1,0,0]=3 24109 B18R2.3922 Fc1cccc(c1F)COCc2cccnc2 34a_100011218644_100000733263 [0,2,0,0,0,0|1,0,0]=3 24110 B18R2.3922 Fc1cccc(c1F)COCc2cccnc2 7a_100011218644_100000741622 [0,2,0,0,0,0|1,0,0]=3 24111 B18R2.3922 Fc1cccc(c1F)COCc2cccnn2 34a_100011218644_100016990269 [0,2,0,0,0,0|2,0,0]=4 24112 B18R2.3922 Fc1cccc(c1F)COCc2cccnn2 7a_100011218644_100016990269 [0,2,0,0,0,0|2,0,0]=4 24113 B18R2.3922 Fc1cccc(c1F)COCc2ccncc2 7a_100011218644_100015193705 [0,2,0,0,0,0|1,0,0]=3 24114 B18R2.3922 Fc1cccc(c1F)COCc2cnccn2 34a_100011218644_100016995436 [0,2,0,0,0,0|2,0,0]=4 24115 B18R2.3922 Fc1cccc(c1F)COCc2cnccn2 7a_100011218644_100016995436 [0,2,0,0,0,0|2,0,0]=4 24116 B18R2.3922 Fc1cccc(c1F)COCc2cncnc2 34a_100011218644_100015196519 [0,2,0,0,0,0|2,0,0]=4 24117 B18R2.3922 Fc1cccc(c1F)COCc2cncnc2 7a_100011218644_100015196519 [0,2,0,0,0,0|2,0,0]=4 24118 B18R2.3922 Fc1cccc(c1F)COCc2ncccn2 34a_100011218644_100000703007 [0,2,0,0,0,0|2,0,0]=4 24119 B18R2.3922 Fc1cccc(c1F)COCc2ncccn2 7a_100011218644_100000703007 [0,2,0,0,0,0|2,0,0]=4 24120 B18R2.3922 Fc1cccc(c1F)CSCc2ccccc2 62a_100000211182_100000217499 [0,2,0,0,0,0|0,1,0]=3 24121 B18R2.3922 Fc1cccc(c1F)CSCc2ccccc2 62a_100000217499_100015291786 [0,2,0,0,0,0|0,1,0]=3 24122 B18R2.3922 Fc1cccc(c1F)CSCc2ccccn2 62a_100000217499_100000721315 [0,2,0,0,0,0|1,1,0]=4 24123 B18R2.3922 Fc1cccc(c1F)CSCc2ccccn2 62a_100000721315_100000217499 [0,2,0,0,0,0|1,1,0]=4 24124 B18R2.3922 Fc1cccc(c1F)CSCc2cccnc2 62a_100000217499_100000741622 [0,2,0,0,0,0|1,1,0]=4 24125 B18R2.3922 Fc1cccc(c1F)CSCc2cccnc2 62a_100000741622_100000217499 [0,2,0,0,0,0|1,1,0]=4 24126 B18R2.3922 Fc1cccc(c1F)CSCc2ccncc2 62a_100000217499_100015193705 [0,2,0,0,0,0|1,1,0]=4 24127 B18R2.3922 Fc1cccc(c1F)CSCc2ccncc2 62a_100015193705_100000217499 [0,2,0,0,0,0|1,1,0]=4 24128 B18R2.3922 Fc1cccc(c1F)NCCc2ccccc2 34a_100000743855_100000765856 [0,2,0,0,0,0|2,0,0]=4 24129 B18R2.3922 Fc1cccc(c1F)OCCc2ccccc2 34a_100000751161_100000765856 [0,2,0,0,0,0|2,0,0]=4 24130 B18R2.3922 Fc1cccc(c1F)OCCc2ccccc2 7a_100000751161_100000765856 [0,2,0,0,0,0|2,0,0]=4 24131 B18R2.3922 Fc1cccc(c1F)SCCc2ccccc2 62a_100000694657_100011218657 [0,2,0,0,0,0|2,0,0]=4 24132 B18R2.3922 Fc1cccc(c1F)SCCc2ccccc2 62a_100000765856_100000694657 [0,2,0,0,0,0|2,0,0]=4 24133 B18R2.3922 Fc1cccc(c1I)CNCc2ccccc2 207a_100015324214_100010186293 [0,2,0,0,0,0|1,0,0]=3 24134 B18R2.3922 Fc1cccc(c1I)CNCc2ccccc2 2230a_100015324214_100010149603 [0,2,0,0,0,0|1,0,0]=3 24135 B18R2.3922 Fc1cccc(c1I)CNCc2ccccc2 270004a_100015324214_100010186293 [0,2,0,0,0,0|1,0,0]=3 24136 B18R2.3922 Fc1cccc(c1I)CNCc2ccccc2 34a_100015324214_100010149603 [0,2,0,0,0,0|1,0,0]=3 24137 B18R2.3922 Fc1cccc(c1I)CNCc2ccccn2 270004a_100000210449_100010186293 [0,2,0,0,0,0|2,0,0]=4 24138 B18R2.3922 Fc1cccc(c1I)CNCc2cccnc2 207a_100000210453_100010186293 [0,2,0,0,0,0|2,0,0]=4 24139 B18R2.3922 Fc1cccc(c1I)CNCc2cccnc2 270004a_100000210453_100010186293 [0,2,0,0,0,0|2,0,0]=4 24140 B18R2.3922 Fc1cccc(c1I)COCc2ccccc2 34a_100000210790_100010149603 [0,2,0,0,0,0|0,0,0]=2 24141 B18R2.3922 Fc1cccc(c1I)COCc2ccccc2 34a_100000692438_100015291786 [0,2,0,0,0,0|0,0,0]=2 24142 B18R2.3922 Fc1cccc(c1I)COCc2ccccc2 7a_100000210790_100010149603 [0,2,0,0,0,0|0,0,0]=2 24143 B18R2.3922 Fc1cccc(c1I)COCc2ccccc2 7a_100000692438_100000211182 [0,2,0,0,0,0|0,0,0]=2 24144 B18R2.3922 Fc1cccc(c1I)COCc2ccccn2 34a_100000692438_100000721315 [0,2,0,0,0,0|1,0,0]=3 24145 B18R2.3922 Fc1cccc(c1I)COCc2ccccn2 7a_100000692438_100000721315 [0,2,0,0,0,0|1,0,0]=3 24146 B18R2.3922 Fc1cccc(c1I)COCc2cccnc2 34a_100000692438_100000733263 [0,2,0,0,0,0|1,0,0]=3 24147 B18R2.3922 Fc1cccc(c1I)COCc2cccnc2 7a_100000692438_100000741622 [0,2,0,0,0,0|1,0,0]=3 24148 B18R2.3922 Fc1cccc(c1I)COCc2cccnn2 34a_100000692438_100016990269 [0,2,0,0,0,0|2,0,0]=4 24149 B18R2.3922 Fc1cccc(c1I)COCc2cccnn2 7a_100000692438_100016990269 [0,2,0,0,0,0|2,0,0]=4 24150 B18R2.3922 Fc1cccc(c1I)COCc2ccncc2 7a_100000692438_100015193705 [0,2,0,0,0,0|1,0,0]=3 24151 B18R2.3922 Fc1cccc(c1I)COCc2cnccn2 34a_100000692438_100016995436 [0,2,0,0,0,0|2,0,0]=4 24152 B18R2.3922 Fc1cccc(c1I)COCc2cnccn2 7a_100000692438_100016995436 [0,2,0,0,0,0|2,0,0]=4 24153 B18R2.3922 Fc1cccc(c1I)COCc2cncnc2 34a_100000692438_100015196519 [0,2,0,0,0,0|2,0,0]=4 24154 B18R2.3922 Fc1cccc(c1I)COCc2cncnc2 7a_100000692438_100015196519 [0,2,0,0,0,0|2,0,0]=4 24155 B18R2.3922 Fc1cccc(c1I)COCc2ncccn2 34a_100000692438_100000703007 [0,2,0,0,0,0|2,0,0]=4 24156 B18R2.3922 Fc1cccc(c1I)COCc2ncccn2 7a_100000692438_100000703007 [0,2,0,0,0,0|2,0,0]=4 24157 B18R2.3922 Fc1cccc(c1I)CSCc2ccccc2 62a_100000211182_100010149603 [0,2,0,0,0,0|0,1,0]=3 24158 B18R2.3922 Fc1cccc(c1I)CSCc2ccccc2 62a_100010149603_100015291786 [0,2,0,0,0,0|0,1,0]=3 24159 B18R2.3922 Fc1cccc(c1I)CSCc2ccccn2 62a_100000721315_100010149603 [0,2,0,0,0,0|1,1,0]=4 24160 B18R2.3922 Fc1cccc(c1I)CSCc2ccccn2 62a_100010149603_100000721315 [0,2,0,0,0,0|1,1,0]=4 24161 B18R2.3922 Fc1cccc(c1I)CSCc2cccnc2 62a_100000741622_100010149603 [0,2,0,0,0,0|1,1,0]=4 24162 B18R2.3922 Fc1cccc(c1I)CSCc2cccnc2 62a_100010149603_100000741622 [0,2,0,0,0,0|1,1,0]=4 24163 B18R2.3922 Fc1cccc(c1I)CSCc2ccncc2 62a_100010149603_100015193705 [0,2,0,0,0,0|1,1,0]=4 24164 B18R2.3922 Fc1cccc(c1I)CSCc2ccncc2 62a_100015193705_100010149603 [0,2,0,0,0,0|1,1,0]=4 24165 B18R2.3922 Fc1cccc(c1I)NCCc2ccccc2 34a_100000690935_100000765856 [0,2,0,0,0,0|2,0,0]=4 24166 B18R2.3922 Fc1cccc(c1I)OCCc2ccccc2 34a_100000690913_100000765856 [0,2,0,0,0,0|2,0,0]=4 24167 B18R2.3922 Fc1cccc(c1I)OCCc2ccccc2 7a_100000690913_100000765856 [0,2,0,0,0,0|2,0,0]=4 24168 B18R2.3922 Fc1nccc(c1Cl)CNCc2ccccc2 270004a_100015324214_100009856171 [0,2,0,0,0,0|2,0,0]=4 24169 B18R2.3922 Nc1c(cccc1C=CCc2ccccc2)Br 271570a_200016263579_100010146558 [0,2,0,0,0,0|1,0,1]=4 24170 B18R2.3922 Nc1c(cccc1C=CCc2ccccc2)Cl 271570a_200016263579_100010190421 [0,2,0,0,0,0|1,0,1]=4 24171 B18R2.3922 Nc1c(cccc1C=CCc2ccccc2)F 271570a_200016263579_100000042321 [0,2,0,0,0,0|1,0,1]=4 24172 B18R2.3922 Nc1c(cccc1C=CCc2ccccc2)O 271570a_200016263579_100011934926 [0,2,0,0,0,0|1,0,1]=4 24173 B18R2.3922 Nc1c(cccc1COCc2ccccc2)Br 34a_100012349457_100015291786 [0,2,0,0,0,0|0,0,0]=2 24174 B18R2.3922 Nc1c(cccc1COCc2ccccc2)Cl 34a_100012182729_100015291786 [0,2,0,0,0,0|0,0,0]=2 24175 B18R2.3922 Nc1c(cccc1COCc2ccccc2)F 34a_100000692437_100015291786 [0,2,0,0,0,0|0,0,0]=2 24176 B18R2.3922 Nc1c(cccc1COCc2ccccn2)Br 34a_100012349457_100000721315 [0,2,0,0,0,0|1,0,0]=3 24177 B18R2.3922 Nc1c(cccc1COCc2ccccn2)Cl 34a_100012182729_100000721315 [0,2,0,0,0,0|1,0,0]=3 24178 B18R2.3922 Nc1c(cccc1COCc2ccccn2)F 34a_100000692437_100000721315 [0,2,0,0,0,0|1,0,0]=3 24179 B18R2.3922 Nc1c(cccc1COCc2cccnc2)Br 34a_100012349457_100000733263 [0,2,0,0,0,0|1,0,0]=3 24180 B18R2.3922 Nc1c(cccc1COCc2cccnc2)Cl 34a_100012182729_100000733263 [0,2,0,0,0,0|1,0,0]=3 24181 B18R2.3922 Nc1c(cccc1COCc2cccnc2)F 34a_100000692437_100000733263 [0,2,0,0,0,0|1,0,0]=3 24182 B18R2.3922 Nc1c(cccc1COCc2cccnn2)Br 34a_100012349457_100016990269 [0,2,0,0,0,0|2,0,0]=4 24183 B18R2.3922 Nc1c(cccc1COCc2cccnn2)Cl 34a_100012182729_100016990269 [0,2,0,0,0,0|2,0,0]=4 24184 B18R2.3922 Nc1c(cccc1COCc2cccnn2)F 34a_100000692437_100016990269 [0,2,0,0,0,0|2,0,0]=4 24185 B18R2.3922 Nc1c(cccc1COCc2cnccn2)Br 34a_100012349457_100016995436 [0,2,0,0,0,0|2,0,0]=4 24186 B18R2.3922 Nc1c(cccc1COCc2cnccn2)Cl 34a_100012182729_100016995436 [0,2,0,0,0,0|2,0,0]=4 24187 B18R2.3922 Nc1c(cccc1COCc2cnccn2)F 34a_100000692437_100016995436 [0,2,0,0,0,0|2,0,0]=4 24188 B18R2.3922 Nc1c(cccc1COCc2cncnc2)Br 34a_100012349457_100015196519 [0,2,0,0,0,0|2,0,0]=4 24189 B18R2.3922 Nc1c(cccc1COCc2cncnc2)Cl 34a_100012182729_100015196519 [0,2,0,0,0,0|2,0,0]=4 24190 B18R2.3922 Nc1c(cccc1COCc2cncnc2)F 34a_100000692437_100015196519 [0,2,0,0,0,0|2,0,0]=4 24191 B18R2.3922 Nc1c(cccc1COCc2ncccn2)Br 34a_100012349457_100000703007 [0,2,0,0,0,0|2,0,0]=4 24192 B18R2.3922 Nc1c(cccc1COCc2ncccn2)Cl 34a_100012182729_100000703007 [0,2,0,0,0,0|2,0,0]=4 24193 B18R2.3922 Nc1c(cccc1COCc2ncccn2)F 34a_100000692437_100000703007 [0,2,0,0,0,0|2,0,0]=4 24194 B18R2.3922 Nc1c(cccc1OCCc2ccccc2)Br 34a_100011934926_100000765856 [0,2,0,0,0,0|2,0,0]=4 24195 B18R2.3922 Nc1c(cccc1OCCc2ccccc2)Br 7a_100011934926_100000765856 [0,2,0,0,0,0|2,0,0]=4 24196 B18R2.3922 Nc1c(cccc1OCCc2ccccc2)Cl 34a_100012022510_100000765856 [0,2,0,0,0,0|2,0,0]=4 24197 B18R2.3922 Nc1c(cccc1OCCc2ccccc2)Cl 7a_100012022510_100000765856 [0,2,0,0,0,0|2,0,0]=4 24198 B18R2.3922 Nc1c(cccc1OCCc2ccccc2)F 34a_100020591140_100000765856 [0,2,0,0,0,0|2,0,0]=4 24199 B18R2.3922 Nc1c(cccc1OCCc2ccccc2)F 7a_100020591140_100000765856 [0,2,0,0,0,0|2,0,0]=4 24200 B18R2.3922 Nc1c(cccc1OCCc2ccccc2)I 34a_200000049512_100000765856 [0,2,0,0,0,0|2,0,0]=4 24201 B18R2.3922 Nc1c(cccc1OCCc2ccccc2)I 7a_200000049512_100000765856 [0,2,0,0,0,0|2,0,0]=4 24202 B18R2.3922 Nc1c(cccc1SCCc2ccccc2)Br 62a_100000765856_100010146558 [0,2,0,0,0,0|2,0,0]=4 24203 B18R2.3922 Nc1c(cccc1SCCc2ccccc2)Br 62a_100010146558_100011218657 [0,2,0,0,0,0|2,0,0]=4 24204 B18R2.3922 Nc1c(cccc1SCCc2ccccc2)Cl 62a_100000765856_100010190421 [0,2,0,0,0,0|2,0,0]=4 24205 B18R2.3922 Nc1c(cccc1SCCc2ccccc2)Cl 62a_100010190421_100011218657 [0,2,0,0,0,0|2,0,0]=4 24206 B18R2.3922 Nc1c(cccc1SCCc2ccccc2)F 62a_100000042321_100011218657 [0,2,0,0,0,0|2,0,0]=4 24207 B18R2.3922 Nc1c(cccc1SCCc2ccccc2)F 62a_100000765856_100000042321 [0,2,0,0,0,0|2,0,0]=4 24208 B18R2.3922 Nc1c(cccc1SCCc2ccccc2)O 62a_100000765856_100011934926 [0,2,0,0,0,0|2,0,0]=4 24209 B18R2.3922 Nc1cccc(c1Br)OCCc2ccccc2 34a_100012183704_100000765856 [0,2,0,0,0,0|2,0,0]=4 24210 B18R2.3922 Nc1cccc(c1Br)OCCc2ccccc2 7a_100012183704_100000765856 [0,2,0,0,0,0|2,0,0]=4 24211 B18R2.3922 Nc1cccc(c1Cl)OCCc2ccccc2 34a_100012002038_100000765856 [0,2,0,0,0,0|2,0,0]=4 24212 B18R2.3922 Nc1cccc(c1Cl)OCCc2ccccc2 7a_100012002038_100000765856 [0,2,0,0,0,0|2,0,0]=4 24213 B18R2.3922 Nc1cccc(c1F)C=CCc2ccccc2 271570a_200016263579_100011935091 [0,2,0,0,0,0|1,0,1]=4 24214 B18R2.3922 Nc1cccc(c1F)COCc2ccccc2 34a_100012023829_100015291786 [0,2,0,0,0,0|0,0,0]=2 24215 B18R2.3922 Nc1cccc(c1F)COCc2ccccn2 34a_100012023829_100000721315 [0,2,0,0,0,0|1,0,0]=3 24216 B18R2.3922 Nc1cccc(c1F)COCc2cccnc2 34a_100012023829_100000733263 [0,2,0,0,0,0|1,0,0]=3 24217 B18R2.3922 Nc1cccc(c1F)COCc2cccnn2 34a_100012023829_100016990269 [0,2,0,0,0,0|2,0,0]=4 24218 B18R2.3922 Nc1cccc(c1F)COCc2cnccn2 34a_100012023829_100016995436 [0,2,0,0,0,0|2,0,0]=4 24219 B18R2.3922 Nc1cccc(c1F)COCc2cncnc2 34a_100012023829_100015196519 [0,2,0,0,0,0|2,0,0]=4 24220 B18R2.3922 Nc1cccc(c1F)COCc2ncccn2 34a_100012023829_100000703007 [0,2,0,0,0,0|2,0,0]=4 24221 B18R2.3922 Nc1cccc(c1F)SCCc2ccccc2 62a_100000765856_100011935091 [0,2,0,0,0,0|2,0,0]=4 24222 B18R2.3922 Nc1cccc(c1F)SCCc2ccccc2 62a_100011935091_100011218657 [0,2,0,0,0,0|2,0,0]=4 24223 B18R2.3922 Nc1cccc(c1N)C=CCc2ccccc2 271570a_200016263579_100015191791 [0,2,0,0,0,0|1,0,1]=4 24224 B18R2.3922 Nc1cccc(c1N)OCCc2ccccc2 34a_100000033209_100000765856 [0,2,0,0,0,0|2,0,0]=4 24225 B18R2.3922 Nc1cccc(c1N)SCCc2ccccc2 62a_100015191791_100011218657 [0,2,0,0,0,0|2,0,0]=4 24226 B18R2.3922 Nc1cccc(c1O)C=CCc2ccccc2 271570a_200016263579_100011934915 [0,2,0,0,0,0|1,0,1]=4 24227 B18R2.3922 Nc1cccc(c1O)SCCc2ccccc2 62a_100000765856_100010084371 [0,2,0,0,0,0|2,0,0]=4 24228 B18R2.3922 Nc1cccc(c1O)SCCc2ccccc2 62a_100011934915_100011218657 [0,2,0,0,0,0|2,0,0]=4 24229 B18R2.3922 Oc1c(cccc1C=CCc2ccccc2)Br 271570a_200016263579_100010084509 [0,2,0,0,0,0|1,0,1]=4 24230 B18R2.3922 Oc1c(cccc1C=CCc2ccccc2)Cl 271570a_200016263579_100010202889 [0,2,0,0,0,0|1,0,1]=4 24231 B18R2.3922 Oc1c(cccc1C=CCc2ccccc2)F 271570a_200016263579_100009813666 [0,2,0,0,0,0|1,0,1]=4 24232 B18R2.3922 Oc1c(cccc1NCCc2ccccc2)Br 34a_100011934915_100000765856 [0,2,0,0,0,0|2,0,0]=4 24233 B18R2.3922 Oc1c(cccc1NCCc2ccccc2)Cl 34a_100000754742_100000765856 [0,2,0,0,0,0|2,0,0]=4 24234 B18R2.3922 Oc1c(cccc1NCCc2ccccc2)F 34a_100011934987_100000765856 [0,2,0,0,0,0|2,0,0]=4 24235 B18R2.3922 Oc1c(cccc1SCCc2ccccc2)Br 62a_100000765856_100010084509 [0,2,0,0,0,0|2,0,0]=4 24236 B18R2.3922 Oc1c(cccc1SCCc2ccccc2)Br 62a_100010084509_100011218657 [0,2,0,0,0,0|2,0,0]=4 24237 B18R2.3922 Oc1c(cccc1SCCc2ccccc2)Cl 62a_100000765856_100010202889 [0,2,0,0,0,0|2,0,0]=4 24238 B18R2.3922 Oc1c(cccc1SCCc2ccccc2)Cl 62a_100010202889_100011218657 [0,2,0,0,0,0|2,0,0]=4 24239 B18R2.3922 Oc1c(cccc1SCCc2ccccc2)F 62a_100000765856_100009813666 [0,2,0,0,0,0|2,0,0]=4 24240 B18R2.3922 Oc1c(cccc1SCCc2ccccc2)F 62a_100009813666_100011218657 [0,2,0,0,0,0|2,0,0]=4 24241 B18R2.3922 Oc1cccc(c1Br)C=CCc2ccccc2 271570a_200016263579_100010187914 [0,2,0,0,0,0|1,0,1]=4 24242 B18R2.3922 Oc1cccc(c1Br)NCCc2ccccc2 34a_100012183704_100000765856 [0,2,0,0,0,0|2,0,0]=4 24243 B18R2.3922 Oc1cccc(c1Br)NCCc2ccccc2 7a_100012183704_100000765856 [0,2,0,0,0,0|2,0,0]=4 24244 B18R2.3922 Oc1cccc(c1Br)SCCc2ccccc2 62a_100000765856_100010187914 [0,2,0,0,0,0|2,0,0]=4 24245 B18R2.3922 Oc1cccc(c1Br)SCCc2ccccc2 62a_100010187914_100011218657 [0,2,0,0,0,0|2,0,0]=4 24246 B18R2.3922 Oc1cccc(c1Cl)C=CCc2ccccc2 271570a_200016263579_100000049636 [0,2,0,0,0,0|1,0,1]=4 24247 B18R2.3922 Oc1cccc(c1Cl)CNCc2ccccc2 270004a_100015324214_100000050521 [0,2,0,0,0,0|1,0,0]=3 24248 B18R2.3922 Oc1cccc(c1Cl)CNCc2ccccn2 270004a_100000210449_100000050521 [0,2,0,0,0,0|2,0,0]=4 24249 B18R2.3922 Oc1cccc(c1Cl)CNCc2cccnc2 270004a_100000210453_100000050521 [0,2,0,0,0,0|2,0,0]=4 24250 B18R2.3922 Oc1cccc(c1Cl)NCCc2ccccc2 34a_100012002038_100000765856 [0,2,0,0,0,0|2,0,0]=4 24251 B18R2.3922 Oc1cccc(c1Cl)NCCc2ccccc2 7a_100012002038_100000765856 [0,2,0,0,0,0|2,0,0]=4 24252 B18R2.3922 Oc1cccc(c1Cl)SCCc2ccccc2 62a_100000765856_100000049636 [0,2,0,0,0,0|2,0,0]=4 24253 B18R2.3922 Oc1cccc(c1F)C=CCc2ccccc2 271570a_200016263579_100009817021 [0,2,0,0,0,0|1,0,1]=4 24254 B18R2.3922 Oc1cccc(c1F)CNCc2ccccc2 270004a_100025773512_100015611070 [0,2,0,0,0,0|1,0,0]=3 24255 B18R2.3922 Oc1cccc(c1F)CNCc2ccccc2 34a_100025773512_100015291786 [0,2,0,0,0,0|1,0,0]=3 24256 B18R2.3922 Oc1cccc(c1F)CNCc2ccccn2 270004a_100025773512_100000209966 [0,2,0,0,0,0|2,0,0]=4 24257 B18R2.3922 Oc1cccc(c1F)CNCc2ccccn2 34a_100025773512_100000721315 [0,2,0,0,0,0|2,0,0]=4 24258 B18R2.3922 Oc1cccc(c1F)CNCc2cccnc2 270004a_100025773512_100000209961 [0,2,0,0,0,0|2,0,0]=4 24259 B18R2.3922 Oc1cccc(c1F)CNCc2cccnc2 34a_100025773512_100000733263 [0,2,0,0,0,0|2,0,0]=4 24260 B18R2.3922 Oc1cccc(c1F)SCCc2ccccc2 62a_100000765856_100009817021 [0,2,0,0,0,0|2,0,0]=4 24261 B18R2.3922 Oc1cccc(c1F)SCCc2ccccc2 62a_100009817021_100011218657 [0,2,0,0,0,0|2,0,0]=4 24262 B18R2.3922 Oc1cccc(c1O)C=CCc2ccccc2 271570a_200016263579_100009815950 [0,2,0,0,0,0|1,0,1]=4 24263 B18R2.3922 Oc1cccc(c1O)SCCc2ccccc2 62a_100000765856_100009815950 [0,2,0,0,0,0|2,0,0]=4 24264 B18R2.6470 Brc1cccc(c1C=CCc2ccccc2)Br 271570a_200016263579_100009994525 [0,2,0,0,0,0|1,0,1]=4 24265 B18R2.6470 Brc1cccc(c1CNCc2ccccc2)Br 207a_100015324214_100010233043 [0,2,0,0,0,0|1,0,0]=3 24266 B18R2.6470 Brc1cccc(c1CNCc2ccccc2)Br 270004a_100015324214_100010233043 [0,2,0,0,0,0|1,0,0]=3 24267 B18R2.6470 Brc1cccc(c1CNCc2ccccc2)I 2230a_100015324214_100010146611 [0,2,0,0,0,0|1,0,0]=3 24268 B18R2.6470 Brc1cccc(c1CNCc2ccccc2)I 34a_100015324214_100010146611 [0,2,0,0,0,0|1,0,0]=3 24269 B18R2.6470 Brc1cccc(c1CNCc2ccccn2)Br 270004a_100000210449_100010233043 [0,2,0,0,0,0|2,0,0]=4 24270 B18R2.6470 Brc1cccc(c1CNCc2cccnc2)Br 207a_100000210453_100010233043 [0,2,0,0,0,0|2,0,0]=4 24271 B18R2.6470 Brc1cccc(c1CNCc2cccnc2)Br 270004a_100000210453_100010233043 [0,2,0,0,0,0|2,0,0]=4 24272 B18R2.6470 Brc1cccc(c1COCc2ccccc2)Br 34a_100010172814_100015291786 [0,2,0,0,0,0|0,0,0]=2 24273 B18R2.6470 Brc1cccc(c1COCc2ccccc2)Br 7a_100010172814_100000211182 [0,2,0,0,0,0|0,0,0]=2 24274 B18R2.6470 Brc1cccc(c1COCc2ccccc2)I 34a_100000210790_100010146611 [0,2,0,0,0,0|0,0,0]=2 24275 B18R2.6470 Brc1cccc(c1COCc2ccccc2)I 7a_100000210790_100010146611 [0,2,0,0,0,0|0,0,0]=2 24276 B18R2.6470 Brc1cccc(c1COCc2ccccn2)Br 34a_100010172814_100000721315 [0,2,0,0,0,0|1,0,0]=3 24277 B18R2.6470 Brc1cccc(c1COCc2ccccn2)Br 7a_100010172814_100000721315 [0,2,0,0,0,0|1,0,0]=3 24278 B18R2.6470 Brc1cccc(c1COCc2cccnc2)Br 34a_100010172814_100000733263 [0,2,0,0,0,0|1,0,0]=3 24279 B18R2.6470 Brc1cccc(c1COCc2cccnc2)Br 7a_100010172814_100000741622 [0,2,0,0,0,0|1,0,0]=3 24280 B18R2.6470 Brc1cccc(c1COCc2cccnn2)Br 34a_100010172814_100016990269 [0,2,0,0,0,0|2,0,0]=4 24281 B18R2.6470 Brc1cccc(c1COCc2cccnn2)Br 7a_100010172814_100016990269 [0,2,0,0,0,0|2,0,0]=4 24282 B18R2.6470 Brc1cccc(c1COCc2ccncc2)Br 7a_100010172814_100015193705 [0,2,0,0,0,0|1,0,0]=3 24283 B18R2.6470 Brc1cccc(c1COCc2cnccn2)Br 34a_100010172814_100016995436 [0,2,0,0,0,0|2,0,0]=4 24284 B18R2.6470 Brc1cccc(c1COCc2cnccn2)Br 7a_100010172814_100016995436 [0,2,0,0,0,0|2,0,0]=4 24285 B18R2.6470 Brc1cccc(c1COCc2cncnc2)Br 34a_100010172814_100015196519 [0,2,0,0,0,0|2,0,0]=4 24286 B18R2.6470 Brc1cccc(c1COCc2cncnc2)Br 7a_100010172814_100015196519 [0,2,0,0,0,0|2,0,0]=4 24287 B18R2.6470 Brc1cccc(c1COCc2ncccn2)Br 34a_100010172814_100000703007 [0,2,0,0,0,0|2,0,0]=4 24288 B18R2.6470 Brc1cccc(c1COCc2ncccn2)Br 7a_100010172814_100000703007 [0,2,0,0,0,0|2,0,0]=4 24289 B18R2.6470 Brc1cccc(c1CSCc2ccccc2)I 62a_100000211182_100010146611 [0,2,0,0,0,0|0,1,0]=3 24290 B18R2.6470 Brc1cccc(c1CSCc2ccccc2)I 62a_100010146611_100015291786 [0,2,0,0,0,0|0,1,0]=3 24291 B18R2.6470 Brc1cccc(c1CSCc2ccccn2)I 62a_100000721315_100010146611 [0,2,0,0,0,0|1,1,0]=4 24292 B18R2.6470 Brc1cccc(c1CSCc2ccccn2)I 62a_100010146611_100000721315 [0,2,0,0,0,0|1,1,0]=4 24293 B18R2.6470 Brc1cccc(c1CSCc2cccnc2)I 62a_100000741622_100010146611 [0,2,0,0,0,0|1,1,0]=4 24294 B18R2.6470 Brc1cccc(c1CSCc2cccnc2)I 62a_100010146611_100000741622 [0,2,0,0,0,0|1,1,0]=4 24295 B18R2.6470 Brc1cccc(c1CSCc2ccncc2)I 62a_100010146611_100015193705 [0,2,0,0,0,0|1,1,0]=4 24296 B18R2.6470 Brc1cccc(c1CSCc2ccncc2)I 62a_100015193705_100010146611 [0,2,0,0,0,0|1,1,0]=4 24297 B18R2.6470 Brc1cccc(c1NCCc2ccccc2)Br 34a_100000690995_100000765856 [0,2,0,0,0,0|2,0,0]=4 24298 B18R2.6470 Brc1cccc(c1OCCc2ccccc2)Br 34a_100000736428_100000765856 [0,2,0,0,0,0|2,0,0]=4 24299 B18R2.6470 Brc1cccc(c1OCCc2ccccc2)Br 7a_100000736428_100000765856 [0,2,0,0,0,0|2,0,0]=4 24300 B18R2.6470 Brc1cccc(c1OCCc2ccccc2)I 34a_100010084509_100000765856 [0,2,0,0,0,0|2,0,0]=4 24301 B18R2.6470 Brc1cccc(c1OCCc2ccccc2)I 7a_100010084509_100000765856 [0,2,0,0,0,0|2,0,0]=4 24302 B18R2.6470 Brc1cccc(c1SCCc2ccccc2)Br 62a_100000765856_100009994525 [0,2,0,0,0,0|2,0,0]=4 24303 B18R2.6470 Brc1cccc(c1SCCc2ccccc2)Br 62a_100009994525_100011218657 [0,2,0,0,0,0|2,0,0]=4 24304 B18R2.6470 Brc1ccnc(c1COCc2ccccc2)Br 34a_200015784018_100015291786 [0,2,0,0,0,0|1,0,0]=3 24305 B18R2.6470 Brc1ccnc(c1COCc2ccccc2)Br 7a_200015784018_100000211182 [0,2,0,0,0,0|1,0,0]=3 24306 B18R2.6470 Brc1ccnc(c1COCc2ccccn2)Br 34a_200015784018_100000721315 [0,2,0,0,0,0|2,0,0]=4 24307 B18R2.6470 Brc1ccnc(c1COCc2ccccn2)Br 7a_200015784018_100000721315 [0,2,0,0,0,0|2,0,0]=4 24308 B18R2.6470 Brc1ccnc(c1COCc2cccnc2)Br 34a_200015784018_100000733263 [0,2,0,0,0,0|2,0,0]=4 24309 B18R2.6470 Brc1ccnc(c1COCc2cccnc2)Br 7a_200015784018_100000741622 [0,2,0,0,0,0|2,0,0]=4 24310 B18R2.6470 Brc1ccnc(c1COCc2ccncc2)Br 7a_200015784018_100015193705 [0,2,0,0,0,0|2,0,0]=4 24311 B18R2.6470 Brc1cncc(c1CNCc2ccccc2)Br 207a_100015324214_100000689152 [0,2,0,0,0,0|2,0,0]=4 24312 B18R2.6470 Brc1cncc(c1CNCc2ccccc2)Br 270004a_100015324214_100000689152 [0,2,0,0,0,0|2,0,0]=4 24313 B18R2.6470 Cc1cccc(c1C=CCc2ccccc2)C 271570a_200016263579_100000033847 [0,2,0,0,0,0|1,0,1]=4 24314 B18R2.6470 Cc1cccc(c1C=CCc2ccccc2)Cl 271570a_200016263579_100000043165 [0,2,0,0,0,0|1,0,1]=4 24315 B18R2.6470 Cc1cccc(c1C=CCc2ccccc2)F 271570a_200016263579_100012349962 [0,2,0,0,0,0|1,0,1]=4 24316 B18R2.6470 Cc1cccc(c1C=CCc2ccccc2)N 271570a_200016263579_100000684715 [0,2,0,0,0,0|1,0,1]=4 24317 B18R2.6470 Cc1cccc(c1C=CCc2ccccc2)O 271570a_200016263579_100000686692 [0,2,0,0,0,0|1,0,1]=4 24318 B18R2.6470 Cc1cccc(c1CNCc2ccccc2)Br 207a_100015324214_100009881667 [0,2,0,0,0,0|1,0,0]=3 24319 B18R2.6470 Cc1cccc(c1CNCc2ccccc2)Br 2230a_100015324214_100010146847 [0,2,0,0,0,0|1,0,0]=3 24320 B18R2.6470 Cc1cccc(c1CNCc2ccccc2)Br 270004a_100015324214_100009881667 [0,2,0,0,0,0|1,0,0]=3 24321 B18R2.6470 Cc1cccc(c1CNCc2ccccc2)Br 34a_100015324214_100010146847 [0,2,0,0,0,0|1,0,0]=3 24322 B18R2.6470 Cc1cccc(c1CNCc2ccccc2)C 207a_100000689800_100015611070 [0,2,0,0,0,0|1,0,0]=3 24323 B18R2.6470 Cc1cccc(c1CNCc2ccccc2)C 207a_100015324214_100000758299 [0,2,0,0,0,0|1,0,0]=3 24324 B18R2.6470 Cc1cccc(c1CNCc2ccccc2)C 2230a_100015324214_100000758300 [0,2,0,0,0,0|1,0,0]=3 24325 B18R2.6470 Cc1cccc(c1CNCc2ccccc2)C 270004a_100000689800_100015611070 [0,2,0,0,0,0|1,0,0]=3 24326 B18R2.6470 Cc1cccc(c1CNCc2ccccc2)C 270004a_100015324214_100000758299 [0,2,0,0,0,0|1,0,0]=3 24327 B18R2.6470 Cc1cccc(c1CNCc2ccccc2)C 34a_100000689800_100015291786 [0,2,0,0,0,0|1,0,0]=3 24328 B18R2.6470 Cc1cccc(c1CNCc2ccccc2)C 34a_100015324214_100000758300 [0,2,0,0,0,0|1,0,0]=3 24329 B18R2.6470 Cc1cccc(c1CNCc2ccccc2)Cl 207a_100015324214_100000041122 [0,2,0,0,0,0|1,0,0]=3 24330 B18R2.6470 Cc1cccc(c1CNCc2ccccc2)Cl 270004a_100015324214_100000041122 [0,2,0,0,0,0|1,0,0]=3 24331 B18R2.6470 Cc1cccc(c1CNCc2ccccc2)F 207a_100000762012_100015611070 [0,2,0,0,0,0|1,0,0]=3 24332 B18R2.6470 Cc1cccc(c1CNCc2ccccc2)F 207a_100015324214_100000069827 [0,2,0,0,0,0|1,0,0]=3 24333 B18R2.6470 Cc1cccc(c1CNCc2ccccc2)F 2230a_100015324214_100009814554 [0,2,0,0,0,0|1,0,0]=3 24334 B18R2.6470 Cc1cccc(c1CNCc2ccccc2)F 270004a_100000762012_100015611070 [0,2,0,0,0,0|1,0,0]=3 24335 B18R2.6470 Cc1cccc(c1CNCc2ccccc2)F 270004a_100015324214_100000069827 [0,2,0,0,0,0|1,0,0]=3 24336 B18R2.6470 Cc1cccc(c1CNCc2ccccc2)F 34a_100000762012_100015291786 [0,2,0,0,0,0|1,0,0]=3 24337 B18R2.6470 Cc1cccc(c1CNCc2ccccc2)F 34a_100015324214_100009814554 [0,2,0,0,0,0|1,0,0]=3 24338 B18R2.6470 Cc1cccc(c1CNCc2ccccc2)I 2230a_100015324214_100010150146 [0,2,0,0,0,0|1,0,0]=3 24339 B18R2.6470 Cc1cccc(c1CNCc2ccccc2)I 34a_100015324214_100010150146 [0,2,0,0,0,0|1,0,0]=3 24340 B18R2.6470 Cc1cccc(c1CNCc2ccccn2)Br 270004a_100000210449_100009881667 [0,2,0,0,0,0|2,0,0]=4 24341 B18R2.6470 Cc1cccc(c1CNCc2ccccn2)C 207a_100000689800_100000209966 [0,2,0,0,0,0|2,0,0]=4 24342 B18R2.6470 Cc1cccc(c1CNCc2ccccn2)C 270004a_100000210449_100000758299 [0,2,0,0,0,0|2,0,0]=4 24343 B18R2.6470 Cc1cccc(c1CNCc2ccccn2)C 270004a_100000689800_100000209966 [0,2,0,0,0,0|2,0,0]=4 24344 B18R2.6470 Cc1cccc(c1CNCc2ccccn2)C 34a_100000689800_100000721315 [0,2,0,0,0,0|2,0,0]=4 24345 B18R2.6470 Cc1cccc(c1CNCc2ccccn2)Cl 270004a_100000210449_100000041122 [0,2,0,0,0,0|2,0,0]=4 24346 B18R2.6470 Cc1cccc(c1CNCc2ccccn2)F 207a_100000762012_100000209966 [0,2,0,0,0,0|2,0,0]=4 24347 B18R2.6470 Cc1cccc(c1CNCc2ccccn2)F 270004a_100000210449_100000069827 [0,2,0,0,0,0|2,0,0]=4 24348 B18R2.6470 Cc1cccc(c1CNCc2ccccn2)F 270004a_100000762012_100000209966 [0,2,0,0,0,0|2,0,0]=4 24349 B18R2.6470 Cc1cccc(c1CNCc2ccccn2)F 34a_100000762012_100000721315 [0,2,0,0,0,0|2,0,0]=4 24350 B18R2.6470 Cc1cccc(c1CNCc2cccnc2)Br 207a_100000210453_100009881667 [0,2,0,0,0,0|2,0,0]=4 24351 B18R2.6470 Cc1cccc(c1CNCc2cccnc2)Br 270004a_100000210453_100009881667 [0,2,0,0,0,0|2,0,0]=4 24352 B18R2.6470 Cc1cccc(c1CNCc2cccnc2)C 207a_100000210453_100000758299 [0,2,0,0,0,0|2,0,0]=4 24353 B18R2.6470 Cc1cccc(c1CNCc2cccnc2)C 207a_100000689800_100000209961 [0,2,0,0,0,0|2,0,0]=4 24354 B18R2.6470 Cc1cccc(c1CNCc2cccnc2)C 270004a_100000210453_100000758299 [0,2,0,0,0,0|2,0,0]=4 24355 B18R2.6470 Cc1cccc(c1CNCc2cccnc2)C 270004a_100000689800_100000209961 [0,2,0,0,0,0|2,0,0]=4 24356 B18R2.6470 Cc1cccc(c1CNCc2cccnc2)C 34a_100000689800_100000733263 [0,2,0,0,0,0|2,0,0]=4 24357 B18R2.6470 Cc1cccc(c1CNCc2cccnc2)Cl 207a_100000210453_100000041122 [0,2,0,0,0,0|2,0,0]=4 24358 B18R2.6470 Cc1cccc(c1CNCc2cccnc2)Cl 270004a_100000210453_100000041122 [0,2,0,0,0,0|2,0,0]=4 24359 B18R2.6470 Cc1cccc(c1CNCc2cccnc2)F 207a_100000210453_100000069827 [0,2,0,0,0,0|2,0,0]=4 24360 B18R2.6470 Cc1cccc(c1CNCc2cccnc2)F 207a_100000762012_100000209961 [0,2,0,0,0,0|2,0,0]=4 24361 B18R2.6470 Cc1cccc(c1CNCc2cccnc2)F 270004a_100000210453_100000069827 [0,2,0,0,0,0|2,0,0]=4 24362 B18R2.6470 Cc1cccc(c1CNCc2cccnc2)F 270004a_100000762012_100000209961 [0,2,0,0,0,0|2,0,0]=4 24363 B18R2.6470 Cc1cccc(c1CNCc2cccnc2)F 34a_100000762012_100000733263 [0,2,0,0,0,0|2,0,0]=4 24364 B18R2.6470 Cc1cccc(c1CNCc2ccncc2)C 207a_100000689800_100000186114 [0,2,0,0,0,0|2,0,0]=4 24365 B18R2.6470 Cc1cccc(c1CNCc2ccncc2)F 207a_100000762012_100000186114 [0,2,0,0,0,0|2,0,0]=4 24366 B18R2.6470 Cc1cccc(c1COCc2ccccc2)Br 34a_100000210790_100010146847 [0,2,0,0,0,0|0,0,0]=2 24367 B18R2.6470 Cc1cccc(c1COCc2ccccc2)Br 7a_100000210790_100010146847 [0,2,0,0,0,0|0,0,0]=2 24368 B18R2.6470 Cc1cccc(c1COCc2ccccc2)C 34a_100000210790_100000758300 [0,2,0,0,0,0|0,0,0]=2 24369 B18R2.6470 Cc1cccc(c1COCc2ccccc2)C 34a_100011933981_100015291786 [0,2,0,0,0,0|0,0,0]=2 24370 B18R2.6470 Cc1cccc(c1COCc2ccccc2)C 7a_100000210790_100000758300 [0,2,0,0,0,0|0,0,0]=2 24371 B18R2.6470 Cc1cccc(c1COCc2ccccc2)C 7a_100011933981_100000211182 [0,2,0,0,0,0|0,0,0]=2 24372 B18R2.6470 Cc1cccc(c1COCc2ccccc2)Cl 34a_100000082531_100015291786 [0,2,0,0,0,0|0,0,0]=2 24373 B18R2.6470 Cc1cccc(c1COCc2ccccc2)Cl 7a_100000082531_100000211182 [0,2,0,0,0,0|0,0,0]=2 24374 B18R2.6470 Cc1cccc(c1COCc2ccccc2)F 34a_100000057874_100015291786 [0,2,0,0,0,0|0,0,0]=2 24375 B18R2.6470 Cc1cccc(c1COCc2ccccc2)F 34a_100000210790_100009814554 [0,2,0,0,0,0|0,0,0]=2 24376 B18R2.6470 Cc1cccc(c1COCc2ccccc2)F 7a_100000057874_100000211182 [0,2,0,0,0,0|0,0,0]=2 24377 B18R2.6470 Cc1cccc(c1COCc2ccccc2)F 7a_100000210790_100009814554 [0,2,0,0,0,0|0,0,0]=2 24378 B18R2.6470 Cc1cccc(c1COCc2ccccc2)I 34a_100000210790_100010150146 [0,2,0,0,0,0|0,0,0]=2 24379 B18R2.6470 Cc1cccc(c1COCc2ccccc2)I 7a_100000210790_100010150146 [0,2,0,0,0,0|0,0,0]=2 24380 B18R2.6470 Cc1cccc(c1COCc2ccccn2)C 34a_100011933981_100000721315 [0,2,0,0,0,0|1,0,0]=3 24381 B18R2.6470 Cc1cccc(c1COCc2ccccn2)C 7a_100011933981_100000721315 [0,2,0,0,0,0|1,0,0]=3 24382 B18R2.6470 Cc1cccc(c1COCc2ccccn2)Cl 34a_100000082531_100000721315 [0,2,0,0,0,0|1,0,0]=3 24383 B18R2.6470 Cc1cccc(c1COCc2ccccn2)Cl 7a_100000082531_100000721315 [0,2,0,0,0,0|1,0,0]=3 24384 B18R2.6470 Cc1cccc(c1COCc2ccccn2)F 34a_100000057874_100000721315 [0,2,0,0,0,0|1,0,0]=3 24385 B18R2.6470 Cc1cccc(c1COCc2ccccn2)F 7a_100000057874_100000721315 [0,2,0,0,0,0|1,0,0]=3 24386 B18R2.6470 Cc1cccc(c1COCc2cccnc2)C 34a_100011933981_100000733263 [0,2,0,0,0,0|1,0,0]=3 24387 B18R2.6470 Cc1cccc(c1COCc2cccnc2)C 7a_100011933981_100000741622 [0,2,0,0,0,0|1,0,0]=3 24388 B18R2.6470 Cc1cccc(c1COCc2cccnc2)Cl 34a_100000082531_100000733263 [0,2,0,0,0,0|1,0,0]=3 24389 B18R2.6470 Cc1cccc(c1COCc2cccnc2)Cl 7a_100000082531_100000741622 [0,2,0,0,0,0|1,0,0]=3 24390 B18R2.6470 Cc1cccc(c1COCc2cccnc2)F 34a_100000057874_100000733263 [0,2,0,0,0,0|1,0,0]=3 24391 B18R2.6470 Cc1cccc(c1COCc2cccnc2)F 7a_100000057874_100000741622 [0,2,0,0,0,0|1,0,0]=3 24392 B18R2.6470 Cc1cccc(c1COCc2cccnn2)C 34a_100011933981_100016990269 [0,2,0,0,0,0|2,0,0]=4 24393 B18R2.6470 Cc1cccc(c1COCc2cccnn2)C 7a_100011933981_100016990269 [0,2,0,0,0,0|2,0,0]=4 24394 B18R2.6470 Cc1cccc(c1COCc2cccnn2)Cl 34a_100000082531_100016990269 [0,2,0,0,0,0|2,0,0]=4 24395 B18R2.6470 Cc1cccc(c1COCc2cccnn2)Cl 7a_100000082531_100016990269 [0,2,0,0,0,0|2,0,0]=4 24396 B18R2.6470 Cc1cccc(c1COCc2cccnn2)F 34a_100000057874_100016990269 [0,2,0,0,0,0|2,0,0]=4 24397 B18R2.6470 Cc1cccc(c1COCc2cccnn2)F 7a_100000057874_100016990269 [0,2,0,0,0,0|2,0,0]=4 24398 B18R2.6470 Cc1cccc(c1COCc2ccncc2)C 7a_100011933981_100015193705 [0,2,0,0,0,0|1,0,0]=3 24399 B18R2.6470 Cc1cccc(c1COCc2ccncc2)Cl 7a_100000082531_100015193705 [0,2,0,0,0,0|1,0,0]=3 24400 B18R2.6470 Cc1cccc(c1COCc2ccncc2)F 7a_100000057874_100015193705 [0,2,0,0,0,0|1,0,0]=3 24401 B18R2.6470 Cc1cccc(c1COCc2cnccn2)C 34a_100011933981_100016995436 [0,2,0,0,0,0|2,0,0]=4 24402 B18R2.6470 Cc1cccc(c1COCc2cnccn2)C 7a_100011933981_100016995436 [0,2,0,0,0,0|2,0,0]=4 24403 B18R2.6470 Cc1cccc(c1COCc2cnccn2)Cl 34a_100000082531_100016995436 [0,2,0,0,0,0|2,0,0]=4 24404 B18R2.6470 Cc1cccc(c1COCc2cnccn2)Cl 7a_100000082531_100016995436 [0,2,0,0,0,0|2,0,0]=4 24405 B18R2.6470 Cc1cccc(c1COCc2cnccn2)F 34a_100000057874_100016995436 [0,2,0,0,0,0|2,0,0]=4 24406 B18R2.6470 Cc1cccc(c1COCc2cnccn2)F 7a_100000057874_100016995436 [0,2,0,0,0,0|2,0,0]=4 24407 B18R2.6470 Cc1cccc(c1COCc2cncnc2)C 34a_100011933981_100015196519 [0,2,0,0,0,0|2,0,0]=4 24408 B18R2.6470 Cc1cccc(c1COCc2cncnc2)C 7a_100011933981_100015196519 [0,2,0,0,0,0|2,0,0]=4 24409 B18R2.6470 Cc1cccc(c1COCc2cncnc2)Cl 34a_100000082531_100015196519 [0,2,0,0,0,0|2,0,0]=4 24410 B18R2.6470 Cc1cccc(c1COCc2cncnc2)Cl 7a_100000082531_100015196519 [0,2,0,0,0,0|2,0,0]=4 24411 B18R2.6470 Cc1cccc(c1COCc2cncnc2)F 34a_100000057874_100015196519 [0,2,0,0,0,0|2,0,0]=4 24412 B18R2.6470 Cc1cccc(c1COCc2cncnc2)F 7a_100000057874_100015196519 [0,2,0,0,0,0|2,0,0]=4 24413 B18R2.6470 Cc1cccc(c1COCc2ncccn2)C 34a_100011933981_100000703007 [0,2,0,0,0,0|2,0,0]=4 24414 B18R2.6470 Cc1cccc(c1COCc2ncccn2)C 7a_100011933981_100000703007 [0,2,0,0,0,0|2,0,0]=4 24415 B18R2.6470 Cc1cccc(c1COCc2ncccn2)Cl 34a_100000082531_100000703007 [0,2,0,0,0,0|2,0,0]=4 24416 B18R2.6470 Cc1cccc(c1COCc2ncccn2)Cl 7a_100000082531_100000703007 [0,2,0,0,0,0|2,0,0]=4 24417 B18R2.6470 Cc1cccc(c1COCc2ncccn2)F 34a_100000057874_100000703007 [0,2,0,0,0,0|2,0,0]=4 24418 B18R2.6470 Cc1cccc(c1COCc2ncccn2)F 7a_100000057874_100000703007 [0,2,0,0,0,0|2,0,0]=4 24419 B18R2.6470 Cc1cccc(c1CSCc2ccccc2)Br 62a_100000211182_100010146847 [0,2,0,0,0,0|0,1,0]=3 24420 B18R2.6470 Cc1cccc(c1CSCc2ccccc2)Br 62a_100010146847_100015291786 [0,2,0,0,0,0|0,1,0]=3 24421 B18R2.6470 Cc1cccc(c1CSCc2ccccc2)C 62a_100000211182_100000758300 [0,2,0,0,0,0|0,1,0]=3 24422 B18R2.6470 Cc1cccc(c1CSCc2ccccc2)C 62a_100000758300_100015291786 [0,2,0,0,0,0|0,1,0]=3 24423 B18R2.6470 Cc1cccc(c1CSCc2ccccc2)F 62a_100000211182_100009814554 [0,2,0,0,0,0|0,1,0]=3 24424 B18R2.6470 Cc1cccc(c1CSCc2ccccc2)F 62a_100009814554_100015291786 [0,2,0,0,0,0|0,1,0]=3 24425 B18R2.6470 Cc1cccc(c1CSCc2ccccc2)I 62a_100000211182_100010150146 [0,2,0,0,0,0|0,1,0]=3 24426 B18R2.6470 Cc1cccc(c1CSCc2ccccc2)I 62a_100010150146_100015291786 [0,2,0,0,0,0|0,1,0]=3 24427 B18R2.6470 Cc1cccc(c1CSCc2ccccn2)Br 62a_100000721315_100010146847 [0,2,0,0,0,0|1,1,0]=4 24428 B18R2.6470 Cc1cccc(c1CSCc2ccccn2)Br 62a_100010146847_100000721315 [0,2,0,0,0,0|1,1,0]=4 24429 B18R2.6470 Cc1cccc(c1CSCc2ccccn2)C 62a_100000721315_100000758300 [0,2,0,0,0,0|1,1,0]=4 24430 B18R2.6470 Cc1cccc(c1CSCc2ccccn2)C 62a_100000758300_100000721315 [0,2,0,0,0,0|1,1,0]=4 24431 B18R2.6470 Cc1cccc(c1CSCc2ccccn2)F 62a_100000721315_100009814554 [0,2,0,0,0,0|1,1,0]=4 24432 B18R2.6470 Cc1cccc(c1CSCc2ccccn2)F 62a_100009814554_100000721315 [0,2,0,0,0,0|1,1,0]=4 24433 B18R2.6470 Cc1cccc(c1CSCc2ccccn2)I 62a_100000721315_100010150146 [0,2,0,0,0,0|1,1,0]=4 24434 B18R2.6470 Cc1cccc(c1CSCc2ccccn2)I 62a_100010150146_100000721315 [0,2,0,0,0,0|1,1,0]=4 24435 B18R2.6470 Cc1cccc(c1CSCc2cccnc2)Br 62a_100000741622_100010146847 [0,2,0,0,0,0|1,1,0]=4 24436 B18R2.6470 Cc1cccc(c1CSCc2cccnc2)Br 62a_100010146847_100000741622 [0,2,0,0,0,0|1,1,0]=4 24437 B18R2.6470 Cc1cccc(c1CSCc2cccnc2)C 62a_100000741622_100000758300 [0,2,0,0,0,0|1,1,0]=4 24438 B18R2.6470 Cc1cccc(c1CSCc2cccnc2)C 62a_100000758300_100000741622 [0,2,0,0,0,0|1,1,0]=4 24439 B18R2.6470 Cc1cccc(c1CSCc2cccnc2)F 62a_100000741622_100009814554 [0,2,0,0,0,0|1,1,0]=4 24440 B18R2.6470 Cc1cccc(c1CSCc2cccnc2)F 62a_100009814554_100000741622 [0,2,0,0,0,0|1,1,0]=4 24441 B18R2.6470 Cc1cccc(c1CSCc2cccnc2)I 62a_100000741622_100010150146 [0,2,0,0,0,0|1,1,0]=4 24442 B18R2.6470 Cc1cccc(c1CSCc2cccnc2)I 62a_100010150146_100000741622 [0,2,0,0,0,0|1,1,0]=4 24443 B18R2.6470 Cc1cccc(c1CSCc2ccncc2)Br 62a_100010146847_100015193705 [0,2,0,0,0,0|1,1,0]=4 24444 B18R2.6470 Cc1cccc(c1CSCc2ccncc2)Br 62a_100015193705_100010146847 [0,2,0,0,0,0|1,1,0]=4 24445 B18R2.6470 Cc1cccc(c1CSCc2ccncc2)C 62a_100000758300_100015193705 [0,2,0,0,0,0|1,1,0]=4 24446 B18R2.6470 Cc1cccc(c1CSCc2ccncc2)C 62a_100015193705_100000758300 [0,2,0,0,0,0|1,1,0]=4 24447 B18R2.6470 Cc1cccc(c1CSCc2ccncc2)F 62a_100009814554_100015193705 [0,2,0,0,0,0|1,1,0]=4 24448 B18R2.6470 Cc1cccc(c1CSCc2ccncc2)F 62a_100015193705_100009814554 [0,2,0,0,0,0|1,1,0]=4 24449 B18R2.6470 Cc1cccc(c1CSCc2ccncc2)I 62a_100010150146_100015193705 [0,2,0,0,0,0|1,1,0]=4 24450 B18R2.6470 Cc1cccc(c1CSCc2ccncc2)I 62a_100015193705_100010150146 [0,2,0,0,0,0|1,1,0]=4 24451 B18R2.6470 Cc1cccc(c1NCCc2ccccc2)Br 34a_100011834072_100000765856 [0,2,0,0,0,0|2,0,0]=4 24452 B18R2.6470 Cc1cccc(c1NCCc2ccccc2)C 34a_100000185769_100000765856 [0,2,0,0,0,0|2,0,0]=4 24453 B18R2.6470 Cc1cccc(c1NCCc2ccccc2)Cl 34a_100000756524_100000765856 [0,2,0,0,0,0|2,0,0]=4 24454 B18R2.6470 Cc1cccc(c1NCCc2ccccc2)F 34a_100000766463_100000765856 [0,2,0,0,0,0|2,0,0]=4 24455 B18R2.6470 Cc1cccc(c1NCCc2ccccc2)O 34a_100000743429_100000765856 [0,2,0,0,0,0|2,0,0]=4 24456 B18R2.6470 Cc1cccc(c1OCCc2ccccc2)Br 34a_100009817157_100000765856 [0,2,0,0,0,0|2,0,0]=4 24457 B18R2.6470 Cc1cccc(c1OCCc2ccccc2)Br 7a_100009817157_100000765856 [0,2,0,0,0,0|2,0,0]=4 24458 B18R2.6470 Cc1cccc(c1OCCc2ccccc2)C 34a_100000210341_100000765856 [0,2,0,0,0,0|2,0,0]=4 24459 B18R2.6470 Cc1cccc(c1OCCc2ccccc2)C 7a_100000210341_100000765856 [0,2,0,0,0,0|2,0,0]=4 24460 B18R2.6470 Cc1cccc(c1OCCc2ccccc2)Cl 34a_100000033731_100000765856 [0,2,0,0,0,0|2,0,0]=4 24461 B18R2.6470 Cc1cccc(c1OCCc2ccccc2)Cl 7a_100000033731_100000765856 [0,2,0,0,0,0|2,0,0]=4 24462 B18R2.6470 Cc1cccc(c1OCCc2ccccc2)F 34a_100011659162_100000765856 [0,2,0,0,0,0|2,0,0]=4 24463 B18R2.6470 Cc1cccc(c1OCCc2ccccc2)F 7a_100011659162_100000765856 [0,2,0,0,0,0|2,0,0]=4 24464 B18R2.6470 Cc1cccc(c1OCCc2ccccc2)N 34a_100000756359_100000765856 [0,2,0,0,0,0|2,0,0]=4 24465 B18R2.6470 Cc1cccc(c1OCCc2ccccc2)N 7a_100000756359_100000765856 [0,2,0,0,0,0|2,0,0]=4 24466 B18R2.6470 Cc1cccc(c1SCCc2ccccc2)Br 62a_100000765856_100010141302 [0,2,0,0,0,0|2,0,0]=4 24467 B18R2.6470 Cc1cccc(c1SCCc2ccccc2)Br 62a_100010141302_100011218657 [0,2,0,0,0,0|2,0,0]=4 24468 B18R2.6470 Cc1cccc(c1SCCc2ccccc2)C 62a_100000033847_100011218657 [0,2,0,0,0,0|2,0,0]=4 24469 B18R2.6470 Cc1cccc(c1SCCc2ccccc2)C 62a_100000765856_100000033847 [0,2,0,0,0,0|2,0,0]=4 24470 B18R2.6470 Cc1cccc(c1SCCc2ccccc2)Cl 62a_100000043165_100011218657 [0,2,0,0,0,0|2,0,0]=4 24471 B18R2.6470 Cc1cccc(c1SCCc2ccccc2)Cl 62a_100000765856_100000043165 [0,2,0,0,0,0|2,0,0]=4 24472 B18R2.6470 Cc1cccc(c1SCCc2ccccc2)F 62a_100000765856_100011218421 [0,2,0,0,0,0|2,0,0]=4 24473 B18R2.6470 Cc1cccc(c1SCCc2ccccc2)F 62a_100011218421_100011218657 [0,2,0,0,0,0|2,0,0]=4 24474 B18R2.6470 Cc1cccc(c1SCCc2ccccc2)N 62a_100000684715_100011218657 [0,2,0,0,0,0|2,0,0]=4 24475 B18R2.6470 Cc1cccc(c1SCCc2ccccc2)N 62a_100000765856_100000684715 [0,2,0,0,0,0|2,0,0]=4 24476 B18R2.6470 Cc1cccc(c1SCCc2ccccc2)O 62a_100000686692_100011218657 [0,2,0,0,0,0|2,0,0]=4 24477 B18R2.6470 Cc1cccc(c1SCCc2ccccc2)O 62a_100000765856_100000686692 [0,2,0,0,0,0|2,0,0]=4 24478 B18R2.6470 Cc1ccnc(c1CNCc2ccccc2)F 207a_100015324214_100000087869 [0,2,0,0,0,0|2,0,0]=4 24479 B18R2.6470 Clc1cccc(c1C=CCc2ccccc2)Br 271570a_200016263579_100010214488 [0,2,0,0,0,0|1,0,1]=4 24480 B18R2.6470 Clc1cccc(c1C=CCc2ccccc2)Cl 271570a_200016263579_100000034237 [0,2,0,0,0,0|1,0,1]=4 24481 B18R2.6470 Clc1cccc(c1CCNc2ccccc2)Cl 34a_100000106764_100012161200 [0,2,0,0,0,0|2,0,0]=4 24482 B18R2.6470 Clc1cccc(c1CCOc2ccccc2)Cl 34a_100000210340_100012161200 [0,2,0,0,0,0|2,0,0]=4 24483 B18R2.6470 Clc1cccc(c1CCOc2ccccc2)Cl 7a_100000210340_100012161200 [0,2,0,0,0,0|2,0,0]=4 24484 B18R2.6470 Clc1cccc(c1CCSc2ccccc2)Cl 62a_100000719477_100012161200 [0,2,0,0,0,0|2,0,0]=4 24485 B18R2.6470 Clc1cccc(c1CCSc2ccccc2)Cl 62a_100012161200_100000041952 [0,2,0,0,0,0|2,0,0]=4 24486 B18R2.6470 Clc1cccc(c1CNCc2ccccc2)Br 207a_100015324214_100011249081 [0,2,0,0,0,0|1,0,0]=3 24487 B18R2.6470 Clc1cccc(c1CNCc2ccccc2)Br 2230a_100015324214_100010138402 [0,2,0,0,0,0|1,0,0]=3 24488 B18R2.6470 Clc1cccc(c1CNCc2ccccc2)Br 270004a_100015324214_100011249081 [0,2,0,0,0,0|1,0,0]=3 24489 B18R2.6470 Clc1cccc(c1CNCc2ccccc2)Br 34a_100015324214_100010138402 [0,2,0,0,0,0|1,0,0]=3 24490 B18R2.6470 Clc1cccc(c1CNCc2ccccc2)Cl 207a_100000174884_100015611070 [0,2,0,0,0,0|1,0,0]=3 24491 B18R2.6470 Clc1cccc(c1CNCc2ccccc2)Cl 207a_100015324214_100000189306 [0,2,0,0,0,0|1,0,0]=3 24492 B18R2.6470 Clc1cccc(c1CNCc2ccccc2)Cl 2230a_100000174884_100015291786 [0,2,0,0,0,0|1,0,0]=3 24493 B18R2.6470 Clc1cccc(c1CNCc2ccccc2)Cl 2230a_100015324214_100000187851 [0,2,0,0,0,0|1,0,0]=3 24494 B18R2.6470 Clc1cccc(c1CNCc2ccccc2)Cl 270004a_100000174884_100015611070 [0,2,0,0,0,0|1,0,0]=3 24495 B18R2.6470 Clc1cccc(c1CNCc2ccccc2)Cl 270004a_100015324214_100000189306 [0,2,0,0,0,0|1,0,0]=3 24496 B18R2.6470 Clc1cccc(c1CNCc2ccccc2)Cl 34a_100000174884_100015291786 [0,2,0,0,0,0|1,0,0]=3 24497 B18R2.6470 Clc1cccc(c1CNCc2ccccc2)Cl 34a_100015324214_100000187851 [0,2,0,0,0,0|1,0,0]=3 24498 B18R2.6470 Clc1cccc(c1CNCc2ccccc2)I 207a_100015324214_100010147682 [0,2,0,0,0,0|1,0,0]=3 24499 B18R2.6470 Clc1cccc(c1CNCc2ccccc2)I 270004a_100015324214_100010147682 [0,2,0,0,0,0|1,0,0]=3 24500 B18R2.6470 Clc1cccc(c1CNCc2ccccn2)Br 270004a_100000210449_100011249081 [0,2,0,0,0,0|2,0,0]=4 24501 B18R2.6470 Clc1cccc(c1CNCc2ccccn2)Cl 207a_100000174884_100000209966 [0,2,0,0,0,0|2,0,0]=4 24502 B18R2.6470 Clc1cccc(c1CNCc2ccccn2)Cl 2230a_100000174884_100000721315 [0,2,0,0,0,0|2,0,0]=4 24503 B18R2.6470 Clc1cccc(c1CNCc2ccccn2)Cl 270004a_100000174884_100000209966 [0,2,0,0,0,0|2,0,0]=4 24504 B18R2.6470 Clc1cccc(c1CNCc2ccccn2)Cl 270004a_100000210449_100000189306 [0,2,0,0,0,0|2,0,0]=4 24505 B18R2.6470 Clc1cccc(c1CNCc2ccccn2)Cl 34a_100000174884_100000721315 [0,2,0,0,0,0|2,0,0]=4 24506 B18R2.6470 Clc1cccc(c1CNCc2ccccn2)I 270004a_100000210449_100010147682 [0,2,0,0,0,0|2,0,0]=4 24507 B18R2.6470 Clc1cccc(c1CNCc2cccnc2)Br 207a_100000210453_100011249081 [0,2,0,0,0,0|2,0,0]=4 24508 B18R2.6470 Clc1cccc(c1CNCc2cccnc2)Br 270004a_100000210453_100011249081 [0,2,0,0,0,0|2,0,0]=4 24509 B18R2.6470 Clc1cccc(c1CNCc2cccnc2)Cl 207a_100000174884_100000209961 [0,2,0,0,0,0|2,0,0]=4 24510 B18R2.6470 Clc1cccc(c1CNCc2cccnc2)Cl 207a_100000210453_100000189306 [0,2,0,0,0,0|2,0,0]=4 24511 B18R2.6470 Clc1cccc(c1CNCc2cccnc2)Cl 2230a_100000174884_100000741622 [0,2,0,0,0,0|2,0,0]=4 24512 B18R2.6470 Clc1cccc(c1CNCc2cccnc2)Cl 270004a_100000174884_100000209961 [0,2,0,0,0,0|2,0,0]=4 24513 B18R2.6470 Clc1cccc(c1CNCc2cccnc2)Cl 270004a_100000210453_100000189306 [0,2,0,0,0,0|2,0,0]=4 24514 B18R2.6470 Clc1cccc(c1CNCc2cccnc2)Cl 34a_100000174884_100000733263 [0,2,0,0,0,0|2,0,0]=4 24515 B18R2.6470 Clc1cccc(c1CNCc2cccnc2)I 207a_100000210453_100010147682 [0,2,0,0,0,0|2,0,0]=4 24516 B18R2.6470 Clc1cccc(c1CNCc2cccnc2)I 270004a_100000210453_100010147682 [0,2,0,0,0,0|2,0,0]=4 24517 B18R2.6470 Clc1cccc(c1CNCc2ccncc2)Cl 207a_100000174884_100000186114 [0,2,0,0,0,0|2,0,0]=4 24518 B18R2.6470 Clc1cccc(c1CNCc2ccncc2)Cl 2230a_100000174884_100015193705 [0,2,0,0,0,0|2,0,0]=4 24519 B18R2.6470 Clc1cccc(c1COCc2ccccc2)Br 34a_100000210790_100010138402 [0,2,0,0,0,0|0,0,0]=2 24520 B18R2.6470 Clc1cccc(c1COCc2ccccc2)Br 7a_100000210790_100010138402 [0,2,0,0,0,0|0,0,0]=2 24521 B18R2.6470 Clc1cccc(c1COCc2ccccc2)Cl 34a_100000210790_100000187851 [0,2,0,0,0,0|0,0,0]=2 24522 B18R2.6470 Clc1cccc(c1COCc2ccccc2)Cl 34a_100000215722_100015291786 [0,2,0,0,0,0|0,0,0]=2 24523 B18R2.6470 Clc1cccc(c1COCc2ccccc2)Cl 7a_100000210790_100000187851 [0,2,0,0,0,0|0,0,0]=2 24524 B18R2.6470 Clc1cccc(c1COCc2ccccc2)Cl 7a_100000215722_100000211182 [0,2,0,0,0,0|0,0,0]=2 24525 B18R2.6470 Clc1cccc(c1COCc2ccccn2)Cl 34a_100000215722_100000721315 [0,2,0,0,0,0|1,0,0]=3 24526 B18R2.6470 Clc1cccc(c1COCc2ccccn2)Cl 7a_100000215722_100000721315 [0,2,0,0,0,0|1,0,0]=3 24527 B18R2.6470 Clc1cccc(c1COCc2cccnc2)Cl 34a_100000215722_100000733263 [0,2,0,0,0,0|1,0,0]=3 24528 B18R2.6470 Clc1cccc(c1COCc2cccnc2)Cl 7a_100000215722_100000741622 [0,2,0,0,0,0|1,0,0]=3 24529 B18R2.6470 Clc1cccc(c1COCc2cccnn2)Cl 34a_100000215722_100016990269 [0,2,0,0,0,0|2,0,0]=4 24530 B18R2.6470 Clc1cccc(c1COCc2cccnn2)Cl 7a_100000215722_100016990269 [0,2,0,0,0,0|2,0,0]=4 24531 B18R2.6470 Clc1cccc(c1COCc2ccncc2)Cl 7a_100000215722_100015193705 [0,2,0,0,0,0|1,0,0]=3 24532 B18R2.6470 Clc1cccc(c1COCc2cnccn2)Cl 34a_100000215722_100016995436 [0,2,0,0,0,0|2,0,0]=4 24533 B18R2.6470 Clc1cccc(c1COCc2cnccn2)Cl 7a_100000215722_100016995436 [0,2,0,0,0,0|2,0,0]=4 24534 B18R2.6470 Clc1cccc(c1COCc2cncnc2)Cl 34a_100000215722_100015196519 [0,2,0,0,0,0|2,0,0]=4 24535 B18R2.6470 Clc1cccc(c1COCc2cncnc2)Cl 7a_100000215722_100015196519 [0,2,0,0,0,0|2,0,0]=4 24536 B18R2.6470 Clc1cccc(c1COCc2ncccn2)Cl 34a_100000215722_100000703007 [0,2,0,0,0,0|2,0,0]=4 24537 B18R2.6470 Clc1cccc(c1COCc2ncccn2)Cl 7a_100000215722_100000703007 [0,2,0,0,0,0|2,0,0]=4 24538 B18R2.6470 Clc1cccc(c1CSCc2ccccc2)Br 62a_100000211182_100010138402 [0,2,0,0,0,0|0,1,0]=3 24539 B18R2.6470 Clc1cccc(c1CSCc2ccccc2)Br 62a_100010138402_100015291786 [0,2,0,0,0,0|0,1,0]=3 24540 B18R2.6470 Clc1cccc(c1CSCc2ccccc2)Cl 62a_100000187851_100015291786 [0,2,0,0,0,0|0,1,0]=3 24541 B18R2.6470 Clc1cccc(c1CSCc2ccccc2)Cl 62a_100000211182_100000187851 [0,2,0,0,0,0|0,1,0]=3 24542 B18R2.6470 Clc1cccc(c1CSCc2ccccn2)Br 62a_100000721315_100010138402 [0,2,0,0,0,0|1,1,0]=4 24543 B18R2.6470 Clc1cccc(c1CSCc2ccccn2)Br 62a_100010138402_100000721315 [0,2,0,0,0,0|1,1,0]=4 24544 B18R2.6470 Clc1cccc(c1CSCc2ccccn2)Cl 62a_100000187851_100000721315 [0,2,0,0,0,0|1,1,0]=4 24545 B18R2.6470 Clc1cccc(c1CSCc2ccccn2)Cl 62a_100000721315_100000187851 [0,2,0,0,0,0|1,1,0]=4 24546 B18R2.6470 Clc1cccc(c1CSCc2cccnc2)Br 62a_100000741622_100010138402 [0,2,0,0,0,0|1,1,0]=4 24547 B18R2.6470 Clc1cccc(c1CSCc2cccnc2)Br 62a_100010138402_100000741622 [0,2,0,0,0,0|1,1,0]=4 24548 B18R2.6470 Clc1cccc(c1CSCc2cccnc2)Cl 62a_100000187851_100000741622 [0,2,0,0,0,0|1,1,0]=4 24549 B18R2.6470 Clc1cccc(c1CSCc2cccnc2)Cl 62a_100000741622_100000187851 [0,2,0,0,0,0|1,1,0]=4 24550 B18R2.6470 Clc1cccc(c1CSCc2ccncc2)Br 62a_100010138402_100015193705 [0,2,0,0,0,0|1,1,0]=4 24551 B18R2.6470 Clc1cccc(c1CSCc2ccncc2)Br 62a_100015193705_100010138402 [0,2,0,0,0,0|1,1,0]=4 24552 B18R2.6470 Clc1cccc(c1CSCc2ccncc2)Cl 62a_100000187851_100015193705 [0,2,0,0,0,0|1,1,0]=4 24553 B18R2.6470 Clc1cccc(c1CSCc2ccncc2)Cl 62a_100015193705_100000187851 [0,2,0,0,0,0|1,1,0]=4 24554 B18R2.6470 Clc1cccc(c1NCCc2ccccc2)Br 34a_100102946385_100000765856 [0,2,0,0,0,0|2,0,0]=4 24555 B18R2.6470 Clc1cccc(c1NCCc2ccccc2)Cl 34a_100000210028_100000765856 [0,2,0,0,0,0|2,0,0]=4 24556 B18R2.6470 Clc1cccc(c1OCCc2ccccc2)Br 34a_100010214474_100000765856 [0,2,0,0,0,0|2,0,0]=4 24557 B18R2.6470 Clc1cccc(c1OCCc2ccccc2)Br 7a_100010214474_100000765856 [0,2,0,0,0,0|2,0,0]=4 24558 B18R2.6470 Clc1cccc(c1OCCc2ccccc2)Cl 34a_100000211709_100000765856 [0,2,0,0,0,0|2,0,0]=4 24559 B18R2.6470 Clc1cccc(c1OCCc2ccccc2)Cl 7a_100000211709_100000765856 [0,2,0,0,0,0|2,0,0]=4 24560 B18R2.6470 Clc1cccc(c1OCCc2ccccc2)I 34a_100010202889_100000765856 [0,2,0,0,0,0|2,0,0]=4 24561 B18R2.6470 Clc1cccc(c1OCCc2ccccc2)I 7a_100010202889_100000765856 [0,2,0,0,0,0|2,0,0]=4 24562 B18R2.6470 Clc1cccc(c1SCCc2ccccc2)Br 62a_100000765856_100010214488 [0,2,0,0,0,0|2,0,0]=4 24563 B18R2.6470 Clc1cccc(c1SCCc2ccccc2)Br 62a_100010214488_100011218657 [0,2,0,0,0,0|2,0,0]=4 24564 B18R2.6470 Clc1cccc(c1SCCc2ccccc2)Cl 62a_100000034237_100011218657 [0,2,0,0,0,0|2,0,0]=4 24565 B18R2.6470 Clc1cccc(c1SCCc2ccccc2)Cl 62a_100000765856_100000034237 [0,2,0,0,0,0|2,0,0]=4 24566 B18R2.6470 Clc1ccnc(c1COCc2ccccc2)Cl 34a_200009882739_100015291786 [0,2,0,0,0,0|1,0,0]=3 24567 B18R2.6470 Clc1ccnc(c1COCc2ccccc2)Cl 7a_200009882739_100000211182 [0,2,0,0,0,0|1,0,0]=3 24568 B18R2.6470 Clc1ccnc(c1COCc2ccccn2)Cl 34a_200009882739_100000721315 [0,2,0,0,0,0|2,0,0]=4 24569 B18R2.6470 Clc1ccnc(c1COCc2ccccn2)Cl 7a_200009882739_100000721315 [0,2,0,0,0,0|2,0,0]=4 24570 B18R2.6470 Clc1ccnc(c1COCc2cccnc2)Cl 34a_200009882739_100000733263 [0,2,0,0,0,0|2,0,0]=4 24571 B18R2.6470 Clc1ccnc(c1COCc2cccnc2)Cl 7a_200009882739_100000741622 [0,2,0,0,0,0|2,0,0]=4 24572 B18R2.6470 Clc1ccnc(c1COCc2ccncc2)Cl 7a_200009882739_100015193705 [0,2,0,0,0,0|2,0,0]=4 24573 B18R2.6470 Clc1cncc(c1CNCc2ccccc2)Br 207a_100015324214_100010064873 [0,2,0,0,0,0|2,0,0]=4 24574 B18R2.6470 Clc1cncc(c1CNCc2ccccc2)Br 270004a_100015324214_100010064873 [0,2,0,0,0,0|2,0,0]=4 24575 B18R2.6470 Clc1cncc(c1CNCc2ccccc2)Cl 207a_100015324214_100000067493 [0,2,0,0,0,0|2,0,0]=4 24576 B18R2.6470 Clc1cncc(c1CNCc2ccccc2)Cl 207a_200009887528_100015611070 [0,2,0,0,0,0|2,0,0]=4 24577 B18R2.6470 Clc1cncc(c1CNCc2ccccc2)Cl 2230a_100015324214_200009872113 [0,2,0,0,0,0|2,0,0]=4 24578 B18R2.6470 Clc1cncc(c1CNCc2ccccc2)Cl 270004a_100015324214_100000067493 [0,2,0,0,0,0|2,0,0]=4 24579 B18R2.6470 Clc1cncc(c1CNCc2ccccc2)Cl 270004a_200009887528_100015611070 [0,2,0,0,0,0|2,0,0]=4 24580 B18R2.6470 Clc1cncc(c1CNCc2ccccc2)Cl 34a_100015324214_200009872113 [0,2,0,0,0,0|2,0,0]=4 24581 B18R2.6470 Clc1cncc(c1COCc2ccccc2)Cl 34a_100000210790_200009872113 [0,2,0,0,0,0|1,0,0]=3 24582 B18R2.6470 Clc1cncc(c1COCc2ccccc2)Cl 7a_100000210790_200009872113 [0,2,0,0,0,0|1,0,0]=3 24583 B18R2.6470 Clc1cncc(c1CSCc2ccccc2)Cl 62a_100000211182_200009872113 [0,2,0,0,0,0|1,1,0]=4 24584 B18R2.6470 Clc1cncc(c1CSCc2ccccc2)Cl 62a_200009872113_100015291786 [0,2,0,0,0,0|1,1,0]=4 24585 B18R2.6470 Clc1nccc(c1COCc2ccccc2)I 7a_100000047008_100000211182 [0,2,0,0,0,0|1,0,0]=3 24586 B18R2.6470 Clc1nccc(c1COCc2ccccn2)I 7a_100000047008_100000721315 [0,2,0,0,0,0|2,0,0]=4 24587 B18R2.6470 Clc1nccc(c1COCc2cccnc2)I 7a_100000047008_100000741622 [0,2,0,0,0,0|2,0,0]=4 24588 B18R2.6470 Clc1nccc(c1COCc2ccncc2)I 7a_100000047008_100015193705 [0,2,0,0,0,0|2,0,0]=4 24589 B18R2.6470 Fc1cccc(c1C=CCc2ccccc2)Br 271570a_200016263579_100011219512 [0,2,0,0,0,0|1,0,1]=4 24590 B18R2.6470 Fc1cccc(c1C=CCc2ccccc2)Cl 271570a_200016263579_100000050007 [0,2,0,0,0,0|1,0,1]=4 24591 B18R2.6470 Fc1cccc(c1C=CCc2ccccc2)F 271570a_200016263579_100000693133 [0,2,0,0,0,0|1,0,1]=4 24592 B18R2.6470 Fc1cccc(c1CNCc2ccccc2)Br 207a_100012349121_100015611070 [0,2,0,0,0,0|1,0,0]=3 24593 B18R2.6470 Fc1cccc(c1CNCc2ccccc2)Br 207a_100015324214_100000752695 [0,2,0,0,0,0|1,0,0]=3 24594 B18R2.6470 Fc1cccc(c1CNCc2ccccc2)Br 2230a_100015324214_100012145669 [0,2,0,0,0,0|1,0,0]=3 24595 B18R2.6470 Fc1cccc(c1CNCc2ccccc2)Br 270004a_100012349121_100015611070 [0,2,0,0,0,0|1,0,0]=3 24596 B18R2.6470 Fc1cccc(c1CNCc2ccccc2)Br 270004a_100015324214_100000752695 [0,2,0,0,0,0|1,0,0]=3 24597 B18R2.6470 Fc1cccc(c1CNCc2ccccc2)Br 34a_100012349121_100015291786 [0,2,0,0,0,0|1,0,0]=3 24598 B18R2.6470 Fc1cccc(c1CNCc2ccccc2)Br 34a_100015324214_100012145669 [0,2,0,0,0,0|1,0,0]=3 24599 B18R2.6470 Fc1cccc(c1CNCc2ccccc2)Cl 207a_100000174883_100015611070 [0,2,0,0,0,0|1,0,0]=3 24600 B18R2.6470 Fc1cccc(c1CNCc2ccccc2)Cl 207a_100015324214_100000210083 [0,2,0,0,0,0|1,0,0]=3 24601 B18R2.6470 Fc1cccc(c1CNCc2ccccc2)Cl 2230a_100015324214_100000187852 [0,2,0,0,0,0|1,0,0]=3 24602 B18R2.6470 Fc1cccc(c1CNCc2ccccc2)Cl 270004a_100000174883_100015611070 [0,2,0,0,0,0|1,0,0]=3 24603 B18R2.6470 Fc1cccc(c1CNCc2ccccc2)Cl 270004a_100015324214_100000210083 [0,2,0,0,0,0|1,0,0]=3 24604 B18R2.6470 Fc1cccc(c1CNCc2ccccc2)Cl 34a_100000174883_100015291786 [0,2,0,0,0,0|1,0,0]=3 24605 B18R2.6470 Fc1cccc(c1CNCc2ccccc2)Cl 34a_100015324214_100000187852 [0,2,0,0,0,0|1,0,0]=3 24606 B18R2.6470 Fc1cccc(c1CNCc2ccccc2)F 207a_100000688400_100015611070 [0,2,0,0,0,0|1,0,0]=3 24607 B18R2.6470 Fc1cccc(c1CNCc2ccccc2)F 207a_100015324214_100000211061 [0,2,0,0,0,0|1,0,0]=3 24608 B18R2.6470 Fc1cccc(c1CNCc2ccccc2)F 2230a_100015324214_100000698325 [0,2,0,0,0,0|1,0,0]=3 24609 B18R2.6470 Fc1cccc(c1CNCc2ccccc2)F 270004a_100000688400_100015611070 [0,2,0,0,0,0|1,0,0]=3 24610 B18R2.6470 Fc1cccc(c1CNCc2ccccc2)F 270004a_100015324214_100000211061 [0,2,0,0,0,0|1,0,0]=3 24611 B18R2.6470 Fc1cccc(c1CNCc2ccccc2)F 34a_100000688400_100015291786 [0,2,0,0,0,0|1,0,0]=3 24612 B18R2.6470 Fc1cccc(c1CNCc2ccccc2)F 34a_100015324214_100000698325 [0,2,0,0,0,0|1,0,0]=3 24613 B18R2.6470 Fc1cccc(c1CNCc2ccccc2)I 207a_100015324214_100010178011 [0,2,0,0,0,0|1,0,0]=3 24614 B18R2.6470 Fc1cccc(c1CNCc2ccccc2)I 2230a_100015324214_100010149602 [0,2,0,0,0,0|1,0,0]=3 24615 B18R2.6470 Fc1cccc(c1CNCc2ccccc2)I 270004a_100015324214_100010178011 [0,2,0,0,0,0|1,0,0]=3 24616 B18R2.6470 Fc1cccc(c1CNCc2ccccc2)I 34a_100015324214_100010149602 [0,2,0,0,0,0|1,0,0]=3 24617 B18R2.6470 Fc1cccc(c1CNCc2ccccn2)Br 207a_100012349121_100000209966 [0,2,0,0,0,0|2,0,0]=4 24618 B18R2.6470 Fc1cccc(c1CNCc2ccccn2)Br 270004a_100000210449_100000752695 [0,2,0,0,0,0|2,0,0]=4 24619 B18R2.6470 Fc1cccc(c1CNCc2ccccn2)Br 270004a_100012349121_100000209966 [0,2,0,0,0,0|2,0,0]=4 24620 B18R2.6470 Fc1cccc(c1CNCc2ccccn2)Br 34a_100012349121_100000721315 [0,2,0,0,0,0|2,0,0]=4 24621 B18R2.6470 Fc1cccc(c1CNCc2ccccn2)Cl 207a_100000174883_100000209966 [0,2,0,0,0,0|2,0,0]=4 24622 B18R2.6470 Fc1cccc(c1CNCc2ccccn2)Cl 270004a_100000174883_100000209966 [0,2,0,0,0,0|2,0,0]=4 24623 B18R2.6470 Fc1cccc(c1CNCc2ccccn2)Cl 270004a_100000210449_100000210083 [0,2,0,0,0,0|2,0,0]=4 24624 B18R2.6470 Fc1cccc(c1CNCc2ccccn2)Cl 34a_100000174883_100000721315 [0,2,0,0,0,0|2,0,0]=4 24625 B18R2.6470 Fc1cccc(c1CNCc2ccccn2)F 207a_100000688400_100000209966 [0,2,0,0,0,0|2,0,0]=4 24626 B18R2.6470 Fc1cccc(c1CNCc2ccccn2)F 270004a_100000210449_100000211061 [0,2,0,0,0,0|2,0,0]=4 24627 B18R2.6470 Fc1cccc(c1CNCc2ccccn2)F 270004a_100000688400_100000209966 [0,2,0,0,0,0|2,0,0]=4 24628 B18R2.6470 Fc1cccc(c1CNCc2ccccn2)F 34a_100000688400_100000721315 [0,2,0,0,0,0|2,0,0]=4 24629 B18R2.6470 Fc1cccc(c1CNCc2ccccn2)I 270004a_100000210449_100010178011 [0,2,0,0,0,0|2,0,0]=4 24630 B18R2.6470 Fc1cccc(c1CNCc2cccnc2)Br 207a_100000210453_100000752695 [0,2,0,0,0,0|2,0,0]=4 24631 B18R2.6470 Fc1cccc(c1CNCc2cccnc2)Br 207a_100012349121_100000209961 [0,2,0,0,0,0|2,0,0]=4 24632 B18R2.6470 Fc1cccc(c1CNCc2cccnc2)Br 270004a_100000210453_100000752695 [0,2,0,0,0,0|2,0,0]=4 24633 B18R2.6470 Fc1cccc(c1CNCc2cccnc2)Br 270004a_100012349121_100000209961 [0,2,0,0,0,0|2,0,0]=4 24634 B18R2.6470 Fc1cccc(c1CNCc2cccnc2)Br 34a_100012349121_100000733263 [0,2,0,0,0,0|2,0,0]=4 24635 B18R2.6470 Fc1cccc(c1CNCc2cccnc2)Cl 207a_100000174883_100000209961 [0,2,0,0,0,0|2,0,0]=4 24636 B18R2.6470 Fc1cccc(c1CNCc2cccnc2)Cl 207a_100000210453_100000210083 [0,2,0,0,0,0|2,0,0]=4 24637 B18R2.6470 Fc1cccc(c1CNCc2cccnc2)Cl 270004a_100000174883_100000209961 [0,2,0,0,0,0|2,0,0]=4 24638 B18R2.6470 Fc1cccc(c1CNCc2cccnc2)Cl 270004a_100000210453_100000210083 [0,2,0,0,0,0|2,0,0]=4 24639 B18R2.6470 Fc1cccc(c1CNCc2cccnc2)Cl 34a_100000174883_100000733263 [0,2,0,0,0,0|2,0,0]=4 24640 B18R2.6470 Fc1cccc(c1CNCc2cccnc2)F 207a_100000210453_100000211061 [0,2,0,0,0,0|2,0,0]=4 24641 B18R2.6470 Fc1cccc(c1CNCc2cccnc2)F 207a_100000688400_100000209961 [0,2,0,0,0,0|2,0,0]=4 24642 B18R2.6470 Fc1cccc(c1CNCc2cccnc2)F 270004a_100000210453_100000211061 [0,2,0,0,0,0|2,0,0]=4 24643 B18R2.6470 Fc1cccc(c1CNCc2cccnc2)F 270004a_100000688400_100000209961 [0,2,0,0,0,0|2,0,0]=4 24644 B18R2.6470 Fc1cccc(c1CNCc2cccnc2)F 34a_100000688400_100000733263 [0,2,0,0,0,0|2,0,0]=4 24645 B18R2.6470 Fc1cccc(c1CNCc2cccnc2)I 207a_100000210453_100010178011 [0,2,0,0,0,0|2,0,0]=4 24646 B18R2.6470 Fc1cccc(c1CNCc2cccnc2)I 270004a_100000210453_100010178011 [0,2,0,0,0,0|2,0,0]=4 24647 B18R2.6470 Fc1cccc(c1CNCc2ccncc2)Br 207a_100012349121_100000186114 [0,2,0,0,0,0|2,0,0]=4 24648 B18R2.6470 Fc1cccc(c1CNCc2ccncc2)Cl 207a_100000174883_100000186114 [0,2,0,0,0,0|2,0,0]=4 24649 B18R2.6470 Fc1cccc(c1CNCc2ccncc2)F 207a_100000688400_100000186114 [0,2,0,0,0,0|2,0,0]=4 24650 B18R2.6470 Fc1cccc(c1COCc2ccccc2)Br 34a_100000210790_100012145669 [0,2,0,0,0,0|0,0,0]=2 24651 B18R2.6470 Fc1cccc(c1COCc2ccccc2)Br 34a_100012355691_100015291786 [0,2,0,0,0,0|0,0,0]=2 24652 B18R2.6470 Fc1cccc(c1COCc2ccccc2)Br 7a_100000210790_100000696636 [0,2,0,0,0,0|0,0,0]=2 24653 B18R2.6470 Fc1cccc(c1COCc2ccccc2)Br 7a_100012355691_100000211182 [0,2,0,0,0,0|0,0,0]=2 24654 B18R2.6470 Fc1cccc(c1COCc2ccccc2)Cl 34a_100000210790_100000187852 [0,2,0,0,0,0|0,0,0]=2 24655 B18R2.6470 Fc1cccc(c1COCc2ccccc2)Cl 34a_100000215723_100015291786 [0,2,0,0,0,0|0,0,0]=2 24656 B18R2.6470 Fc1cccc(c1COCc2ccccc2)Cl 7a_100000210790_100000187852 [0,2,0,0,0,0|0,0,0]=2 24657 B18R2.6470 Fc1cccc(c1COCc2ccccc2)Cl 7a_100000215723_100000211182 [0,2,0,0,0,0|0,0,0]=2 24658 B18R2.6470 Fc1cccc(c1COCc2ccccc2)F 34a_100000210790_100000698325 [0,2,0,0,0,0|0,0,0]=2 24659 B18R2.6470 Fc1cccc(c1COCc2ccccc2)F 34a_100000698215_100015291786 [0,2,0,0,0,0|0,0,0]=2 24660 B18R2.6470 Fc1cccc(c1COCc2ccccc2)F 7a_100000210790_100000698325 [0,2,0,0,0,0|0,0,0]=2 24661 B18R2.6470 Fc1cccc(c1COCc2ccccc2)F 7a_100000698215_100000211182 [0,2,0,0,0,0|0,0,0]=2 24662 B18R2.6470 Fc1cccc(c1COCc2ccccc2)I 34a_100000210790_100010149602 [0,2,0,0,0,0|0,0,0]=2 24663 B18R2.6470 Fc1cccc(c1COCc2ccccc2)I 34a_100010214973_100015291786 [0,2,0,0,0,0|0,0,0]=2 24664 B18R2.6470 Fc1cccc(c1COCc2ccccc2)I 7a_100000210790_100010149602 [0,2,0,0,0,0|0,0,0]=2 24665 B18R2.6470 Fc1cccc(c1COCc2ccccc2)I 7a_100010214973_100000211182 [0,2,0,0,0,0|0,0,0]=2 24666 B18R2.6470 Fc1cccc(c1COCc2ccccn2)Br 34a_100012355691_100000721315 [0,2,0,0,0,0|1,0,0]=3 24667 B18R2.6470 Fc1cccc(c1COCc2ccccn2)Br 7a_100012355691_100000721315 [0,2,0,0,0,0|1,0,0]=3 24668 B18R2.6470 Fc1cccc(c1COCc2ccccn2)Cl 34a_100000215723_100000721315 [0,2,0,0,0,0|1,0,0]=3 24669 B18R2.6470 Fc1cccc(c1COCc2ccccn2)Cl 7a_100000215723_100000721315 [0,2,0,0,0,0|1,0,0]=3 24670 B18R2.6470 Fc1cccc(c1COCc2ccccn2)F 34a_100000698215_100000721315 [0,2,0,0,0,0|1,0,0]=3 24671 B18R2.6470 Fc1cccc(c1COCc2ccccn2)F 7a_100000698215_100000721315 [0,2,0,0,0,0|1,0,0]=3 24672 B18R2.6470 Fc1cccc(c1COCc2ccccn2)I 34a_100010214973_100000721315 [0,2,0,0,0,0|1,0,0]=3 24673 B18R2.6470 Fc1cccc(c1COCc2ccccn2)I 7a_100010214973_100000721315 [0,2,0,0,0,0|1,0,0]=3 24674 B18R2.6470 Fc1cccc(c1COCc2cccnc2)Br 34a_100012355691_100000733263 [0,2,0,0,0,0|1,0,0]=3 24675 B18R2.6470 Fc1cccc(c1COCc2cccnc2)Br 7a_100012355691_100000741622 [0,2,0,0,0,0|1,0,0]=3 24676 B18R2.6470 Fc1cccc(c1COCc2cccnc2)Cl 34a_100000215723_100000733263 [0,2,0,0,0,0|1,0,0]=3 24677 B18R2.6470 Fc1cccc(c1COCc2cccnc2)Cl 7a_100000215723_100000741622 [0,2,0,0,0,0|1,0,0]=3 24678 B18R2.6470 Fc1cccc(c1COCc2cccnc2)F 34a_100000698215_100000733263 [0,2,0,0,0,0|1,0,0]=3 24679 B18R2.6470 Fc1cccc(c1COCc2cccnc2)F 7a_100000698215_100000741622 [0,2,0,0,0,0|1,0,0]=3 24680 B18R2.6470 Fc1cccc(c1COCc2cccnc2)I 34a_100010214973_100000733263 [0,2,0,0,0,0|1,0,0]=3 24681 B18R2.6470 Fc1cccc(c1COCc2cccnc2)I 7a_100010214973_100000741622 [0,2,0,0,0,0|1,0,0]=3 24682 B18R2.6470 Fc1cccc(c1COCc2cccnn2)Br 34a_100012355691_100016990269 [0,2,0,0,0,0|2,0,0]=4 24683 B18R2.6470 Fc1cccc(c1COCc2cccnn2)Br 7a_100012355691_100016990269 [0,2,0,0,0,0|2,0,0]=4 24684 B18R2.6470 Fc1cccc(c1COCc2cccnn2)Cl 34a_100000215723_100016990269 [0,2,0,0,0,0|2,0,0]=4 24685 B18R2.6470 Fc1cccc(c1COCc2cccnn2)Cl 7a_100000215723_100016990269 [0,2,0,0,0,0|2,0,0]=4 24686 B18R2.6470 Fc1cccc(c1COCc2cccnn2)F 34a_100000698215_100016990269 [0,2,0,0,0,0|2,0,0]=4 24687 B18R2.6470 Fc1cccc(c1COCc2cccnn2)F 7a_100000698215_100016990269 [0,2,0,0,0,0|2,0,0]=4 24688 B18R2.6470 Fc1cccc(c1COCc2cccnn2)I 34a_100010214973_100016990269 [0,2,0,0,0,0|2,0,0]=4 24689 B18R2.6470 Fc1cccc(c1COCc2cccnn2)I 7a_100010214973_100016990269 [0,2,0,0,0,0|2,0,0]=4 24690 B18R2.6470 Fc1cccc(c1COCc2ccncc2)Br 7a_100012355691_100015193705 [0,2,0,0,0,0|1,0,0]=3 24691 B18R2.6470 Fc1cccc(c1COCc2ccncc2)Cl 7a_100000215723_100015193705 [0,2,0,0,0,0|1,0,0]=3 24692 B18R2.6470 Fc1cccc(c1COCc2ccncc2)F 7a_100000698215_100015193705 [0,2,0,0,0,0|1,0,0]=3 24693 B18R2.6470 Fc1cccc(c1COCc2ccncc2)I 7a_100010214973_100015193705 [0,2,0,0,0,0|1,0,0]=3 24694 B18R2.6470 Fc1cccc(c1COCc2cnccn2)Br 34a_100012355691_100016995436 [0,2,0,0,0,0|2,0,0]=4 24695 B18R2.6470 Fc1cccc(c1COCc2cnccn2)Br 7a_100012355691_100016995436 [0,2,0,0,0,0|2,0,0]=4 24696 B18R2.6470 Fc1cccc(c1COCc2cnccn2)Cl 34a_100000215723_100016995436 [0,2,0,0,0,0|2,0,0]=4 24697 B18R2.6470 Fc1cccc(c1COCc2cnccn2)Cl 7a_100000215723_100016995436 [0,2,0,0,0,0|2,0,0]=4 24698 B18R2.6470 Fc1cccc(c1COCc2cnccn2)F 34a_100000698215_100016995436 [0,2,0,0,0,0|2,0,0]=4 24699 B18R2.6470 Fc1cccc(c1COCc2cnccn2)F 7a_100000698215_100016995436 [0,2,0,0,0,0|2,0,0]=4 24700 B18R2.6470 Fc1cccc(c1COCc2cnccn2)I 34a_100010214973_100016995436 [0,2,0,0,0,0|2,0,0]=4 24701 B18R2.6470 Fc1cccc(c1COCc2cnccn2)I 7a_100010214973_100016995436 [0,2,0,0,0,0|2,0,0]=4 24702 B18R2.6470 Fc1cccc(c1COCc2cncnc2)Br 34a_100012355691_100015196519 [0,2,0,0,0,0|2,0,0]=4 24703 B18R2.6470 Fc1cccc(c1COCc2cncnc2)Br 7a_100012355691_100015196519 [0,2,0,0,0,0|2,0,0]=4 24704 B18R2.6470 Fc1cccc(c1COCc2cncnc2)Cl 34a_100000215723_100015196519 [0,2,0,0,0,0|2,0,0]=4 24705 B18R2.6470 Fc1cccc(c1COCc2cncnc2)Cl 7a_100000215723_100015196519 [0,2,0,0,0,0|2,0,0]=4 24706 B18R2.6470 Fc1cccc(c1COCc2cncnc2)F 34a_100000698215_100015196519 [0,2,0,0,0,0|2,0,0]=4 24707 B18R2.6470 Fc1cccc(c1COCc2cncnc2)F 7a_100000698215_100015196519 [0,2,0,0,0,0|2,0,0]=4 24708 B18R2.6470 Fc1cccc(c1COCc2cncnc2)I 34a_100010214973_100015196519 [0,2,0,0,0,0|2,0,0]=4 24709 B18R2.6470 Fc1cccc(c1COCc2cncnc2)I 7a_100010214973_100015196519 [0,2,0,0,0,0|2,0,0]=4 24710 B18R2.6470 Fc1cccc(c1COCc2ncccn2)Br 34a_100012355691_100000703007 [0,2,0,0,0,0|2,0,0]=4 24711 B18R2.6470 Fc1cccc(c1COCc2ncccn2)Br 7a_100012355691_100000703007 [0,2,0,0,0,0|2,0,0]=4 24712 B18R2.6470 Fc1cccc(c1COCc2ncccn2)Cl 34a_100000215723_100000703007 [0,2,0,0,0,0|2,0,0]=4 24713 B18R2.6470 Fc1cccc(c1COCc2ncccn2)Cl 7a_100000215723_100000703007 [0,2,0,0,0,0|2,0,0]=4 24714 B18R2.6470 Fc1cccc(c1COCc2ncccn2)F 34a_100000698215_100000703007 [0,2,0,0,0,0|2,0,0]=4 24715 B18R2.6470 Fc1cccc(c1COCc2ncccn2)F 7a_100000698215_100000703007 [0,2,0,0,0,0|2,0,0]=4 24716 B18R2.6470 Fc1cccc(c1COCc2ncccn2)I 34a_100010214973_100000703007 [0,2,0,0,0,0|2,0,0]=4 24717 B18R2.6470 Fc1cccc(c1COCc2ncccn2)I 7a_100010214973_100000703007 [0,2,0,0,0,0|2,0,0]=4 24718 B18R2.6470 Fc1cccc(c1CSCc2ccccc2)Br 62a_100000211182_100012145669 [0,2,0,0,0,0|0,1,0]=3 24719 B18R2.6470 Fc1cccc(c1CSCc2ccccc2)Br 62a_100012145669_100015291786 [0,2,0,0,0,0|0,1,0]=3 24720 B18R2.6470 Fc1cccc(c1CSCc2ccccc2)Cl 62a_100000187852_100015291786 [0,2,0,0,0,0|0,1,0]=3 24721 B18R2.6470 Fc1cccc(c1CSCc2ccccc2)Cl 62a_100000211182_100000187852 [0,2,0,0,0,0|0,1,0]=3 24722 B18R2.6470 Fc1cccc(c1CSCc2ccccc2)F 62a_100000211182_100000698325 [0,2,0,0,0,0|0,1,0]=3 24723 B18R2.6470 Fc1cccc(c1CSCc2ccccc2)F 62a_100000709179_100015291786 [0,2,0,0,0,0|0,1,0]=3 24724 B18R2.6470 Fc1cccc(c1CSCc2ccccc2)I 62a_100000211182_100010149602 [0,2,0,0,0,0|0,1,0]=3 24725 B18R2.6470 Fc1cccc(c1CSCc2ccccc2)I 62a_100010149602_100015291786 [0,2,0,0,0,0|0,1,0]=3 24726 B18R2.6470 Fc1cccc(c1CSCc2ccccn2)Br 62a_100000721315_100012145669 [0,2,0,0,0,0|1,1,0]=4 24727 B18R2.6470 Fc1cccc(c1CSCc2ccccn2)Br 62a_100012145669_100000721315 [0,2,0,0,0,0|1,1,0]=4 24728 B18R2.6470 Fc1cccc(c1CSCc2ccccn2)Cl 62a_100000187852_100000721315 [0,2,0,0,0,0|1,1,0]=4 24729 B18R2.6470 Fc1cccc(c1CSCc2ccccn2)Cl 62a_100000721315_100000187852 [0,2,0,0,0,0|1,1,0]=4 24730 B18R2.6470 Fc1cccc(c1CSCc2ccccn2)F 62a_100000709179_100000721315 [0,2,0,0,0,0|1,1,0]=4 24731 B18R2.6470 Fc1cccc(c1CSCc2ccccn2)F 62a_100000721315_100000698325 [0,2,0,0,0,0|1,1,0]=4 24732 B18R2.6470 Fc1cccc(c1CSCc2ccccn2)I 62a_100000721315_100010149602 [0,2,0,0,0,0|1,1,0]=4 24733 B18R2.6470 Fc1cccc(c1CSCc2ccccn2)I 62a_100010149602_100000721315 [0,2,0,0,0,0|1,1,0]=4 24734 B18R2.6470 Fc1cccc(c1CSCc2cccnc2)Br 62a_100000741622_100012145669 [0,2,0,0,0,0|1,1,0]=4 24735 B18R2.6470 Fc1cccc(c1CSCc2cccnc2)Br 62a_100012145669_100000741622 [0,2,0,0,0,0|1,1,0]=4 24736 B18R2.6470 Fc1cccc(c1CSCc2cccnc2)Cl 62a_100000187852_100000741622 [0,2,0,0,0,0|1,1,0]=4 24737 B18R2.6470 Fc1cccc(c1CSCc2cccnc2)Cl 62a_100000741622_100000187852 [0,2,0,0,0,0|1,1,0]=4 24738 B18R2.6470 Fc1cccc(c1CSCc2cccnc2)F 62a_100000709179_100000741622 [0,2,0,0,0,0|1,1,0]=4 24739 B18R2.6470 Fc1cccc(c1CSCc2cccnc2)F 62a_100000741622_100000698325 [0,2,0,0,0,0|1,1,0]=4 24740 B18R2.6470 Fc1cccc(c1CSCc2cccnc2)I 62a_100000741622_100010149602 [0,2,0,0,0,0|1,1,0]=4 24741 B18R2.6470 Fc1cccc(c1CSCc2cccnc2)I 62a_100010149602_100000741622 [0,2,0,0,0,0|1,1,0]=4 24742 B18R2.6470 Fc1cccc(c1CSCc2ccncc2)Br 62a_100012145669_100015193705 [0,2,0,0,0,0|1,1,0]=4 24743 B18R2.6470 Fc1cccc(c1CSCc2ccncc2)Br 62a_100015193705_100012145669 [0,2,0,0,0,0|1,1,0]=4 24744 B18R2.6470 Fc1cccc(c1CSCc2ccncc2)Cl 62a_100000187852_100015193705 [0,2,0,0,0,0|1,1,0]=4 24745 B18R2.6470 Fc1cccc(c1CSCc2ccncc2)Cl 62a_100015193705_100000187852 [0,2,0,0,0,0|1,1,0]=4 24746 B18R2.6470 Fc1cccc(c1CSCc2ccncc2)F 62a_100000709179_100015193705 [0,2,0,0,0,0|1,1,0]=4 24747 B18R2.6470 Fc1cccc(c1CSCc2ccncc2)F 62a_100015193705_100000698325 [0,2,0,0,0,0|1,1,0]=4 24748 B18R2.6470 Fc1cccc(c1CSCc2ccncc2)I 62a_100010149602_100015193705 [0,2,0,0,0,0|1,1,0]=4 24749 B18R2.6470 Fc1cccc(c1CSCc2ccncc2)I 62a_100015193705_100010149602 [0,2,0,0,0,0|1,1,0]=4 24750 B18R2.6470 Fc1cccc(c1NCCc2ccccc2)Br 34a_100000684712_100000765856 [0,2,0,0,0,0|2,0,0]=4 24751 B18R2.6470 Fc1cccc(c1NCCc2ccccc2)Cl 34a_100000760031_100000765856 [0,2,0,0,0,0|2,0,0]=4 24752 B18R2.6470 Fc1cccc(c1NCCc2ccccc2)F 2230a_100000210704_100000765856 [0,2,0,0,0,0|2,0,0]=4 24753 B18R2.6470 Fc1cccc(c1NCCc2ccccc2)F 34a_100000210704_100000765856 [0,2,0,0,0,0|2,0,0]=4 24754 B18R2.6470 Fc1cccc(c1NCCc2ccccc2)I 34a_100000042321_100000765856 [0,2,0,0,0,0|2,0,0]=4 24755 B18R2.6470 Fc1cccc(c1OCCc2ccccc2)Br 34a_100009813666_100000765856 [0,2,0,0,0,0|2,0,0]=4 24756 B18R2.6470 Fc1cccc(c1OCCc2ccccc2)Br 7a_100009813666_100000765856 [0,2,0,0,0,0|2,0,0]=4 24757 B18R2.6470 Fc1cccc(c1OCCc2ccccc2)Cl 34a_100000694953_100000765856 [0,2,0,0,0,0|2,0,0]=4 24758 B18R2.6470 Fc1cccc(c1OCCc2ccccc2)Cl 7a_100000694953_100000765856 [0,2,0,0,0,0|2,0,0]=4 24759 B18R2.6470 Fc1cccc(c1OCCc2ccccc2)F 34a_100000230165_100000765856 [0,2,0,0,0,0|2,0,0]=4 24760 B18R2.6470 Fc1cccc(c1OCCc2ccccc2)F 7a_100000230165_100000765856 [0,2,0,0,0,0|2,0,0]=4 24761 B18R2.6470 Fc1cccc(c1OCCc2ccccc2)I 34a_100010186298_100000765856 [0,2,0,0,0,0|2,0,0]=4 24762 B18R2.6470 Fc1cccc(c1OCCc2ccccc2)I 7a_100010186298_100000765856 [0,2,0,0,0,0|2,0,0]=4 24763 B18R2.6470 Fc1cccc(c1SCCc2ccccc2)Br 62a_100000765856_100011219512 [0,2,0,0,0,0|2,0,0]=4 24764 B18R2.6470 Fc1cccc(c1SCCc2ccccc2)Br 62a_100011219512_100011218657 [0,2,0,0,0,0|2,0,0]=4 24765 B18R2.6470 Fc1cccc(c1SCCc2ccccc2)Cl 62a_100000050007_100011218657 [0,2,0,0,0,0|2,0,0]=4 24766 B18R2.6470 Fc1cccc(c1SCCc2ccccc2)Cl 62a_100000765856_100000050007 [0,2,0,0,0,0|2,0,0]=4 24767 B18R2.6470 Fc1cccc(c1SCCc2ccccc2)F 62a_100000693133_100011218657 [0,2,0,0,0,0|2,0,0]=4 24768 B18R2.6470 Fc1cccc(c1SCCc2ccccc2)F 62a_100000765856_100000693133 [0,2,0,0,0,0|2,0,0]=4 24769 B18R2.6470 Fc1cncc(c1CNCc2ccccc2)Br 207a_100015324214_100010064882 [0,2,0,0,0,0|2,0,0]=4 24770 B18R2.6470 Fc1cncc(c1CNCc2ccccc2)Br 270004a_100015324214_100010064882 [0,2,0,0,0,0|2,0,0]=4 24771 B18R2.6470 Fc1cncc(c1CNCc2ccccc2)F 207a_100015324214_100000068831 [0,2,0,0,0,0|2,0,0]=4 24772 B18R2.6470 Fc1nccc(c1COCc2ccccc2)I 34a_100000050056_100015291786 [0,2,0,0,0,0|1,0,0]=3 24773 B18R2.6470 Fc1nccc(c1COCc2ccccc2)I 7a_100000050056_100000211182 [0,2,0,0,0,0|1,0,0]=3 24774 B18R2.6470 Fc1nccc(c1COCc2ccccn2)I 34a_100000050056_100000721315 [0,2,0,0,0,0|2,0,0]=4 24775 B18R2.6470 Fc1nccc(c1COCc2ccccn2)I 7a_100000050056_100000721315 [0,2,0,0,0,0|2,0,0]=4 24776 B18R2.6470 Fc1nccc(c1COCc2cccnc2)I 34a_100000050056_100000733263 [0,2,0,0,0,0|2,0,0]=4 24777 B18R2.6470 Fc1nccc(c1COCc2cccnc2)I 7a_100000050056_100000741622 [0,2,0,0,0,0|2,0,0]=4 24778 B18R2.6470 Fc1nccc(c1COCc2ccncc2)I 7a_100000050056_100015193705 [0,2,0,0,0,0|2,0,0]=4 24779 B18R2.6470 Nc1cccc(c1C=CCc2ccccc2)Br 271570a_200016263579_100020590159 [0,2,0,0,0,0|1,0,1]=4 24780 B18R2.6470 Nc1cccc(c1C=CCc2ccccc2)Cl 271570a_200016263579_100000049713 [0,2,0,0,0,0|1,0,1]=4 24781 B18R2.6470 Nc1cccc(c1C=CCc2ccccc2)F 271570a_200016263579_100011934729 [0,2,0,0,0,0|1,0,1]=4 24782 B18R2.6470 Nc1cccc(c1C=CCc2ccccc2)O 271570a_200016263579_100012183704 [0,2,0,0,0,0|1,0,1]=4 24783 B18R2.6470 Nc1cccc(c1COCc2ccccc2)Br 34a_100000747656_100015291786 [0,2,0,0,0,0|0,0,0]=2 24784 B18R2.6470 Nc1cccc(c1COCc2ccccc2)Cl 34a_100011916388_100015291786 [0,2,0,0,0,0|0,0,0]=2 24785 B18R2.6470 Nc1cccc(c1COCc2ccccc2)F 34a_100011846719_100015291786 [0,2,0,0,0,0|0,0,0]=2 24786 B18R2.6470 Nc1cccc(c1COCc2ccccn2)Br 34a_100000747656_100000721315 [0,2,0,0,0,0|1,0,0]=3 24787 B18R2.6470 Nc1cccc(c1COCc2ccccn2)Cl 34a_100011916388_100000721315 [0,2,0,0,0,0|1,0,0]=3 24788 B18R2.6470 Nc1cccc(c1COCc2ccccn2)F 34a_100011846719_100000721315 [0,2,0,0,0,0|1,0,0]=3 24789 B18R2.6470 Nc1cccc(c1COCc2cccnc2)Br 34a_100000747656_100000733263 [0,2,0,0,0,0|1,0,0]=3 24790 B18R2.6470 Nc1cccc(c1COCc2cccnc2)Cl 34a_100011916388_100000733263 [0,2,0,0,0,0|1,0,0]=3 24791 B18R2.6470 Nc1cccc(c1COCc2cccnc2)F 34a_100011846719_100000733263 [0,2,0,0,0,0|1,0,0]=3 24792 B18R2.6470 Nc1cccc(c1COCc2cccnn2)Br 34a_100000747656_100016990269 [0,2,0,0,0,0|2,0,0]=4 24793 B18R2.6470 Nc1cccc(c1COCc2cccnn2)Cl 34a_100011916388_100016990269 [0,2,0,0,0,0|2,0,0]=4 24794 B18R2.6470 Nc1cccc(c1COCc2cccnn2)F 34a_100011846719_100016990269 [0,2,0,0,0,0|2,0,0]=4 24795 B18R2.6470 Nc1cccc(c1COCc2cnccn2)Br 34a_100000747656_100016995436 [0,2,0,0,0,0|2,0,0]=4 24796 B18R2.6470 Nc1cccc(c1COCc2cnccn2)Cl 34a_100011916388_100016995436 [0,2,0,0,0,0|2,0,0]=4 24797 B18R2.6470 Nc1cccc(c1COCc2cnccn2)F 34a_100011846719_100016995436 [0,2,0,0,0,0|2,0,0]=4 24798 B18R2.6470 Nc1cccc(c1COCc2cncnc2)Br 34a_100000747656_100015196519 [0,2,0,0,0,0|2,0,0]=4 24799 B18R2.6470 Nc1cccc(c1COCc2cncnc2)Cl 34a_100011916388_100015196519 [0,2,0,0,0,0|2,0,0]=4 24800 B18R2.6470 Nc1cccc(c1COCc2cncnc2)F 34a_100011846719_100015196519 [0,2,0,0,0,0|2,0,0]=4 24801 B18R2.6470 Nc1cccc(c1COCc2ncccn2)Br 34a_100000747656_100000703007 [0,2,0,0,0,0|2,0,0]=4 24802 B18R2.6470 Nc1cccc(c1COCc2ncccn2)Cl 34a_100011916388_100000703007 [0,2,0,0,0,0|2,0,0]=4 24803 B18R2.6470 Nc1cccc(c1COCc2ncccn2)F 34a_100011846719_100000703007 [0,2,0,0,0,0|2,0,0]=4 24804 B18R2.6470 Nc1cccc(c1OCCc2ccccc2)Br 34a_100011934915_100000765856 [0,2,0,0,0,0|2,0,0]=4 24805 B18R2.6470 Nc1cccc(c1OCCc2ccccc2)Cl 34a_100000754742_100000765856 [0,2,0,0,0,0|2,0,0]=4 24806 B18R2.6470 Nc1cccc(c1OCCc2ccccc2)F 34a_100011934987_100000765856 [0,2,0,0,0,0|2,0,0]=4 24807 B18R2.6470 Nc1cccc(c1OCCc2ccccc2)I 34a_100010084371_100000765856 [0,2,0,0,0,0|2,0,0]=4 24808 B18R2.6470 Nc1cccc(c1OCCc2ccccc2)N 34a_200016994477_100000765856 [0,2,0,0,0,0|2,0,0]=4 24809 B18R2.6470 Nc1cccc(c1SCCc2ccccc2)Br 62a_100000765856_100020590159 [0,2,0,0,0,0|2,0,0]=4 24810 B18R2.6470 Nc1cccc(c1SCCc2ccccc2)Br 62a_100020590159_100011218657 [0,2,0,0,0,0|2,0,0]=4 24811 B18R2.6470 Nc1cccc(c1SCCc2ccccc2)Cl 62a_100000049713_100011218657 [0,2,0,0,0,0|2,0,0]=4 24812 B18R2.6470 Nc1cccc(c1SCCc2ccccc2)Cl 62a_100000765856_100000049713 [0,2,0,0,0,0|2,0,0]=4 24813 B18R2.6470 Nc1cccc(c1SCCc2ccccc2)F 62a_100000690935_100011218657 [0,2,0,0,0,0|2,0,0]=4 24814 B18R2.6470 Nc1cccc(c1SCCc2ccccc2)F 62a_100000765856_100000690935 [0,2,0,0,0,0|2,0,0]=4 24815 B18R2.6470 Nc1cccc(c1SCCc2ccccc2)O 62a_100000765856_100012183704 [0,2,0,0,0,0|2,0,0]=4 24816 B18R2.6470 Nc1cccc(c1SCCc2ccccc2)O 62a_100012183704_100011218657 [0,2,0,0,0,0|2,0,0]=4 24817 B18R2.6470 Oc1cccc(c1C=CCc2ccccc2)Br 271570a_200016263579_100010187912 [0,2,0,0,0,0|1,0,1]=4 24818 B18R2.6470 Oc1cccc(c1C=CCc2ccccc2)Cl 271570a_200016263579_100000050174 [0,2,0,0,0,0|1,0,1]=4 24819 B18R2.6470 Oc1cccc(c1C=CCc2ccccc2)F 271570a_200016263579_100009820682 [0,2,0,0,0,0|1,0,1]=4 24820 B18R2.6470 Oc1cccc(c1C=CCc2ccccc2)O 271570a_200016263579_100010205330 [0,2,0,0,0,0|1,0,1]=4 24821 B18R2.6470 Oc1cccc(c1NCCc2ccccc2)Br 34a_100011934926_100000765856 [0,2,0,0,0,0|2,0,0]=4 24822 B18R2.6470 Oc1cccc(c1NCCc2ccccc2)Cl 34a_100012022510_100000765856 [0,2,0,0,0,0|2,0,0]=4 24823 B18R2.6470 Oc1cccc(c1NCCc2ccccc2)F 34a_100020591140_100000765856 [0,2,0,0,0,0|2,0,0]=4 24824 B18R2.6470 Oc1cccc(c1SCCc2ccccc2)Br 62a_100000765856_100010187912 [0,2,0,0,0,0|2,0,0]=4 24825 B18R2.6470 Oc1cccc(c1SCCc2ccccc2)Br 62a_100010187912_100011218657 [0,2,0,0,0,0|2,0,0]=4 24826 B18R2.6470 Oc1cccc(c1SCCc2ccccc2)Cl 62a_100000765856_100000050174 [0,2,0,0,0,0|2,0,0]=4 24827 B18R2.6470 Oc1cccc(c1SCCc2ccccc2)F 62a_100000765856_100009820682 [0,2,0,0,0,0|2,0,0]=4 24828 B18R2.6470 Oc1cccc(c1SCCc2ccccc2)F 62a_100009820682_100011218657 [0,2,0,0,0,0|2,0,0]=4 24829 B18R2.6470 Oc1cccc(c1SCCc2ccccc2)O 62a_100000765856_100010205330 [0,2,0,0,0,0|2,0,0]=4 24830 B18R2.6544 Brc1cc(c(cn1)Br)CNCc2ccccc2 270004a_100015324214_100010230906 [0,2,0,0,0,0|2,0,0]=4 24831 B18R2.6544 Brc1cc(c(cn1)Br)COCc2ccccc2 34a_100010245045_100015291786 [0,2,0,0,0,0|1,0,0]=3 24832 B18R2.6544 Brc1cc(c(cn1)Br)COCc2ccccc2 7a_100010245045_100000211182 [0,2,0,0,0,0|1,0,0]=3 24833 B18R2.6544 Brc1cc(c(cn1)Br)COCc2ccccn2 34a_100010245045_100000721315 [0,2,0,0,0,0|2,0,0]=4 24834 B18R2.6544 Brc1cc(c(cn1)Br)COCc2ccccn2 7a_100010245045_100000721315 [0,2,0,0,0,0|2,0,0]=4 24835 B18R2.6544 Brc1cc(c(cn1)Br)COCc2cccnc2 34a_100010245045_100000733263 [0,2,0,0,0,0|2,0,0]=4 24836 B18R2.6544 Brc1cc(c(cn1)Br)COCc2cccnc2 7a_100010245045_100000741622 [0,2,0,0,0,0|2,0,0]=4 24837 B18R2.6544 Brc1cc(c(cn1)Br)COCc2ccncc2 7a_100010245045_100015193705 [0,2,0,0,0,0|2,0,0]=4 24838 B18R2.6544 Brc1ccc(c(c1)C=CCc2ccccc2)Br 271570a_200016263579_100011483371 [0,2,0,0,0,0|1,0,1]=4 24839 B18R2.6544 Brc1ccc(c(c1)CNCc2ccccc2)Br 207a_100000707832_100015611070 [0,2,0,0,0,0|1,0,0]=3 24840 B18R2.6544 Brc1ccc(c(c1)CNCc2ccccc2)Br 207a_100015324214_100011266429 [0,2,0,0,0,0|1,0,0]=3 24841 B18R2.6544 Brc1ccc(c(c1)CNCc2ccccc2)Br 2230a_100015324214_100011982794 [0,2,0,0,0,0|1,0,0]=3 24842 B18R2.6544 Brc1ccc(c(c1)CNCc2ccccc2)Br 270004a_100000707832_100015611070 [0,2,0,0,0,0|1,0,0]=3 24843 B18R2.6544 Brc1ccc(c(c1)CNCc2ccccc2)Br 270004a_100015324214_100011266429 [0,2,0,0,0,0|1,0,0]=3 24844 B18R2.6544 Brc1ccc(c(c1)CNCc2ccccc2)Br 34a_100000707832_100015291786 [0,2,0,0,0,0|1,0,0]=3 24845 B18R2.6544 Brc1ccc(c(c1)CNCc2ccccc2)Br 34a_100015324214_100011982794 [0,2,0,0,0,0|1,0,0]=3 24846 B18R2.6544 Brc1ccc(c(c1)CNCc2ccccc2)I 207a_100015324214_100010185651 [0,2,0,0,0,0|1,0,0]=3 24847 B18R2.6544 Brc1ccc(c(c1)CNCc2ccccc2)I 2230a_100015324214_100012362523 [0,2,0,0,0,0|1,0,0]=3 24848 B18R2.6544 Brc1ccc(c(c1)CNCc2ccccc2)I 270004a_100015324214_100010185651 [0,2,0,0,0,0|1,0,0]=3 24849 B18R2.6544 Brc1ccc(c(c1)CNCc2ccccc2)I 34a_100015324214_100012362523 [0,2,0,0,0,0|1,0,0]=3 24850 B18R2.6544 Brc1ccc(c(c1)CNCc2ccccn2)Br 207a_100000707832_100000209966 [0,2,0,0,0,0|2,0,0]=4 24851 B18R2.6544 Brc1ccc(c(c1)CNCc2ccccn2)Br 270004a_100000210449_100011266429 [0,2,0,0,0,0|2,0,0]=4 24852 B18R2.6544 Brc1ccc(c(c1)CNCc2ccccn2)Br 270004a_100000707832_100000209966 [0,2,0,0,0,0|2,0,0]=4 24853 B18R2.6544 Brc1ccc(c(c1)CNCc2ccccn2)Br 34a_100000707832_100000721315 [0,2,0,0,0,0|2,0,0]=4 24854 B18R2.6544 Brc1ccc(c(c1)CNCc2ccccn2)I 270004a_100000210449_100010185651 [0,2,0,0,0,0|2,0,0]=4 24855 B18R2.6544 Brc1ccc(c(c1)CNCc2cccnc2)Br 207a_100000210453_100011266429 [0,2,0,0,0,0|2,0,0]=4 24856 B18R2.6544 Brc1ccc(c(c1)CNCc2cccnc2)Br 207a_100000707832_100000209961 [0,2,0,0,0,0|2,0,0]=4 24857 B18R2.6544 Brc1ccc(c(c1)CNCc2cccnc2)Br 270004a_100000210453_100011266429 [0,2,0,0,0,0|2,0,0]=4 24858 B18R2.6544 Brc1ccc(c(c1)CNCc2cccnc2)Br 270004a_100000707832_100000209961 [0,2,0,0,0,0|2,0,0]=4 24859 B18R2.6544 Brc1ccc(c(c1)CNCc2cccnc2)Br 34a_100000707832_100000733263 [0,2,0,0,0,0|2,0,0]=4 24860 B18R2.6544 Brc1ccc(c(c1)CNCc2cccnc2)I 207a_100000210453_100010185651 [0,2,0,0,0,0|2,0,0]=4 24861 B18R2.6544 Brc1ccc(c(c1)CNCc2cccnc2)I 270004a_100000210453_100010185651 [0,2,0,0,0,0|2,0,0]=4 24862 B18R2.6544 Brc1ccc(c(c1)CNCc2ccncc2)Br 207a_100000707832_100000186114 [0,2,0,0,0,0|2,0,0]=4 24863 B18R2.6544 Brc1ccc(c(c1)COCc2ccccc2)Br 34a_100000210790_100011982794 [0,2,0,0,0,0|0,0,0]=2 24864 B18R2.6544 Brc1ccc(c(c1)COCc2ccccc2)Br 34a_100011266457_100015291786 [0,2,0,0,0,0|0,0,0]=2 24865 B18R2.6544 Brc1ccc(c(c1)COCc2ccccc2)Br 7a_100000210790_100011982794 [0,2,0,0,0,0|0,0,0]=2 24866 B18R2.6544 Brc1ccc(c(c1)COCc2ccccc2)Br 7a_100011266457_100000211182 [0,2,0,0,0,0|0,0,0]=2 24867 B18R2.6544 Brc1ccc(c(c1)COCc2ccccc2)I 34a_100000210790_100012362523 [0,2,0,0,0,0|0,0,0]=2 24868 B18R2.6544 Brc1ccc(c(c1)COCc2ccccc2)I 34a_100011356890_100015291786 [0,2,0,0,0,0|0,0,0]=2 24869 B18R2.6544 Brc1ccc(c(c1)COCc2ccccc2)I 7a_100000210790_100012362523 [0,2,0,0,0,0|0,0,0]=2 24870 B18R2.6544 Brc1ccc(c(c1)COCc2ccccc2)I 7a_100011356890_100000211182 [0,2,0,0,0,0|0,0,0]=2 24871 B18R2.6544 Brc1ccc(c(c1)COCc2ccccn2)Br 34a_100011266457_100000721315 [0,2,0,0,0,0|1,0,0]=3 24872 B18R2.6544 Brc1ccc(c(c1)COCc2ccccn2)Br 7a_100011266457_100000721315 [0,2,0,0,0,0|1,0,0]=3 24873 B18R2.6544 Brc1ccc(c(c1)COCc2ccccn2)I 34a_100011356890_100000721315 [0,2,0,0,0,0|1,0,0]=3 24874 B18R2.6544 Brc1ccc(c(c1)COCc2ccccn2)I 7a_100011356890_100000721315 [0,2,0,0,0,0|1,0,0]=3 24875 B18R2.6544 Brc1ccc(c(c1)COCc2cccnc2)Br 34a_100011266457_100000733263 [0,2,0,0,0,0|1,0,0]=3 24876 B18R2.6544 Brc1ccc(c(c1)COCc2cccnc2)Br 7a_100011266457_100000741622 [0,2,0,0,0,0|1,0,0]=3 24877 B18R2.6544 Brc1ccc(c(c1)COCc2cccnc2)I 34a_100011356890_100000733263 [0,2,0,0,0,0|1,0,0]=3 24878 B18R2.6544 Brc1ccc(c(c1)COCc2cccnc2)I 7a_100011356890_100000741622 [0,2,0,0,0,0|1,0,0]=3 24879 B18R2.6544 Brc1ccc(c(c1)COCc2cccnn2)Br 34a_100011266457_100016990269 [0,2,0,0,0,0|2,0,0]=4 24880 B18R2.6544 Brc1ccc(c(c1)COCc2cccnn2)Br 7a_100011266457_100016990269 [0,2,0,0,0,0|2,0,0]=4 24881 B18R2.6544 Brc1ccc(c(c1)COCc2cccnn2)I 34a_100011356890_100016990269 [0,2,0,0,0,0|2,0,0]=4 24882 B18R2.6544 Brc1ccc(c(c1)COCc2cccnn2)I 7a_100011356890_100016990269 [0,2,0,0,0,0|2,0,0]=4 24883 B18R2.6544 Brc1ccc(c(c1)COCc2ccncc2)Br 7a_100011266457_100015193705 [0,2,0,0,0,0|1,0,0]=3 24884 B18R2.6544 Brc1ccc(c(c1)COCc2ccncc2)I 7a_100011356890_100015193705 [0,2,0,0,0,0|1,0,0]=3 24885 B18R2.6544 Brc1ccc(c(c1)COCc2cnccn2)Br 34a_100011266457_100016995436 [0,2,0,0,0,0|2,0,0]=4 24886 B18R2.6544 Brc1ccc(c(c1)COCc2cnccn2)Br 7a_100011266457_100016995436 [0,2,0,0,0,0|2,0,0]=4 24887 B18R2.6544 Brc1ccc(c(c1)COCc2cnccn2)I 34a_100011356890_100016995436 [0,2,0,0,0,0|2,0,0]=4 24888 B18R2.6544 Brc1ccc(c(c1)COCc2cnccn2)I 7a_100011356890_100016995436 [0,2,0,0,0,0|2,0,0]=4 24889 B18R2.6544 Brc1ccc(c(c1)COCc2cncnc2)Br 34a_100011266457_100015196519 [0,2,0,0,0,0|2,0,0]=4 24890 B18R2.6544 Brc1ccc(c(c1)COCc2cncnc2)Br 7a_100011266457_100015196519 [0,2,0,0,0,0|2,0,0]=4 24891 B18R2.6544 Brc1ccc(c(c1)COCc2cncnc2)I 34a_100011356890_100015196519 [0,2,0,0,0,0|2,0,0]=4 24892 B18R2.6544 Brc1ccc(c(c1)COCc2cncnc2)I 7a_100011356890_100015196519 [0,2,0,0,0,0|2,0,0]=4 24893 B18R2.6544 Brc1ccc(c(c1)COCc2ncccn2)Br 34a_100011266457_100000703007 [0,2,0,0,0,0|2,0,0]=4 24894 B18R2.6544 Brc1ccc(c(c1)COCc2ncccn2)Br 7a_100011266457_100000703007 [0,2,0,0,0,0|2,0,0]=4 24895 B18R2.6544 Brc1ccc(c(c1)COCc2ncccn2)I 34a_100011356890_100000703007 [0,2,0,0,0,0|2,0,0]=4 24896 B18R2.6544 Brc1ccc(c(c1)COCc2ncccn2)I 7a_100011356890_100000703007 [0,2,0,0,0,0|2,0,0]=4 24897 B18R2.6544 Brc1ccc(c(c1)CSCc2ccccc2)Br 62a_100000211182_100011982794 [0,2,0,0,0,0|0,1,0]=3 24898 B18R2.6544 Brc1ccc(c(c1)CSCc2ccccc2)Br 62a_100011982794_100015291786 [0,2,0,0,0,0|0,1,0]=3 24899 B18R2.6544 Brc1ccc(c(c1)CSCc2ccccc2)I 62a_100000211182_100012362523 [0,2,0,0,0,0|0,1,0]=3 24900 B18R2.6544 Brc1ccc(c(c1)CSCc2ccccc2)I 62a_100012362523_100015291786 [0,2,0,0,0,0|0,1,0]=3 24901 B18R2.6544 Brc1ccc(c(c1)CSCc2ccccn2)Br 62a_100000721315_100011982794 [0,2,0,0,0,0|1,1,0]=4 24902 B18R2.6544 Brc1ccc(c(c1)CSCc2ccccn2)Br 62a_100011982794_100000721315 [0,2,0,0,0,0|1,1,0]=4 24903 B18R2.6544 Brc1ccc(c(c1)CSCc2ccccn2)I 62a_100000721315_100012362523 [0,2,0,0,0,0|1,1,0]=4 24904 B18R2.6544 Brc1ccc(c(c1)CSCc2ccccn2)I 62a_100012362523_100000721315 [0,2,0,0,0,0|1,1,0]=4 24905 B18R2.6544 Brc1ccc(c(c1)CSCc2cccnc2)Br 62a_100000741622_100011982794 [0,2,0,0,0,0|1,1,0]=4 24906 B18R2.6544 Brc1ccc(c(c1)CSCc2cccnc2)Br 62a_100011982794_100000741622 [0,2,0,0,0,0|1,1,0]=4 24907 B18R2.6544 Brc1ccc(c(c1)CSCc2cccnc2)I 62a_100000741622_100012362523 [0,2,0,0,0,0|1,1,0]=4 24908 B18R2.6544 Brc1ccc(c(c1)CSCc2cccnc2)I 62a_100012362523_100000741622 [0,2,0,0,0,0|1,1,0]=4 24909 B18R2.6544 Brc1ccc(c(c1)CSCc2ccncc2)Br 62a_100011982794_100015193705 [0,2,0,0,0,0|1,1,0]=4 24910 B18R2.6544 Brc1ccc(c(c1)CSCc2ccncc2)Br 62a_100015193705_100011982794 [0,2,0,0,0,0|1,1,0]=4 24911 B18R2.6544 Brc1ccc(c(c1)CSCc2ccncc2)I 62a_100012362523_100015193705 [0,2,0,0,0,0|1,1,0]=4 24912 B18R2.6544 Brc1ccc(c(c1)CSCc2ccncc2)I 62a_100015193705_100012362523 [0,2,0,0,0,0|1,1,0]=4 24913 B18R2.6544 Brc1ccc(c(c1)NCCc2ccccc2)Br 34a_100000737762_100000765856 [0,2,0,0,0,0|2,0,0]=4 24914 B18R2.6544 Brc1ccc(c(c1)NCCc2ccccc2)I 34a_100000743836_100000765856 [0,2,0,0,0,0|2,0,0]=4 24915 B18R2.6544 Brc1ccc(c(c1)OCCc2ccccc2)Br 34a_100011220040_100000765856 [0,2,0,0,0,0|2,0,0]=4 24916 B18R2.6544 Brc1ccc(c(c1)OCCc2ccccc2)Br 7a_100011220040_100000765856 [0,2,0,0,0,0|2,0,0]=4 24917 B18R2.6544 Brc1ccc(c(c1)OCCc2ccccc2)I 34a_100012344904_100000765856 [0,2,0,0,0,0|2,0,0]=4 24918 B18R2.6544 Brc1ccc(c(c1)OCCc2ccccc2)I 7a_100012344904_100000765856 [0,2,0,0,0,0|2,0,0]=4 24919 B18R2.6544 Brc1ccc(c(c1)SCCc2ccccc2)Br 62a_100000765856_100011483371 [0,2,0,0,0,0|2,0,0]=4 24920 B18R2.6544 Brc1ccc(c(c1)SCCc2ccccc2)Br 62a_100011483371_100011218657 [0,2,0,0,0,0|2,0,0]=4 24921 B18R2.6544 Brc1ccc(c(n1)COCc2ccccc2)Br 34a_200010065229_100015291786 [0,2,0,0,0,0|1,0,0]=3 24922 B18R2.6544 Brc1ccc(c(n1)COCc2ccccc2)Br 7a_200010065229_100000211182 [0,2,0,0,0,0|1,0,0]=3 24923 B18R2.6544 Brc1ccc(c(n1)COCc2ccccn2)Br 34a_200010065229_100000721315 [0,2,0,0,0,0|2,0,0]=4 24924 B18R2.6544 Brc1ccc(c(n1)COCc2ccccn2)Br 7a_200010065229_100000721315 [0,2,0,0,0,0|2,0,0]=4 24925 B18R2.6544 Brc1ccc(c(n1)COCc2cccnc2)Br 34a_200010065229_100000733263 [0,2,0,0,0,0|2,0,0]=4 24926 B18R2.6544 Brc1ccc(c(n1)COCc2cccnc2)Br 7a_200010065229_100000741622 [0,2,0,0,0,0|2,0,0]=4 24927 B18R2.6544 Brc1ccc(c(n1)COCc2ccncc2)Br 7a_200010065229_100015193705 [0,2,0,0,0,0|2,0,0]=4 24928 B18R2.6544 Brc1ccc(cc1CNCc2ccccc2)I 207a_100015324214_100010185652 [0,2,0,0,0,0|1,0,0]=3 24929 B18R2.6544 Brc1ccc(cc1CNCc2ccccc2)I 2230a_100015324214_100012355412 [0,2,0,0,0,0|1,0,0]=3 24930 B18R2.6544 Brc1ccc(cc1CNCc2ccccc2)I 34a_100015324214_100012355412 [0,2,0,0,0,0|1,0,0]=3 24931 B18R2.6544 Brc1ccc(cc1CNCc2cccnc2)I 207a_100000210453_100010185652 [0,2,0,0,0,0|2,0,0]=4 24932 B18R2.6544 Brc1ccc(cc1COCc2ccccc2)I 34a_100000210790_100012355412 [0,2,0,0,0,0|0,0,0]=2 24933 B18R2.6544 Brc1ccc(cc1COCc2ccccc2)I 7a_100000210790_100012355412 [0,2,0,0,0,0|0,0,0]=2 24934 B18R2.6544 Brc1ccc(cc1COCc2ccccc2)I 7a_100012359683_100000211182 [0,2,0,0,0,0|0,0,0]=2 24935 B18R2.6544 Brc1ccc(cc1COCc2ccccn2)I 7a_100012359683_100000721315 [0,2,0,0,0,0|1,0,0]=3 24936 B18R2.6544 Brc1ccc(cc1COCc2cccnc2)I 7a_100012359683_100000741622 [0,2,0,0,0,0|1,0,0]=3 24937 B18R2.6544 Brc1ccc(cc1COCc2cccnn2)I 7a_100012359683_100016990269 [0,2,0,0,0,0|2,0,0]=4 24938 B18R2.6544 Brc1ccc(cc1COCc2ccncc2)I 7a_100012359683_100015193705 [0,2,0,0,0,0|1,0,0]=3 24939 B18R2.6544 Brc1ccc(cc1COCc2cnccn2)I 7a_100012359683_100016995436 [0,2,0,0,0,0|2,0,0]=4 24940 B18R2.6544 Brc1ccc(cc1COCc2cncnc2)I 7a_100012359683_100015196519 [0,2,0,0,0,0|2,0,0]=4 24941 B18R2.6544 Brc1ccc(cc1COCc2ncccn2)I 7a_100012359683_100000703007 [0,2,0,0,0,0|2,0,0]=4 24942 B18R2.6544 Brc1ccc(cc1CSCc2ccccc2)I 62a_100000211182_100012355412 [0,2,0,0,0,0|0,1,0]=3 24943 B18R2.6544 Brc1ccc(cc1CSCc2ccccc2)I 62a_100012355412_100015291786 [0,2,0,0,0,0|0,1,0]=3 24944 B18R2.6544 Brc1ccc(cc1CSCc2ccccn2)I 62a_100000721315_100012355412 [0,2,0,0,0,0|1,1,0]=4 24945 B18R2.6544 Brc1ccc(cc1CSCc2ccccn2)I 62a_100012355412_100000721315 [0,2,0,0,0,0|1,1,0]=4 24946 B18R2.6544 Brc1ccc(cc1CSCc2cccnc2)I 62a_100000741622_100012355412 [0,2,0,0,0,0|1,1,0]=4 24947 B18R2.6544 Brc1ccc(cc1CSCc2cccnc2)I 62a_100012355412_100000741622 [0,2,0,0,0,0|1,1,0]=4 24948 B18R2.6544 Brc1ccc(cc1CSCc2ccncc2)I 62a_100012355412_100015193705 [0,2,0,0,0,0|1,1,0]=4 24949 B18R2.6544 Brc1ccc(cc1CSCc2ccncc2)I 62a_100015193705_100012355412 [0,2,0,0,0,0|1,1,0]=4 24950 B18R2.6544 Brc1ccc(cc1OCCc2ccccc2)I 34a_100012356990_100000765856 [0,2,0,0,0,0|2,0,0]=4 24951 B18R2.6544 Brc1ccc(cc1OCCc2ccccc2)I 7a_100012356990_100000765856 [0,2,0,0,0,0|2,0,0]=4 24952 B18R2.6544 Brc1cnc(c(c1)CNCc2ccccc2)Br 207a_100015324214_100010177830 [0,2,0,0,0,0|2,0,0]=4 24953 B18R2.6544 Brc1cnc(c(c1)CNCc2ccccc2)Br 2230a_100015324214_100010253922 [0,2,0,0,0,0|2,0,0]=4 24954 B18R2.6544 Brc1cnc(c(c1)CNCc2ccccc2)Br 34a_100015324214_100010253922 [0,2,0,0,0,0|2,0,0]=4 24955 B18R2.6544 Brc1cnc(c(c1)COCc2ccccc2)Br 34a_100000210790_100010253922 [0,2,0,0,0,0|1,0,0]=3 24956 B18R2.6544 Brc1cnc(c(c1)COCc2ccccc2)Br 7a_100000210790_100010253922 [0,2,0,0,0,0|1,0,0]=3 24957 B18R2.6544 Brc1cnc(c(c1)CSCc2ccccc2)Br 62a_100000211182_100010253922 [0,2,0,0,0,0|1,1,0]=4 24958 B18R2.6544 Brc1cnc(c(c1)CSCc2ccccc2)Br 62a_100010253922_100015291786 [0,2,0,0,0,0|1,1,0]=4 24959 B18R2.6544 Cc1cc(c(cn1)Br)COCc2ccccc2 34a_100015579599_100015291786 [0,2,0,0,0,0|1,0,0]=3 24960 B18R2.6544 Cc1cc(c(cn1)Br)COCc2ccccn2 34a_100015579599_100000721315 [0,2,0,0,0,0|2,0,0]=4 24961 B18R2.6544 Cc1cc(c(cn1)Br)COCc2cccnc2 34a_100015579599_100000733263 [0,2,0,0,0,0|2,0,0]=4 24962 B18R2.6544 Cc1ccc(c(c1)C=CCc2ccccc2)Br 271570a_200016263579_100012353751 [0,2,0,0,0,0|1,0,1]=4 24963 B18R2.6544 Cc1ccc(c(c1)C=CCc2ccccc2)C 271570a_200016263579_100000210833 [0,2,0,0,0,0|1,0,1]=4 24964 B18R2.6544 Cc1ccc(c(c1)C=CCc2ccccc2)Cl 271570a_200016263579_100012356289 [0,2,0,0,0,0|1,0,1]=4 24965 B18R2.6544 Cc1ccc(c(c1)C=CCc2ccccc2)F 271570a_200016263579_100000736223 [0,2,0,0,0,0|1,0,1]=4 24966 B18R2.6544 Cc1ccc(c(c1)C=CCc2ccccc2)N 271570a_200016263579_100000210942 [0,2,0,0,0,0|1,0,1]=4 24967 B18R2.6544 Cc1ccc(c(c1)C=CCc2ccccc2)O 271570a_200016263579_100000765521 [0,2,0,0,0,0|1,0,1]=4 24968 B18R2.6544 Cc1ccc(c(c1)CNCc2ccccc2)Br 207a_100015324214_100011551863 [0,2,0,0,0,0|1,0,0]=3 24969 B18R2.6544 Cc1ccc(c(c1)CNCc2ccccc2)Br 270004a_100015324214_100011551863 [0,2,0,0,0,0|1,0,0]=3 24970 B18R2.6544 Cc1ccc(c(c1)CNCc2ccccc2)C 207a_100000174964_100015611070 [0,2,0,0,0,0|1,0,0]=3 24971 B18R2.6544 Cc1ccc(c(c1)CNCc2ccccc2)C 207a_100015324214_100000211343 [0,2,0,0,0,0|1,0,0]=3 24972 B18R2.6544 Cc1ccc(c(c1)CNCc2ccccc2)C 2230a_100015324214_100000184699 [0,2,0,0,0,0|1,0,0]=3 24973 B18R2.6544 Cc1ccc(c(c1)CNCc2ccccc2)C 270004a_100000174964_100015611070 [0,2,0,0,0,0|1,0,0]=3 24974 B18R2.6544 Cc1ccc(c(c1)CNCc2ccccc2)C 270004a_100015324214_100000211343 [0,2,0,0,0,0|1,0,0]=3 24975 B18R2.6544 Cc1ccc(c(c1)CNCc2ccccc2)C 34a_100000174964_100015291786 [0,2,0,0,0,0|1,0,0]=3 24976 B18R2.6544 Cc1ccc(c(c1)CNCc2ccccc2)C 34a_100015324214_100000184699 [0,2,0,0,0,0|1,0,0]=3 24977 B18R2.6544 Cc1ccc(c(c1)CNCc2ccccc2)Cl 207a_100015324214_100011551332 [0,2,0,0,0,0|1,0,0]=3 24978 B18R2.6544 Cc1ccc(c(c1)CNCc2ccccc2)Cl 207a_100025705715_100015611070 [0,2,0,0,0,0|1,0,0]=3 24979 B18R2.6544 Cc1ccc(c(c1)CNCc2ccccc2)Cl 2230a_100015324214_100009871730 [0,2,0,0,0,0|1,0,0]=3 24980 B18R2.6544 Cc1ccc(c(c1)CNCc2ccccc2)Cl 2230a_100025705715_100015291786 [0,2,0,0,0,0|1,0,0]=3 24981 B18R2.6544 Cc1ccc(c(c1)CNCc2ccccc2)Cl 270004a_100015324214_100011551332 [0,2,0,0,0,0|1,0,0]=3 24982 B18R2.6544 Cc1ccc(c(c1)CNCc2ccccc2)Cl 270004a_100025705715_100015611070 [0,2,0,0,0,0|1,0,0]=3 24983 B18R2.6544 Cc1ccc(c(c1)CNCc2ccccc2)Cl 34a_100015324214_100009871730 [0,2,0,0,0,0|1,0,0]=3 24984 B18R2.6544 Cc1ccc(c(c1)CNCc2ccccc2)Cl 34a_100025705715_100015291786 [0,2,0,0,0,0|1,0,0]=3 24985 B18R2.6544 Cc1ccc(c(c1)CNCc2ccccc2)F 207a_100015324214_100000756917 [0,2,0,0,0,0|1,0,0]=3 24986 B18R2.6544 Cc1ccc(c(c1)CNCc2ccccc2)F 207a_100102693586_100015611070 [0,2,0,0,0,0|1,0,0]=3 24987 B18R2.6544 Cc1ccc(c(c1)CNCc2ccccc2)F 2230a_100015324214_100011260760 [0,2,0,0,0,0|1,0,0]=3 24988 B18R2.6544 Cc1ccc(c(c1)CNCc2ccccc2)F 270004a_100015324214_100000756917 [0,2,0,0,0,0|1,0,0]=3 24989 B18R2.6544 Cc1ccc(c(c1)CNCc2ccccc2)F 270004a_100102693586_100015611070 [0,2,0,0,0,0|1,0,0]=3 24990 B18R2.6544 Cc1ccc(c(c1)CNCc2ccccc2)F 34a_100015324214_100011260760 [0,2,0,0,0,0|1,0,0]=3 24991 B18R2.6544 Cc1ccc(c(c1)CNCc2ccccc2)F 34a_100102693586_100015291786 [0,2,0,0,0,0|1,0,0]=3 24992 B18R2.6544 Cc1ccc(c(c1)CNCc2ccccc2)I 207a_100015324214_100010150105 [0,2,0,0,0,0|1,0,0]=3 24993 B18R2.6544 Cc1ccc(c(c1)CNCc2ccccc2)I 270004a_100015324214_100010150105 [0,2,0,0,0,0|1,0,0]=3 24994 B18R2.6544 Cc1ccc(c(c1)CNCc2ccccn2)Br 270004a_100000210449_100011551863 [0,2,0,0,0,0|2,0,0]=4 24995 B18R2.6544 Cc1ccc(c(c1)CNCc2ccccn2)C 207a_100000174964_100000209966 [0,2,0,0,0,0|2,0,0]=4 24996 B18R2.6544 Cc1ccc(c(c1)CNCc2ccccn2)C 270004a_100000174964_100000209966 [0,2,0,0,0,0|2,0,0]=4 24997 B18R2.6544 Cc1ccc(c(c1)CNCc2ccccn2)C 270004a_100000210449_100000211343 [0,2,0,0,0,0|2,0,0]=4 24998 B18R2.6544 Cc1ccc(c(c1)CNCc2ccccn2)C 34a_100000174964_100000721315 [0,2,0,0,0,0|2,0,0]=4 24999 B18R2.6544 Cc1ccc(c(c1)CNCc2ccccn2)Cl 207a_100025705715_100000209966 [0,2,0,0,0,0|2,0,0]=4 25000 B18R2.6544 Cc1ccc(c(c1)CNCc2ccccn2)Cl 2230a_100025705715_100000721315 [0,2,0,0,0,0|2,0,0]=4 25001 B18R2.6544 Cc1ccc(c(c1)CNCc2ccccn2)Cl 270004a_100000210449_100011551332 [0,2,0,0,0,0|2,0,0]=4 25002 B18R2.6544 Cc1ccc(c(c1)CNCc2ccccn2)Cl 270004a_100025705715_100000209966 [0,2,0,0,0,0|2,0,0]=4 25003 B18R2.6544 Cc1ccc(c(c1)CNCc2ccccn2)Cl 34a_100025705715_100000721315 [0,2,0,0,0,0|2,0,0]=4 25004 B18R2.6544 Cc1ccc(c(c1)CNCc2ccccn2)F 207a_100102693586_100000209966 [0,2,0,0,0,0|2,0,0]=4 25005 B18R2.6544 Cc1ccc(c(c1)CNCc2ccccn2)F 270004a_100000210449_100000756917 [0,2,0,0,0,0|2,0,0]=4 25006 B18R2.6544 Cc1ccc(c(c1)CNCc2ccccn2)F 270004a_100102693586_100000209966 [0,2,0,0,0,0|2,0,0]=4 25007 B18R2.6544 Cc1ccc(c(c1)CNCc2ccccn2)F 34a_100102693586_100000721315 [0,2,0,0,0,0|2,0,0]=4 25008 B18R2.6544 Cc1ccc(c(c1)CNCc2ccccn2)I 270004a_100000210449_100010150105 [0,2,0,0,0,0|2,0,0]=4 25009 B18R2.6544 Cc1ccc(c(c1)CNCc2cccnc2)Br 207a_100000210453_100011551863 [0,2,0,0,0,0|2,0,0]=4 25010 B18R2.6544 Cc1ccc(c(c1)CNCc2cccnc2)Br 270004a_100000210453_100011551863 [0,2,0,0,0,0|2,0,0]=4 25011 B18R2.6544 Cc1ccc(c(c1)CNCc2cccnc2)C 207a_100000174964_100000209961 [0,2,0,0,0,0|2,0,0]=4 25012 B18R2.6544 Cc1ccc(c(c1)CNCc2cccnc2)C 207a_100000210453_100000211343 [0,2,0,0,0,0|2,0,0]=4 25013 B18R2.6544 Cc1ccc(c(c1)CNCc2cccnc2)C 270004a_100000174964_100000209961 [0,2,0,0,0,0|2,0,0]=4 25014 B18R2.6544 Cc1ccc(c(c1)CNCc2cccnc2)C 270004a_100000210453_100000211343 [0,2,0,0,0,0|2,0,0]=4 25015 B18R2.6544 Cc1ccc(c(c1)CNCc2cccnc2)C 34a_100000174964_100000733263 [0,2,0,0,0,0|2,0,0]=4 25016 B18R2.6544 Cc1ccc(c(c1)CNCc2cccnc2)Cl 207a_100000210453_100011551332 [0,2,0,0,0,0|2,0,0]=4 25017 B18R2.6544 Cc1ccc(c(c1)CNCc2cccnc2)Cl 207a_100025705715_100000209961 [0,2,0,0,0,0|2,0,0]=4 25018 B18R2.6544 Cc1ccc(c(c1)CNCc2cccnc2)Cl 2230a_100025705715_100000741622 [0,2,0,0,0,0|2,0,0]=4 25019 B18R2.6544 Cc1ccc(c(c1)CNCc2cccnc2)Cl 270004a_100000210453_100011551332 [0,2,0,0,0,0|2,0,0]=4 25020 B18R2.6544 Cc1ccc(c(c1)CNCc2cccnc2)Cl 270004a_100025705715_100000209961 [0,2,0,0,0,0|2,0,0]=4 25021 B18R2.6544 Cc1ccc(c(c1)CNCc2cccnc2)Cl 34a_100025705715_100000733263 [0,2,0,0,0,0|2,0,0]=4 25022 B18R2.6544 Cc1ccc(c(c1)CNCc2cccnc2)F 207a_100000210453_100000756917 [0,2,0,0,0,0|2,0,0]=4 25023 B18R2.6544 Cc1ccc(c(c1)CNCc2cccnc2)F 207a_100102693586_100000209961 [0,2,0,0,0,0|2,0,0]=4 25024 B18R2.6544 Cc1ccc(c(c1)CNCc2cccnc2)F 270004a_100000210453_100000756917 [0,2,0,0,0,0|2,0,0]=4 25025 B18R2.6544 Cc1ccc(c(c1)CNCc2cccnc2)F 270004a_100102693586_100000209961 [0,2,0,0,0,0|2,0,0]=4 25026 B18R2.6544 Cc1ccc(c(c1)CNCc2cccnc2)F 34a_100102693586_100000733263 [0,2,0,0,0,0|2,0,0]=4 25027 B18R2.6544 Cc1ccc(c(c1)CNCc2cccnc2)I 207a_100000210453_100010150105 [0,2,0,0,0,0|2,0,0]=4 25028 B18R2.6544 Cc1ccc(c(c1)CNCc2cccnc2)I 270004a_100000210453_100010150105 [0,2,0,0,0,0|2,0,0]=4 25029 B18R2.6544 Cc1ccc(c(c1)CNCc2ccncc2)C 207a_100000174964_100000186114 [0,2,0,0,0,0|2,0,0]=4 25030 B18R2.6544 Cc1ccc(c(c1)CNCc2ccncc2)Cl 207a_100025705715_100000186114 [0,2,0,0,0,0|2,0,0]=4 25031 B18R2.6544 Cc1ccc(c(c1)CNCc2ccncc2)Cl 2230a_100025705715_100015193705 [0,2,0,0,0,0|2,0,0]=4 25032 B18R2.6544 Cc1ccc(c(c1)CNCc2ccncc2)F 207a_100102693586_100000186114 [0,2,0,0,0,0|2,0,0]=4 25033 B18R2.6544 Cc1ccc(c(c1)COCc2ccccc2)Br 34a_100012361352_100015291786 [0,2,0,0,0,0|0,0,0]=2 25034 B18R2.6544 Cc1ccc(c(c1)COCc2ccccc2)Br 7a_100012361352_100000211182 [0,2,0,0,0,0|0,0,0]=2 25035 B18R2.6544 Cc1ccc(c(c1)COCc2ccccc2)C 34a_100000210790_100000184699 [0,2,0,0,0,0|0,0,0]=2 25036 B18R2.6544 Cc1ccc(c(c1)COCc2ccccc2)C 34a_200011215349_100015291786 [0,2,0,0,0,0|0,0,0]=2 25037 B18R2.6544 Cc1ccc(c(c1)COCc2ccccc2)C 7a_100000210790_100000184699 [0,2,0,0,0,0|0,0,0]=2 25038 B18R2.6544 Cc1ccc(c(c1)COCc2ccccc2)C 7a_200011215349_100000211182 [0,2,0,0,0,0|0,0,0]=2 25039 B18R2.6544 Cc1ccc(c(c1)COCc2ccccc2)Cl 34a_100000210790_100009871730 [0,2,0,0,0,0|0,0,0]=2 25040 B18R2.6544 Cc1ccc(c(c1)COCc2ccccc2)Cl 34a_100009878994_100015291786 [0,2,0,0,0,0|0,0,0]=2 25041 B18R2.6544 Cc1ccc(c(c1)COCc2ccccc2)Cl 7a_100000210790_100009871730 [0,2,0,0,0,0|0,0,0]=2 25042 B18R2.6544 Cc1ccc(c(c1)COCc2ccccc2)Cl 7a_100009878994_100000211182 [0,2,0,0,0,0|0,0,0]=2 25043 B18R2.6544 Cc1ccc(c(c1)COCc2ccccc2)F 34a_100000210790_100011260760 [0,2,0,0,0,0|0,0,0]=2 25044 B18R2.6544 Cc1ccc(c(c1)COCc2ccccc2)F 34a_100011692775_100015291786 [0,2,0,0,0,0|0,0,0]=2 25045 B18R2.6544 Cc1ccc(c(c1)COCc2ccccc2)F 7a_100000210790_100011260760 [0,2,0,0,0,0|0,0,0]=2 25046 B18R2.6544 Cc1ccc(c(c1)COCc2ccccc2)F 7a_100011692775_100000211182 [0,2,0,0,0,0|0,0,0]=2 25047 B18R2.6544 Cc1ccc(c(c1)COCc2ccccc2)N 34a_100011215565_100015291786 [0,2,0,0,0,0|0,0,0]=2 25048 B18R2.6544 Cc1ccc(c(c1)COCc2ccccc2)N 7a_100011215565_100000211182 [0,2,0,0,0,0|0,0,0]=2 25049 B18R2.6544 Cc1ccc(c(c1)COCc2ccccn2)Br 34a_100012361352_100000721315 [0,2,0,0,0,0|1,0,0]=3 25050 B18R2.6544 Cc1ccc(c(c1)COCc2ccccn2)Br 7a_100012361352_100000721315 [0,2,0,0,0,0|1,0,0]=3 25051 B18R2.6544 Cc1ccc(c(c1)COCc2ccccn2)C 34a_200011215349_100000721315 [0,2,0,0,0,0|1,0,0]=3 25052 B18R2.6544 Cc1ccc(c(c1)COCc2ccccn2)C 7a_200011215349_100000721315 [0,2,0,0,0,0|1,0,0]=3 25053 B18R2.6544 Cc1ccc(c(c1)COCc2ccccn2)Cl 34a_100009878994_100000721315 [0,2,0,0,0,0|1,0,0]=3 25054 B18R2.6544 Cc1ccc(c(c1)COCc2ccccn2)Cl 7a_100009878994_100000721315 [0,2,0,0,0,0|1,0,0]=3 25055 B18R2.6544 Cc1ccc(c(c1)COCc2ccccn2)F 34a_100011692775_100000721315 [0,2,0,0,0,0|1,0,0]=3 25056 B18R2.6544 Cc1ccc(c(c1)COCc2ccccn2)F 7a_100011692775_100000721315 [0,2,0,0,0,0|1,0,0]=3 25057 B18R2.6544 Cc1ccc(c(c1)COCc2ccccn2)N 34a_100011215565_100000721315 [0,2,0,0,0,0|1,0,0]=3 25058 B18R2.6544 Cc1ccc(c(c1)COCc2ccccn2)N 7a_100011215565_100000721315 [0,2,0,0,0,0|1,0,0]=3 25059 B18R2.6544 Cc1ccc(c(c1)COCc2cccnc2)Br 34a_100012361352_100000733263 [0,2,0,0,0,0|1,0,0]=3 25060 B18R2.6544 Cc1ccc(c(c1)COCc2cccnc2)Br 7a_100012361352_100000741622 [0,2,0,0,0,0|1,0,0]=3 25061 B18R2.6544 Cc1ccc(c(c1)COCc2cccnc2)C 34a_200011215349_100000733263 [0,2,0,0,0,0|1,0,0]=3 25062 B18R2.6544 Cc1ccc(c(c1)COCc2cccnc2)C 7a_200011215349_100000741622 [0,2,0,0,0,0|1,0,0]=3 25063 B18R2.6544 Cc1ccc(c(c1)COCc2cccnc2)Cl 34a_100009878994_100000733263 [0,2,0,0,0,0|1,0,0]=3 25064 B18R2.6544 Cc1ccc(c(c1)COCc2cccnc2)Cl 7a_100009878994_100000741622 [0,2,0,0,0,0|1,0,0]=3 25065 B18R2.6544 Cc1ccc(c(c1)COCc2cccnc2)F 34a_100011692775_100000733263 [0,2,0,0,0,0|1,0,0]=3 25066 B18R2.6544 Cc1ccc(c(c1)COCc2cccnc2)F 7a_100011692775_100000741622 [0,2,0,0,0,0|1,0,0]=3 25067 B18R2.6544 Cc1ccc(c(c1)COCc2cccnc2)N 34a_100011215565_100000733263 [0,2,0,0,0,0|1,0,0]=3 25068 B18R2.6544 Cc1ccc(c(c1)COCc2cccnc2)N 7a_100011215565_100000741622 [0,2,0,0,0,0|1,0,0]=3 25069 B18R2.6544 Cc1ccc(c(c1)COCc2cccnn2)Br 34a_100012361352_100016990269 [0,2,0,0,0,0|2,0,0]=4 25070 B18R2.6544 Cc1ccc(c(c1)COCc2cccnn2)Br 7a_100012361352_100016990269 [0,2,0,0,0,0|2,0,0]=4 25071 B18R2.6544 Cc1ccc(c(c1)COCc2cccnn2)C 34a_200011215349_100016990269 [0,2,0,0,0,0|2,0,0]=4 25072 B18R2.6544 Cc1ccc(c(c1)COCc2cccnn2)C 7a_200011215349_100016990269 [0,2,0,0,0,0|2,0,0]=4 25073 B18R2.6544 Cc1ccc(c(c1)COCc2cccnn2)Cl 34a_100009878994_100016990269 [0,2,0,0,0,0|2,0,0]=4 25074 B18R2.6544 Cc1ccc(c(c1)COCc2cccnn2)Cl 7a_100009878994_100016990269 [0,2,0,0,0,0|2,0,0]=4 25075 B18R2.6544 Cc1ccc(c(c1)COCc2cccnn2)F 34a_100011692775_100016990269 [0,2,0,0,0,0|2,0,0]=4 25076 B18R2.6544 Cc1ccc(c(c1)COCc2cccnn2)F 7a_100011692775_100016990269 [0,2,0,0,0,0|2,0,0]=4 25077 B18R2.6544 Cc1ccc(c(c1)COCc2cccnn2)N 34a_100011215565_100016990269 [0,2,0,0,0,0|2,0,0]=4 25078 B18R2.6544 Cc1ccc(c(c1)COCc2cccnn2)N 7a_100011215565_100016990269 [0,2,0,0,0,0|2,0,0]=4 25079 B18R2.6544 Cc1ccc(c(c1)COCc2ccncc2)Br 7a_100012361352_100015193705 [0,2,0,0,0,0|1,0,0]=3 25080 B18R2.6544 Cc1ccc(c(c1)COCc2ccncc2)C 7a_200011215349_100015193705 [0,2,0,0,0,0|1,0,0]=3 25081 B18R2.6544 Cc1ccc(c(c1)COCc2ccncc2)Cl 7a_100009878994_100015193705 [0,2,0,0,0,0|1,0,0]=3 25082 B18R2.6544 Cc1ccc(c(c1)COCc2ccncc2)F 7a_100011692775_100015193705 [0,2,0,0,0,0|1,0,0]=3 25083 B18R2.6544 Cc1ccc(c(c1)COCc2ccncc2)N 7a_100011215565_100015193705 [0,2,0,0,0,0|1,0,0]=3 25084 B18R2.6544 Cc1ccc(c(c1)COCc2cnccn2)Br 34a_100012361352_100016995436 [0,2,0,0,0,0|2,0,0]=4 25085 B18R2.6544 Cc1ccc(c(c1)COCc2cnccn2)Br 7a_100012361352_100016995436 [0,2,0,0,0,0|2,0,0]=4 25086 B18R2.6544 Cc1ccc(c(c1)COCc2cnccn2)C 34a_200011215349_100016995436 [0,2,0,0,0,0|2,0,0]=4 25087 B18R2.6544 Cc1ccc(c(c1)COCc2cnccn2)C 7a_200011215349_100016995436 [0,2,0,0,0,0|2,0,0]=4 25088 B18R2.6544 Cc1ccc(c(c1)COCc2cnccn2)Cl 34a_100009878994_100016995436 [0,2,0,0,0,0|2,0,0]=4 25089 B18R2.6544 Cc1ccc(c(c1)COCc2cnccn2)Cl 7a_100009878994_100016995436 [0,2,0,0,0,0|2,0,0]=4 25090 B18R2.6544 Cc1ccc(c(c1)COCc2cnccn2)F 34a_100011692775_100016995436 [0,2,0,0,0,0|2,0,0]=4 25091 B18R2.6544 Cc1ccc(c(c1)COCc2cnccn2)F 7a_100011692775_100016995436 [0,2,0,0,0,0|2,0,0]=4 25092 B18R2.6544 Cc1ccc(c(c1)COCc2cnccn2)N 34a_100011215565_100016995436 [0,2,0,0,0,0|2,0,0]=4 25093 B18R2.6544 Cc1ccc(c(c1)COCc2cnccn2)N 7a_100011215565_100016995436 [0,2,0,0,0,0|2,0,0]=4 25094 B18R2.6544 Cc1ccc(c(c1)COCc2cncnc2)Br 34a_100012361352_100015196519 [0,2,0,0,0,0|2,0,0]=4 25095 B18R2.6544 Cc1ccc(c(c1)COCc2cncnc2)Br 7a_100012361352_100015196519 [0,2,0,0,0,0|2,0,0]=4 25096 B18R2.6544 Cc1ccc(c(c1)COCc2cncnc2)C 34a_200011215349_100015196519 [0,2,0,0,0,0|2,0,0]=4 25097 B18R2.6544 Cc1ccc(c(c1)COCc2cncnc2)C 7a_200011215349_100015196519 [0,2,0,0,0,0|2,0,0]=4 25098 B18R2.6544 Cc1ccc(c(c1)COCc2cncnc2)Cl 34a_100009878994_100015196519 [0,2,0,0,0,0|2,0,0]=4 25099 B18R2.6544 Cc1ccc(c(c1)COCc2cncnc2)Cl 7a_100009878994_100015196519 [0,2,0,0,0,0|2,0,0]=4 25100 B18R2.6544 Cc1ccc(c(c1)COCc2cncnc2)F 34a_100011692775_100015196519 [0,2,0,0,0,0|2,0,0]=4 25101 B18R2.6544 Cc1ccc(c(c1)COCc2cncnc2)F 7a_100011692775_100015196519 [0,2,0,0,0,0|2,0,0]=4 25102 B18R2.6544 Cc1ccc(c(c1)COCc2cncnc2)N 34a_100011215565_100015196519 [0,2,0,0,0,0|2,0,0]=4 25103 B18R2.6544 Cc1ccc(c(c1)COCc2cncnc2)N 7a_100011215565_100015196519 [0,2,0,0,0,0|2,0,0]=4 25104 B18R2.6544 Cc1ccc(c(c1)COCc2ncccn2)Br 34a_100012361352_100000703007 [0,2,0,0,0,0|2,0,0]=4 25105 B18R2.6544 Cc1ccc(c(c1)COCc2ncccn2)Br 7a_100012361352_100000703007 [0,2,0,0,0,0|2,0,0]=4 25106 B18R2.6544 Cc1ccc(c(c1)COCc2ncccn2)C 34a_200011215349_100000703007 [0,2,0,0,0,0|2,0,0]=4 25107 B18R2.6544 Cc1ccc(c(c1)COCc2ncccn2)C 7a_200011215349_100000703007 [0,2,0,0,0,0|2,0,0]=4 25108 B18R2.6544 Cc1ccc(c(c1)COCc2ncccn2)Cl 34a_100009878994_100000703007 [0,2,0,0,0,0|2,0,0]=4 25109 B18R2.6544 Cc1ccc(c(c1)COCc2ncccn2)Cl 7a_100009878994_100000703007 [0,2,0,0,0,0|2,0,0]=4 25110 B18R2.6544 Cc1ccc(c(c1)COCc2ncccn2)F 34a_100011692775_100000703007 [0,2,0,0,0,0|2,0,0]=4 25111 B18R2.6544 Cc1ccc(c(c1)COCc2ncccn2)F 7a_100011692775_100000703007 [0,2,0,0,0,0|2,0,0]=4 25112 B18R2.6544 Cc1ccc(c(c1)COCc2ncccn2)N 34a_100011215565_100000703007 [0,2,0,0,0,0|2,0,0]=4 25113 B18R2.6544 Cc1ccc(c(c1)COCc2ncccn2)N 7a_100011215565_100000703007 [0,2,0,0,0,0|2,0,0]=4 25114 B18R2.6544 Cc1ccc(c(c1)CSCc2ccccc2)C 62a_100000184699_100015291786 [0,2,0,0,0,0|0,1,0]=3 25115 B18R2.6544 Cc1ccc(c(c1)CSCc2ccccc2)C 62a_100000211182_100000184699 [0,2,0,0,0,0|0,1,0]=3 25116 B18R2.6544 Cc1ccc(c(c1)CSCc2ccccc2)Cl 62a_100000211182_100009871730 [0,2,0,0,0,0|0,1,0]=3 25117 B18R2.6544 Cc1ccc(c(c1)CSCc2ccccc2)Cl 62a_100009871730_100015291786 [0,2,0,0,0,0|0,1,0]=3 25118 B18R2.6544 Cc1ccc(c(c1)CSCc2ccccc2)F 62a_100000211182_100011260760 [0,2,0,0,0,0|0,1,0]=3 25119 B18R2.6544 Cc1ccc(c(c1)CSCc2ccccc2)F 62a_100011260760_100015291786 [0,2,0,0,0,0|0,1,0]=3 25120 B18R2.6544 Cc1ccc(c(c1)CSCc2ccccn2)C 62a_100000184699_100000721315 [0,2,0,0,0,0|1,1,0]=4 25121 B18R2.6544 Cc1ccc(c(c1)CSCc2ccccn2)C 62a_100000721315_100000184699 [0,2,0,0,0,0|1,1,0]=4 25122 B18R2.6544 Cc1ccc(c(c1)CSCc2ccccn2)Cl 62a_100000721315_100009871730 [0,2,0,0,0,0|1,1,0]=4 25123 B18R2.6544 Cc1ccc(c(c1)CSCc2ccccn2)Cl 62a_100009871730_100000721315 [0,2,0,0,0,0|1,1,0]=4 25124 B18R2.6544 Cc1ccc(c(c1)CSCc2ccccn2)F 62a_100000721315_100011260760 [0,2,0,0,0,0|1,1,0]=4 25125 B18R2.6544 Cc1ccc(c(c1)CSCc2ccccn2)F 62a_100011260760_100000721315 [0,2,0,0,0,0|1,1,0]=4 25126 B18R2.6544 Cc1ccc(c(c1)CSCc2cccnc2)C 62a_100000184699_100000741622 [0,2,0,0,0,0|1,1,0]=4 25127 B18R2.6544 Cc1ccc(c(c1)CSCc2cccnc2)C 62a_100000741622_100000184699 [0,2,0,0,0,0|1,1,0]=4 25128 B18R2.6544 Cc1ccc(c(c1)CSCc2cccnc2)Cl 62a_100000741622_100009871730 [0,2,0,0,0,0|1,1,0]=4 25129 B18R2.6544 Cc1ccc(c(c1)CSCc2cccnc2)Cl 62a_100009871730_100000741622 [0,2,0,0,0,0|1,1,0]=4 25130 B18R2.6544 Cc1ccc(c(c1)CSCc2cccnc2)F 62a_100000741622_100011260760 [0,2,0,0,0,0|1,1,0]=4 25131 B18R2.6544 Cc1ccc(c(c1)CSCc2cccnc2)F 62a_100011260760_100000741622 [0,2,0,0,0,0|1,1,0]=4 25132 B18R2.6544 Cc1ccc(c(c1)CSCc2ccncc2)C 62a_100000184699_100015193705 [0,2,0,0,0,0|1,1,0]=4 25133 B18R2.6544 Cc1ccc(c(c1)CSCc2ccncc2)C 62a_100015193705_100000184699 [0,2,0,0,0,0|1,1,0]=4 25134 B18R2.6544 Cc1ccc(c(c1)CSCc2ccncc2)Cl 62a_100009871730_100015193705 [0,2,0,0,0,0|1,1,0]=4 25135 B18R2.6544 Cc1ccc(c(c1)CSCc2ccncc2)Cl 62a_100015193705_100009871730 [0,2,0,0,0,0|1,1,0]=4 25136 B18R2.6544 Cc1ccc(c(c1)CSCc2ccncc2)F 62a_100011260760_100015193705 [0,2,0,0,0,0|1,1,0]=4 25137 B18R2.6544 Cc1ccc(c(c1)CSCc2ccncc2)F 62a_100015193705_100011260760 [0,2,0,0,0,0|1,1,0]=4 25138 B18R2.6544 Cc1ccc(c(c1)NCCc2ccccc2)Br 34a_100000745044_100000765856 [0,2,0,0,0,0|2,0,0]=4 25139 B18R2.6544 Cc1ccc(c(c1)NCCc2ccccc2)C 2230a_100000185781_100000765856 [0,2,0,0,0,0|2,0,0]=4 25140 B18R2.6544 Cc1ccc(c(c1)NCCc2ccccc2)C 34a_100000185781_100000765856 [0,2,0,0,0,0|2,0,0]=4 25141 B18R2.6544 Cc1ccc(c(c1)NCCc2ccccc2)C 7a_100000185781_100000765856 [0,2,0,0,0,0|2,0,0]=4 25142 B18R2.6544 Cc1ccc(c(c1)NCCc2ccccc2)Cl 34a_100011215360_100000765856 [0,2,0,0,0,0|2,0,0]=4 25143 B18R2.6544 Cc1ccc(c(c1)NCCc2ccccc2)F 34a_100000211285_100000765856 [0,2,0,0,0,0|2,0,0]=4 25144 B18R2.6544 Cc1ccc(c(c1)NCCc2ccccc2)I 34a_100011216686_100000765856 [0,2,0,0,0,0|2,0,0]=4 25145 B18R2.6544 Cc1ccc(c(c1)NCCc2ccccc2)O 34a_100011215204_100000765856 [0,2,0,0,0,0|2,0,0]=4 25146 B18R2.6544 Cc1ccc(c(c1)OCCc2ccccc2)Br 34a_100012002257_100000765856 [0,2,0,0,0,0|2,0,0]=4 25147 B18R2.6544 Cc1ccc(c(c1)OCCc2ccccc2)Br 7a_100012002257_100000765856 [0,2,0,0,0,0|2,0,0]=4 25148 B18R2.6544 Cc1ccc(c(c1)OCCc2ccccc2)C 34a_100000210931_100000765856 [0,2,0,0,0,0|2,0,0]=4 25149 B18R2.6544 Cc1ccc(c(c1)OCCc2ccccc2)C 7a_100000210931_100000765856 [0,2,0,0,0,0|2,0,0]=4 25150 B18R2.6544 Cc1ccc(c(c1)OCCc2ccccc2)Cl 34a_100000211493_100000765856 [0,2,0,0,0,0|2,0,0]=4 25151 B18R2.6544 Cc1ccc(c(c1)OCCc2ccccc2)Cl 7a_100000211493_100000765856 [0,2,0,0,0,0|2,0,0]=4 25152 B18R2.6544 Cc1ccc(c(c1)OCCc2ccccc2)F 34a_100000759540_100000765856 [0,2,0,0,0,0|2,0,0]=4 25153 B18R2.6544 Cc1ccc(c(c1)OCCc2ccccc2)F 7a_100000759540_100000765856 [0,2,0,0,0,0|2,0,0]=4 25154 B18R2.6544 Cc1ccc(c(c1)OCCc2ccccc2)N 34a_100000211527_100000765856 [0,2,0,0,0,0|2,0,0]=4 25155 B18R2.6544 Cc1ccc(c(c1)OCCc2ccccc2)N 7a_100000211527_100000765856 [0,2,0,0,0,0|2,0,0]=4 25156 B18R2.6544 Cc1ccc(c(c1)SCCc2ccccc2)Br 62a_100000765856_100012353751 [0,2,0,0,0,0|2,0,0]=4 25157 B18R2.6544 Cc1ccc(c(c1)SCCc2ccccc2)Br 62a_100012353751_100011218657 [0,2,0,0,0,0|2,0,0]=4 25158 B18R2.6544 Cc1ccc(c(c1)SCCc2ccccc2)C 62a_100000210833_100011218657 [0,2,0,0,0,0|2,0,0]=4 25159 B18R2.6544 Cc1ccc(c(c1)SCCc2ccccc2)C 62a_100000765856_100000210833 [0,2,0,0,0,0|2,0,0]=4 25160 B18R2.6544 Cc1ccc(c(c1)SCCc2ccccc2)Cl 62a_100000765856_100012356289 [0,2,0,0,0,0|2,0,0]=4 25161 B18R2.6544 Cc1ccc(c(c1)SCCc2ccccc2)Cl 62a_100012356289_100011218657 [0,2,0,0,0,0|2,0,0]=4 25162 B18R2.6544 Cc1ccc(c(c1)SCCc2ccccc2)F 62a_100000736223_100011218657 [0,2,0,0,0,0|2,0,0]=4 25163 B18R2.6544 Cc1ccc(c(c1)SCCc2ccccc2)F 62a_100000765856_100000736223 [0,2,0,0,0,0|2,0,0]=4 25164 B18R2.6544 Cc1ccc(c(c1)SCCc2ccccc2)N 62a_100000765856_100011356834 [0,2,0,0,0,0|2,0,0]=4 25165 B18R2.6544 Cc1ccc(c(c1)SCCc2ccccc2)N 62a_100011356834_100011218657 [0,2,0,0,0,0|2,0,0]=4 25166 B18R2.6544 Cc1ccc(c(c1)SCCc2ccccc2)O 62a_100000765521_100011218657 [0,2,0,0,0,0|2,0,0]=4 25167 B18R2.6544 Cc1ccc(c(c1)SCCc2ccccc2)O 62a_100000765856_100000765521 [0,2,0,0,0,0|2,0,0]=4 25168 B18R2.6544 Cc1ccc(c(n1)CNCc2ccccc2)Br 207a_100015324214_100010173661 [0,2,0,0,0,0|2,0,0]=4 25169 B18R2.6544 Cc1ccc(c(n1)CNCc2ccccc2)Br 270004a_100015324214_100010173661 [0,2,0,0,0,0|2,0,0]=4 25170 B18R2.6544 Cc1ccc(c(n1)CNCc2ccccc2)Cl 2230a_100015324214_200009852033 [0,2,0,0,0,0|2,0,0]=4 25171 B18R2.6544 Cc1ccc(c(n1)CNCc2ccccc2)Cl 34a_100015324214_200009852033 [0,2,0,0,0,0|2,0,0]=4 25172 B18R2.6544 Cc1ccc(c(n1)CNCc2ccccc2)O 2230a_100015324214_100020630696 [0,2,0,0,0,0|2,0,0]=4 25173 B18R2.6544 Cc1ccc(c(n1)CNCc2ccccc2)O 34a_100015324214_100020630696 [0,2,0,0,0,0|2,0,0]=4 25174 B18R2.6544 Cc1ccc(c(n1)COCc2ccccc2)Br 34a_100010074375_100015291786 [0,2,0,0,0,0|1,0,0]=3 25175 B18R2.6544 Cc1ccc(c(n1)COCc2ccccc2)Cl 34a_100000210790_200009852033 [0,2,0,0,0,0|1,0,0]=3 25176 B18R2.6544 Cc1ccc(c(n1)COCc2ccccc2)Cl 7a_100000210790_200009852033 [0,2,0,0,0,0|1,0,0]=3 25177 B18R2.6544 Cc1ccc(c(n1)COCc2ccccc2)O 34a_100000210790_100020630696 [0,2,0,0,0,0|1,0,0]=3 25178 B18R2.6544 Cc1ccc(c(n1)COCc2ccccc2)O 7a_100000210790_100020630696 [0,2,0,0,0,0|1,0,0]=3 25179 B18R2.6544 Cc1ccc(c(n1)COCc2ccccn2)Br 34a_100010074375_100000721315 [0,2,0,0,0,0|2,0,0]=4 25180 B18R2.6544 Cc1ccc(c(n1)COCc2cccnc2)Br 34a_100010074375_100000733263 [0,2,0,0,0,0|2,0,0]=4 25181 B18R2.6544 Cc1ccc(c(n1)CSCc2ccccc2)Cl 62a_100000211182_200009852033 [0,2,0,0,0,0|1,1,0]=4 25182 B18R2.6544 Cc1ccc(c(n1)CSCc2ccccc2)Cl 62a_200009852033_100015291786 [0,2,0,0,0,0|1,1,0]=4 25183 B18R2.6544 Cc1ccc(c(n1)CSCc2ccccc2)O 62a_100000211182_100020630696 [0,2,0,0,0,0|1,1,0]=4 25184 B18R2.6544 Cc1ccc(c(n1)CSCc2ccccc2)O 62a_100020630696_100015291786 [0,2,0,0,0,0|1,1,0]=4 25185 B18R2.6544 Cc1ccc(cc1C=CCc2ccccc2)Br 271570a_200016263579_100011344865 [0,2,0,0,0,0|1,0,1]=4 25186 B18R2.6544 Cc1ccc(cc1C=CCc2ccccc2)Cl 271570a_200016263579_100011263213 [0,2,0,0,0,0|1,0,1]=4 25187 B18R2.6544 Cc1ccc(cc1C=CCc2ccccc2)F 271570a_200016263579_100011218078 [0,2,0,0,0,0|1,0,1]=4 25188 B18R2.6544 Cc1ccc(cc1C=CCc2ccccc2)N 271570a_200016263579_100000736455 [0,2,0,0,0,0|1,0,1]=4 25189 B18R2.6544 Cc1ccc(cc1C=CCc2ccccc2)O 271570a_200016263579_100011380479 [0,2,0,0,0,0|1,0,1]=4 25190 B18R2.6544 Cc1ccc(cc1CNCc2ccccc2)Br 207a_100015324214_100011361606 [0,2,0,0,0,0|1,0,0]=3 25191 B18R2.6544 Cc1ccc(cc1CNCc2ccccc2)Br 270004a_100015324214_100011361606 [0,2,0,0,0,0|1,0,0]=3 25192 B18R2.6544 Cc1ccc(cc1CNCc2ccccc2)Cl 207a_100000717755_100015611070 [0,2,0,0,0,0|1,0,0]=3 25193 B18R2.6544 Cc1ccc(cc1CNCc2ccccc2)Cl 207a_100015324214_100011551331 [0,2,0,0,0,0|1,0,0]=3 25194 B18R2.6544 Cc1ccc(cc1CNCc2ccccc2)Cl 2230a_100015324214_100012186985 [0,2,0,0,0,0|1,0,0]=3 25195 B18R2.6544 Cc1ccc(cc1CNCc2ccccc2)Cl 270004a_100000717755_100015611070 [0,2,0,0,0,0|1,0,0]=3 25196 B18R2.6544 Cc1ccc(cc1CNCc2ccccc2)Cl 270004a_100015324214_100011551331 [0,2,0,0,0,0|1,0,0]=3 25197 B18R2.6544 Cc1ccc(cc1CNCc2ccccc2)Cl 34a_100000717755_100015291786 [0,2,0,0,0,0|1,0,0]=3 25198 B18R2.6544 Cc1ccc(cc1CNCc2ccccc2)Cl 34a_100015324214_100012186985 [0,2,0,0,0,0|1,0,0]=3 25199 B18R2.6544 Cc1ccc(cc1CNCc2ccccc2)F 207a_100011217291_100015611070 [0,2,0,0,0,0|1,0,0]=3 25200 B18R2.6544 Cc1ccc(cc1CNCc2ccccc2)F 207a_100015324214_100000697687 [0,2,0,0,0,0|1,0,0]=3 25201 B18R2.6544 Cc1ccc(cc1CNCc2ccccc2)F 2230a_100015324214_100000709795 [0,2,0,0,0,0|1,0,0]=3 25202 B18R2.6544 Cc1ccc(cc1CNCc2ccccc2)F 270004a_100011217291_100015611070 [0,2,0,0,0,0|1,0,0]=3 25203 B18R2.6544 Cc1ccc(cc1CNCc2ccccc2)F 270004a_100015324214_100000697687 [0,2,0,0,0,0|1,0,0]=3 25204 B18R2.6544 Cc1ccc(cc1CNCc2ccccc2)F 34a_100011217291_100015291786 [0,2,0,0,0,0|1,0,0]=3 25205 B18R2.6544 Cc1ccc(cc1CNCc2ccccc2)F 34a_100015324214_100000709795 [0,2,0,0,0,0|1,0,0]=3 25206 B18R2.6544 Cc1ccc(cc1CNCc2ccccc2)O 270004a_200009844824_100015611070 [0,2,0,0,0,0|1,0,0]=3 25207 B18R2.6544 Cc1ccc(cc1CNCc2ccccc2)O 34a_200009844824_100015291786 [0,2,0,0,0,0|1,0,0]=3 25208 B18R2.6544 Cc1ccc(cc1CNCc2ccccn2)Br 270004a_100000210449_100011361606 [0,2,0,0,0,0|2,0,0]=4 25209 B18R2.6544 Cc1ccc(cc1CNCc2ccccn2)Cl 207a_100000717755_100000209966 [0,2,0,0,0,0|2,0,0]=4 25210 B18R2.6544 Cc1ccc(cc1CNCc2ccccn2)Cl 270004a_100000210449_100011551331 [0,2,0,0,0,0|2,0,0]=4 25211 B18R2.6544 Cc1ccc(cc1CNCc2ccccn2)Cl 270004a_100000717755_100000209966 [0,2,0,0,0,0|2,0,0]=4 25212 B18R2.6544 Cc1ccc(cc1CNCc2ccccn2)Cl 34a_100000717755_100000721315 [0,2,0,0,0,0|2,0,0]=4 25213 B18R2.6544 Cc1ccc(cc1CNCc2ccccn2)F 207a_100011217291_100000209966 [0,2,0,0,0,0|2,0,0]=4 25214 B18R2.6544 Cc1ccc(cc1CNCc2ccccn2)F 270004a_100000210449_100000697687 [0,2,0,0,0,0|2,0,0]=4 25215 B18R2.6544 Cc1ccc(cc1CNCc2ccccn2)F 270004a_100011217291_100000209966 [0,2,0,0,0,0|2,0,0]=4 25216 B18R2.6544 Cc1ccc(cc1CNCc2ccccn2)F 34a_100011217291_100000721315 [0,2,0,0,0,0|2,0,0]=4 25217 B18R2.6544 Cc1ccc(cc1CNCc2ccccn2)O 270004a_200009844824_100000209966 [0,2,0,0,0,0|2,0,0]=4 25218 B18R2.6544 Cc1ccc(cc1CNCc2ccccn2)O 34a_200009844824_100000721315 [0,2,0,0,0,0|2,0,0]=4 25219 B18R2.6544 Cc1ccc(cc1CNCc2cccnc2)Br 207a_100000210453_100011361606 [0,2,0,0,0,0|2,0,0]=4 25220 B18R2.6544 Cc1ccc(cc1CNCc2cccnc2)Br 270004a_100000210453_100011361606 [0,2,0,0,0,0|2,0,0]=4 25221 B18R2.6544 Cc1ccc(cc1CNCc2cccnc2)Cl 207a_100000210453_100011551331 [0,2,0,0,0,0|2,0,0]=4 25222 B18R2.6544 Cc1ccc(cc1CNCc2cccnc2)Cl 207a_100000717755_100000209961 [0,2,0,0,0,0|2,0,0]=4 25223 B18R2.6544 Cc1ccc(cc1CNCc2cccnc2)Cl 270004a_100000210453_100011551331 [0,2,0,0,0,0|2,0,0]=4 25224 B18R2.6544 Cc1ccc(cc1CNCc2cccnc2)Cl 270004a_100000717755_100000209961 [0,2,0,0,0,0|2,0,0]=4 25225 B18R2.6544 Cc1ccc(cc1CNCc2cccnc2)Cl 34a_100000717755_100000733263 [0,2,0,0,0,0|2,0,0]=4 25226 B18R2.6544 Cc1ccc(cc1CNCc2cccnc2)F 207a_100000210453_100000697687 [0,2,0,0,0,0|2,0,0]=4 25227 B18R2.6544 Cc1ccc(cc1CNCc2cccnc2)F 207a_100011217291_100000209961 [0,2,0,0,0,0|2,0,0]=4 25228 B18R2.6544 Cc1ccc(cc1CNCc2cccnc2)F 270004a_100000210453_100000697687 [0,2,0,0,0,0|2,0,0]=4 25229 B18R2.6544 Cc1ccc(cc1CNCc2cccnc2)F 270004a_100011217291_100000209961 [0,2,0,0,0,0|2,0,0]=4 25230 B18R2.6544 Cc1ccc(cc1CNCc2cccnc2)F 34a_100011217291_100000733263 [0,2,0,0,0,0|2,0,0]=4 25231 B18R2.6544 Cc1ccc(cc1CNCc2cccnc2)O 270004a_200009844824_100000209961 [0,2,0,0,0,0|2,0,0]=4 25232 B18R2.6544 Cc1ccc(cc1CNCc2cccnc2)O 34a_200009844824_100000733263 [0,2,0,0,0,0|2,0,0]=4 25233 B18R2.6544 Cc1ccc(cc1CNCc2ccncc2)Cl 207a_100000717755_100000186114 [0,2,0,0,0,0|2,0,0]=4 25234 B18R2.6544 Cc1ccc(cc1CNCc2ccncc2)F 207a_100011217291_100000186114 [0,2,0,0,0,0|2,0,0]=4 25235 B18R2.6544 Cc1ccc(cc1COCc2ccccc2)Br 34a_100000700630_100015291786 [0,2,0,0,0,0|0,0,0]=2 25236 B18R2.6544 Cc1ccc(cc1COCc2ccccc2)Br 7a_100000700630_100000211182 [0,2,0,0,0,0|0,0,0]=2 25237 B18R2.6544 Cc1ccc(cc1COCc2ccccc2)Cl 34a_100000210790_100012186985 [0,2,0,0,0,0|0,0,0]=2 25238 B18R2.6544 Cc1ccc(cc1COCc2ccccc2)Cl 34a_100012002407_100015291786 [0,2,0,0,0,0|0,0,0]=2 25239 B18R2.6544 Cc1ccc(cc1COCc2ccccc2)Cl 7a_100000210790_100012186985 [0,2,0,0,0,0|0,0,0]=2 25240 B18R2.6544 Cc1ccc(cc1COCc2ccccc2)Cl 7a_100012002407_100000211182 [0,2,0,0,0,0|0,0,0]=2 25241 B18R2.6544 Cc1ccc(cc1COCc2ccccc2)F 34a_100000210790_100000709795 [0,2,0,0,0,0|0,0,0]=2 25242 B18R2.6544 Cc1ccc(cc1COCc2ccccc2)F 34a_100011219218_100015291786 [0,2,0,0,0,0|0,0,0]=2 25243 B18R2.6544 Cc1ccc(cc1COCc2ccccc2)F 7a_100000210790_100000709795 [0,2,0,0,0,0|0,0,0]=2 25244 B18R2.6544 Cc1ccc(cc1COCc2ccccc2)F 7a_100011219218_100000211182 [0,2,0,0,0,0|0,0,0]=2 25245 B18R2.6544 Cc1ccc(cc1COCc2ccccc2)I 34a_100010150140_100015291786 [0,2,0,0,0,0|0,0,0]=2 25246 B18R2.6544 Cc1ccc(cc1COCc2ccccc2)I 7a_100010150140_100000211182 [0,2,0,0,0,0|0,0,0]=2 25247 B18R2.6544 Cc1ccc(cc1COCc2ccccn2)Br 34a_100000700630_100000721315 [0,2,0,0,0,0|1,0,0]=3 25248 B18R2.6544 Cc1ccc(cc1COCc2ccccn2)Br 7a_100000700630_100000721315 [0,2,0,0,0,0|1,0,0]=3 25249 B18R2.6544 Cc1ccc(cc1COCc2ccccn2)Cl 34a_100012002407_100000721315 [0,2,0,0,0,0|1,0,0]=3 25250 B18R2.6544 Cc1ccc(cc1COCc2ccccn2)Cl 7a_100012002407_100000721315 [0,2,0,0,0,0|1,0,0]=3 25251 B18R2.6544 Cc1ccc(cc1COCc2ccccn2)F 34a_100011219218_100000721315 [0,2,0,0,0,0|1,0,0]=3 25252 B18R2.6544 Cc1ccc(cc1COCc2ccccn2)F 7a_100011219218_100000721315 [0,2,0,0,0,0|1,0,0]=3 25253 B18R2.6544 Cc1ccc(cc1COCc2ccccn2)I 34a_100010150140_100000721315 [0,2,0,0,0,0|1,0,0]=3 25254 B18R2.6544 Cc1ccc(cc1COCc2ccccn2)I 7a_100010150140_100000721315 [0,2,0,0,0,0|1,0,0]=3 25255 B18R2.6544 Cc1ccc(cc1COCc2cccnc2)Br 34a_100000700630_100000733263 [0,2,0,0,0,0|1,0,0]=3 25256 B18R2.6544 Cc1ccc(cc1COCc2cccnc2)Br 7a_100000700630_100000741622 [0,2,0,0,0,0|1,0,0]=3 25257 B18R2.6544 Cc1ccc(cc1COCc2cccnc2)Cl 34a_100012002407_100000733263 [0,2,0,0,0,0|1,0,0]=3 25258 B18R2.6544 Cc1ccc(cc1COCc2cccnc2)Cl 7a_100012002407_100000741622 [0,2,0,0,0,0|1,0,0]=3 25259 B18R2.6544 Cc1ccc(cc1COCc2cccnc2)F 34a_100011219218_100000733263 [0,2,0,0,0,0|1,0,0]=3 25260 B18R2.6544 Cc1ccc(cc1COCc2cccnc2)F 7a_100011219218_100000741622 [0,2,0,0,0,0|1,0,0]=3 25261 B18R2.6544 Cc1ccc(cc1COCc2cccnc2)I 34a_100010150140_100000733263 [0,2,0,0,0,0|1,0,0]=3 25262 B18R2.6544 Cc1ccc(cc1COCc2cccnc2)I 7a_100010150140_100000741622 [0,2,0,0,0,0|1,0,0]=3 25263 B18R2.6544 Cc1ccc(cc1COCc2cccnn2)Br 34a_100000700630_100016990269 [0,2,0,0,0,0|2,0,0]=4 25264 B18R2.6544 Cc1ccc(cc1COCc2cccnn2)Br 7a_100000700630_100016990269 [0,2,0,0,0,0|2,0,0]=4 25265 B18R2.6544 Cc1ccc(cc1COCc2cccnn2)Cl 34a_100012002407_100016990269 [0,2,0,0,0,0|2,0,0]=4 25266 B18R2.6544 Cc1ccc(cc1COCc2cccnn2)Cl 7a_100012002407_100016990269 [0,2,0,0,0,0|2,0,0]=4 25267 B18R2.6544 Cc1ccc(cc1COCc2cccnn2)F 34a_100011219218_100016990269 [0,2,0,0,0,0|2,0,0]=4 25268 B18R2.6544 Cc1ccc(cc1COCc2cccnn2)F 7a_100011219218_100016990269 [0,2,0,0,0,0|2,0,0]=4 25269 B18R2.6544 Cc1ccc(cc1COCc2cccnn2)I 34a_100010150140_100016990269 [0,2,0,0,0,0|2,0,0]=4 25270 B18R2.6544 Cc1ccc(cc1COCc2cccnn2)I 7a_100010150140_100016990269 [0,2,0,0,0,0|2,0,0]=4 25271 B18R2.6544 Cc1ccc(cc1COCc2ccncc2)Br 7a_100000700630_100015193705 [0,2,0,0,0,0|1,0,0]=3 25272 B18R2.6544 Cc1ccc(cc1COCc2ccncc2)Cl 7a_100012002407_100015193705 [0,2,0,0,0,0|1,0,0]=3 25273 B18R2.6544 Cc1ccc(cc1COCc2ccncc2)F 7a_100011219218_100015193705 [0,2,0,0,0,0|1,0,0]=3 25274 B18R2.6544 Cc1ccc(cc1COCc2ccncc2)I 7a_100010150140_100015193705 [0,2,0,0,0,0|1,0,0]=3 25275 B18R2.6544 Cc1ccc(cc1COCc2cnccn2)Br 34a_100000700630_100016995436 [0,2,0,0,0,0|2,0,0]=4 25276 B18R2.6544 Cc1ccc(cc1COCc2cnccn2)Br 7a_100000700630_100016995436 [0,2,0,0,0,0|2,0,0]=4 25277 B18R2.6544 Cc1ccc(cc1COCc2cnccn2)Cl 34a_100012002407_100016995436 [0,2,0,0,0,0|2,0,0]=4 25278 B18R2.6544 Cc1ccc(cc1COCc2cnccn2)Cl 7a_100012002407_100016995436 [0,2,0,0,0,0|2,0,0]=4 25279 B18R2.6544 Cc1ccc(cc1COCc2cnccn2)F 34a_100011219218_100016995436 [0,2,0,0,0,0|2,0,0]=4 25280 B18R2.6544 Cc1ccc(cc1COCc2cnccn2)F 7a_100011219218_100016995436 [0,2,0,0,0,0|2,0,0]=4 25281 B18R2.6544 Cc1ccc(cc1COCc2cnccn2)I 34a_100010150140_100016995436 [0,2,0,0,0,0|2,0,0]=4 25282 B18R2.6544 Cc1ccc(cc1COCc2cnccn2)I 7a_100010150140_100016995436 [0,2,0,0,0,0|2,0,0]=4 25283 B18R2.6544 Cc1ccc(cc1COCc2cncnc2)Br 34a_100000700630_100015196519 [0,2,0,0,0,0|2,0,0]=4 25284 B18R2.6544 Cc1ccc(cc1COCc2cncnc2)Br 7a_100000700630_100015196519 [0,2,0,0,0,0|2,0,0]=4 25285 B18R2.6544 Cc1ccc(cc1COCc2cncnc2)Cl 34a_100012002407_100015196519 [0,2,0,0,0,0|2,0,0]=4 25286 B18R2.6544 Cc1ccc(cc1COCc2cncnc2)Cl 7a_100012002407_100015196519 [0,2,0,0,0,0|2,0,0]=4 25287 B18R2.6544 Cc1ccc(cc1COCc2cncnc2)F 34a_100011219218_100015196519 [0,2,0,0,0,0|2,0,0]=4 25288 B18R2.6544 Cc1ccc(cc1COCc2cncnc2)F 7a_100011219218_100015196519 [0,2,0,0,0,0|2,0,0]=4 25289 B18R2.6544 Cc1ccc(cc1COCc2cncnc2)I 34a_100010150140_100015196519 [0,2,0,0,0,0|2,0,0]=4 25290 B18R2.6544 Cc1ccc(cc1COCc2cncnc2)I 7a_100010150140_100015196519 [0,2,0,0,0,0|2,0,0]=4 25291 B18R2.6544 Cc1ccc(cc1COCc2ncccn2)Br 34a_100000700630_100000703007 [0,2,0,0,0,0|2,0,0]=4 25292 B18R2.6544 Cc1ccc(cc1COCc2ncccn2)Br 7a_100000700630_100000703007 [0,2,0,0,0,0|2,0,0]=4 25293 B18R2.6544 Cc1ccc(cc1COCc2ncccn2)Cl 34a_100012002407_100000703007 [0,2,0,0,0,0|2,0,0]=4 25294 B18R2.6544 Cc1ccc(cc1COCc2ncccn2)Cl 7a_100012002407_100000703007 [0,2,0,0,0,0|2,0,0]=4 25295 B18R2.6544 Cc1ccc(cc1COCc2ncccn2)F 34a_100011219218_100000703007 [0,2,0,0,0,0|2,0,0]=4 25296 B18R2.6544 Cc1ccc(cc1COCc2ncccn2)F 7a_100011219218_100000703007 [0,2,0,0,0,0|2,0,0]=4 25297 B18R2.6544 Cc1ccc(cc1COCc2ncccn2)I 34a_100010150140_100000703007 [0,2,0,0,0,0|2,0,0]=4 25298 B18R2.6544 Cc1ccc(cc1COCc2ncccn2)I 7a_100010150140_100000703007 [0,2,0,0,0,0|2,0,0]=4 25299 B18R2.6544 Cc1ccc(cc1CSCc2ccccc2)Cl 62a_100000211182_100012186985 [0,2,0,0,0,0|0,1,0]=3 25300 B18R2.6544 Cc1ccc(cc1CSCc2ccccc2)Cl 62a_100012186985_100015291786 [0,2,0,0,0,0|0,1,0]=3 25301 B18R2.6544 Cc1ccc(cc1CSCc2ccccc2)F 62a_100000211182_100000709795 [0,2,0,0,0,0|0,1,0]=3 25302 B18R2.6544 Cc1ccc(cc1CSCc2ccccc2)F 62a_100000709795_100015291786 [0,2,0,0,0,0|0,1,0]=3 25303 B18R2.6544 Cc1ccc(cc1CSCc2ccccn2)Cl 62a_100000721315_100012186985 [0,2,0,0,0,0|1,1,0]=4 25304 B18R2.6544 Cc1ccc(cc1CSCc2ccccn2)Cl 62a_100012186985_100000721315 [0,2,0,0,0,0|1,1,0]=4 25305 B18R2.6544 Cc1ccc(cc1CSCc2ccccn2)F 62a_100000709795_100000721315 [0,2,0,0,0,0|1,1,0]=4 25306 B18R2.6544 Cc1ccc(cc1CSCc2ccccn2)F 62a_100000721315_100000709795 [0,2,0,0,0,0|1,1,0]=4 25307 B18R2.6544 Cc1ccc(cc1CSCc2cccnc2)Cl 62a_100000741622_100012186985 [0,2,0,0,0,0|1,1,0]=4 25308 B18R2.6544 Cc1ccc(cc1CSCc2cccnc2)Cl 62a_100012186985_100000741622 [0,2,0,0,0,0|1,1,0]=4 25309 B18R2.6544 Cc1ccc(cc1CSCc2cccnc2)F 62a_100000709795_100000741622 [0,2,0,0,0,0|1,1,0]=4 25310 B18R2.6544 Cc1ccc(cc1CSCc2cccnc2)F 62a_100000741622_100000709795 [0,2,0,0,0,0|1,1,0]=4 25311 B18R2.6544 Cc1ccc(cc1CSCc2ccncc2)Cl 62a_100012186985_100015193705 [0,2,0,0,0,0|1,1,0]=4 25312 B18R2.6544 Cc1ccc(cc1CSCc2ccncc2)Cl 62a_100015193705_100012186985 [0,2,0,0,0,0|1,1,0]=4 25313 B18R2.6544 Cc1ccc(cc1CSCc2ccncc2)F 62a_100000709795_100015193705 [0,2,0,0,0,0|1,1,0]=4 25314 B18R2.6544 Cc1ccc(cc1CSCc2ccncc2)F 62a_100015193705_100000709795 [0,2,0,0,0,0|1,1,0]=4 25315 B18R2.6544 Cc1ccc(cc1NCCc2ccccc2)Br 34a_100000741167_100000765856 [0,2,0,0,0,0|2,0,0]=4 25316 B18R2.6544 Cc1ccc(cc1NCCc2ccccc2)Br 7a_100000741167_100000765856 [0,2,0,0,0,0|2,0,0]=4 25317 B18R2.6544 Cc1ccc(cc1NCCc2ccccc2)Cl 34a_100000211374_100000765856 [0,2,0,0,0,0|2,0,0]=4 25318 B18R2.6544 Cc1ccc(cc1NCCc2ccccc2)Cl 7a_100000211374_100000765856 [0,2,0,0,0,0|2,0,0]=4 25319 B18R2.6544 Cc1ccc(cc1NCCc2ccccc2)F 34a_100000211107_100000765856 [0,2,0,0,0,0|2,0,0]=4 25320 B18R2.6544 Cc1ccc(cc1NCCc2ccccc2)F 7a_100000211107_100000765856 [0,2,0,0,0,0|2,0,0]=4 25321 B18R2.6544 Cc1ccc(cc1NCCc2ccccc2)I 7a_100000761890_100000765856 [0,2,0,0,0,0|2,0,0]=4 25322 B18R2.6544 Cc1ccc(cc1NCCc2ccccc2)O 34a_100011216113_100000765856 [0,2,0,0,0,0|2,0,0]=4 25323 B18R2.6544 Cc1ccc(cc1OCCc2ccccc2)Br 34a_100000685420_100000765856 [0,2,0,0,0,0|2,0,0]=4 25324 B18R2.6544 Cc1ccc(cc1OCCc2ccccc2)Br 7a_100000685420_100000765856 [0,2,0,0,0,0|2,0,0]=4 25325 B18R2.6544 Cc1ccc(cc1OCCc2ccccc2)Cl 34a_100000756515_100000765856 [0,2,0,0,0,0|2,0,0]=4 25326 B18R2.6544 Cc1ccc(cc1OCCc2ccccc2)Cl 7a_100000756515_100000765856 [0,2,0,0,0,0|2,0,0]=4 25327 B18R2.6544 Cc1ccc(cc1OCCc2ccccc2)F 34a_100000690566_100000765856 [0,2,0,0,0,0|2,0,0]=4 25328 B18R2.6544 Cc1ccc(cc1OCCc2ccccc2)F 7a_100000690566_100000765856 [0,2,0,0,0,0|2,0,0]=4 25329 B18R2.6544 Cc1ccc(cc1OCCc2ccccc2)I 7a_100000766334_100000765856 [0,2,0,0,0,0|2,0,0]=4 25330 B18R2.6544 Cc1ccc(cc1OCCc2ccccc2)N 34a_100000759471_100000765856 [0,2,0,0,0,0|2,0,0]=4 25331 B18R2.6544 Cc1ccc(cc1OCCc2ccccc2)N 7a_100000759471_100000765856 [0,2,0,0,0,0|2,0,0]=4 25332 B18R2.6544 Cc1ccc(cc1SCCc2ccccc2)Br 62a_100000765856_100011344865 [0,2,0,0,0,0|2,0,0]=4 25333 B18R2.6544 Cc1ccc(cc1SCCc2ccccc2)Br 62a_100011344865_100011218657 [0,2,0,0,0,0|2,0,0]=4 25334 B18R2.6544 Cc1ccc(cc1SCCc2ccccc2)Cl 62a_100000765856_100011263213 [0,2,0,0,0,0|2,0,0]=4 25335 B18R2.6544 Cc1ccc(cc1SCCc2ccccc2)Cl 62a_100011263213_100011218657 [0,2,0,0,0,0|2,0,0]=4 25336 B18R2.6544 Cc1ccc(cc1SCCc2ccccc2)F 62a_100000765856_100011218078 [0,2,0,0,0,0|2,0,0]=4 25337 B18R2.6544 Cc1ccc(cc1SCCc2ccccc2)F 62a_100011218078_100011218657 [0,2,0,0,0,0|2,0,0]=4 25338 B18R2.6544 Cc1ccc(cc1SCCc2ccccc2)N 62a_100000736455_100011218657 [0,2,0,0,0,0|2,0,0]=4 25339 B18R2.6544 Cc1ccc(cc1SCCc2ccccc2)N 62a_100000765856_100000736455 [0,2,0,0,0,0|2,0,0]=4 25340 B18R2.6544 Cc1ccc(cc1SCCc2ccccc2)O 62a_100000765856_100011380479 [0,2,0,0,0,0|2,0,0]=4 25341 B18R2.6544 Cc1ccc(cc1SCCc2ccccc2)O 62a_100011380479_100011218657 [0,2,0,0,0,0|2,0,0]=4 25342 B18R2.6544 Cc1cnc(c(c1)CNCc2ccccc2)Cl 207a_100015324214_100000050350 [0,2,0,0,0,0|2,0,0]=4 25343 B18R2.6544 Cc1cnc(c(c1)CNCc2ccccc2)F 207a_100015324214_100009854360 [0,2,0,0,0,0|2,0,0]=4 25344 B18R2.6544 Cc1cnc(c(c1)COCc2ccccc2)Cl 34a_100000118064_100015291786 [0,2,0,0,0,0|1,0,0]=3 25345 B18R2.6544 Cc1cnc(c(c1)COCc2ccccc2)Cl 7a_100000118064_100000211182 [0,2,0,0,0,0|1,0,0]=3 25346 B18R2.6544 Cc1cnc(c(c1)COCc2ccccn2)Cl 34a_100000118064_100000721315 [0,2,0,0,0,0|2,0,0]=4 25347 B18R2.6544 Cc1cnc(c(c1)COCc2ccccn2)Cl 7a_100000118064_100000721315 [0,2,0,0,0,0|2,0,0]=4 25348 B18R2.6544 Cc1cnc(c(c1)COCc2cccnc2)Cl 34a_100000118064_100000733263 [0,2,0,0,0,0|2,0,0]=4 25349 B18R2.6544 Cc1cnc(c(c1)COCc2cccnc2)Cl 7a_100000118064_100000741622 [0,2,0,0,0,0|2,0,0]=4 25350 B18R2.6544 Cc1cnc(c(c1)COCc2ccncc2)Cl 7a_100000118064_100015193705 [0,2,0,0,0,0|2,0,0]=4 25351 B18R2.6544 Cc1ncc(cc1CNCc2ccccc2)Cl 207a_100015324214_100000100030 [0,2,0,0,0,0|2,0,0]=4 25352 B18R2.6544 Cc1ncc(cc1CNCc2ccccc2)Cl 270004a_100015324214_100000100030 [0,2,0,0,0,0|2,0,0]=4 25353 B18R2.6544 Cc1ncc(cc1COCc2ccccc2)Br 34a_100010894652_100015291786 [0,2,0,0,0,0|1,0,0]=3 25354 B18R2.6544 Cc1ncc(cc1COCc2ccccc2)Br 7a_100010894652_100000211182 [0,2,0,0,0,0|1,0,0]=3 25355 B18R2.6544 Cc1ncc(cc1COCc2ccccn2)Br 34a_100010894652_100000721315 [0,2,0,0,0,0|2,0,0]=4 25356 B18R2.6544 Cc1ncc(cc1COCc2ccccn2)Br 7a_100010894652_100000721315 [0,2,0,0,0,0|2,0,0]=4 25357 B18R2.6544 Cc1ncc(cc1COCc2cccnc2)Br 34a_100010894652_100000733263 [0,2,0,0,0,0|2,0,0]=4 25358 B18R2.6544 Cc1ncc(cc1COCc2cccnc2)Br 7a_100010894652_100000741622 [0,2,0,0,0,0|2,0,0]=4 25359 B18R2.6544 Cc1ncc(cc1COCc2ccncc2)Br 7a_100010894652_100015193705 [0,2,0,0,0,0|2,0,0]=4 25360 B18R2.6544 Clc1cc(c(cn1)Br)COCc2ccccc2 34a_100010245067_100015291786 [0,2,0,0,0,0|1,0,0]=3 25361 B18R2.6544 Clc1cc(c(cn1)Br)COCc2ccccc2 7a_100010245067_100000211182 [0,2,0,0,0,0|1,0,0]=3 25362 B18R2.6544 Clc1cc(c(cn1)Br)COCc2ccccn2 34a_100010245067_100000721315 [0,2,0,0,0,0|2,0,0]=4 25363 B18R2.6544 Clc1cc(c(cn1)Br)COCc2ccccn2 7a_100010245067_100000721315 [0,2,0,0,0,0|2,0,0]=4 25364 B18R2.6544 Clc1cc(c(cn1)Br)COCc2cccnc2 34a_100010245067_100000733263 [0,2,0,0,0,0|2,0,0]=4 25365 B18R2.6544 Clc1cc(c(cn1)Br)COCc2cccnc2 7a_100010245067_100000741622 [0,2,0,0,0,0|2,0,0]=4 25366 B18R2.6544 Clc1cc(c(cn1)Br)COCc2ccncc2 7a_100010245067_100015193705 [0,2,0,0,0,0|2,0,0]=4 25367 B18R2.6544 Clc1cc(c(cn1)Cl)CNCc2ccccc2 270004a_100015324214_100000050890 [0,2,0,0,0,0|2,0,0]=4 25368 B18R2.6544 Clc1cc(c(cn1)Cl)COCc2ccccc2 34a_100000081519_100015291786 [0,2,0,0,0,0|1,0,0]=3 25369 B18R2.6544 Clc1cc(c(cn1)Cl)COCc2ccccc2 7a_100000081519_100000211182 [0,2,0,0,0,0|1,0,0]=3 25370 B18R2.6544 Clc1cc(c(cn1)Cl)COCc2ccccn2 34a_100000081519_100000721315 [0,2,0,0,0,0|2,0,0]=4 25371 B18R2.6544 Clc1cc(c(cn1)Cl)COCc2ccccn2 7a_100000081519_100000721315 [0,2,0,0,0,0|2,0,0]=4 25372 B18R2.6544 Clc1cc(c(cn1)Cl)COCc2cccnc2 34a_100000081519_100000733263 [0,2,0,0,0,0|2,0,0]=4 25373 B18R2.6544 Clc1cc(c(cn1)Cl)COCc2cccnc2 7a_100000081519_100000741622 [0,2,0,0,0,0|2,0,0]=4 25374 B18R2.6544 Clc1cc(c(cn1)Cl)COCc2ccncc2 7a_100000081519_100015193705 [0,2,0,0,0,0|2,0,0]=4 25375 B18R2.6544 Clc1ccc(c(c1)C=CCc2ccccc2)Br 271570a_200016263579_100012339723 [0,2,0,0,0,0|1,0,1]=4 25376 B18R2.6544 Clc1ccc(c(c1)C=CCc2ccccc2)Cl 271570a_200016263579_100000707729 [0,2,0,0,0,0|1,0,1]=4 25377 B18R2.6544 Clc1ccc(c(c1)CNCc2ccccc2)Br 207a_100015324214_100000746314 [0,2,0,0,0,0|1,0,0]=3 25378 B18R2.6544 Clc1ccc(c(c1)CNCc2ccccc2)Br 2230a_100015324214_100000733903 [0,2,0,0,0,0|1,0,0]=3 25379 B18R2.6544 Clc1ccc(c(c1)CNCc2ccccc2)Br 270004a_100015324214_100000746314 [0,2,0,0,0,0|1,0,0]=3 25380 B18R2.6544 Clc1ccc(c(c1)CNCc2ccccc2)Br 34a_100015324214_100000733903 [0,2,0,0,0,0|1,0,0]=3 25381 B18R2.6544 Clc1ccc(c(c1)CNCc2ccccc2)Cl 207a_100015324214_100000746308 [0,2,0,0,0,0|1,0,0]=3 25382 B18R2.6544 Clc1ccc(c(c1)CNCc2ccccc2)Cl 207a_100102946428_100015611070 [0,2,0,0,0,0|1,0,0]=3 25383 B18R2.6544 Clc1ccc(c(c1)CNCc2ccccc2)Cl 2230a_100015324214_100000756322 [0,2,0,0,0,0|1,0,0]=3 25384 B18R2.6544 Clc1ccc(c(c1)CNCc2ccccc2)Cl 270004a_100015324214_100000746308 [0,2,0,0,0,0|1,0,0]=3 25385 B18R2.6544 Clc1ccc(c(c1)CNCc2ccccc2)Cl 270004a_100102946428_100015611070 [0,2,0,0,0,0|1,0,0]=3 25386 B18R2.6544 Clc1ccc(c(c1)CNCc2ccccc2)Cl 34a_100015324214_100000756322 [0,2,0,0,0,0|1,0,0]=3 25387 B18R2.6544 Clc1ccc(c(c1)CNCc2ccccc2)Cl 34a_100102946428_100015291786 [0,2,0,0,0,0|1,0,0]=3 25388 B18R2.6544 Clc1ccc(c(c1)CNCc2ccccc2)I 207a_100015324214_100010254386 [0,2,0,0,0,0|1,0,0]=3 25389 B18R2.6544 Clc1ccc(c(c1)CNCc2ccccc2)I 2230a_100015324214_100012348826 [0,2,0,0,0,0|1,0,0]=3 25390 B18R2.6544 Clc1ccc(c(c1)CNCc2ccccc2)I 270004a_100015324214_100010254386 [0,2,0,0,0,0|1,0,0]=3 25391 B18R2.6544 Clc1ccc(c(c1)CNCc2ccccc2)I 34a_100015324214_100012348826 [0,2,0,0,0,0|1,0,0]=3 25392 B18R2.6544 Clc1ccc(c(c1)CNCc2ccccn2)Br 270004a_100000210449_100000746314 [0,2,0,0,0,0|2,0,0]=4 25393 B18R2.6544 Clc1ccc(c(c1)CNCc2ccccn2)Cl 207a_100102946428_100000209966 [0,2,0,0,0,0|2,0,0]=4 25394 B18R2.6544 Clc1ccc(c(c1)CNCc2ccccn2)Cl 270004a_100000210449_100000746308 [0,2,0,0,0,0|2,0,0]=4 25395 B18R2.6544 Clc1ccc(c(c1)CNCc2ccccn2)Cl 270004a_100102946428_100000209966 [0,2,0,0,0,0|2,0,0]=4 25396 B18R2.6544 Clc1ccc(c(c1)CNCc2ccccn2)Cl 34a_100102946428_100000721315 [0,2,0,0,0,0|2,0,0]=4 25397 B18R2.6544 Clc1ccc(c(c1)CNCc2ccccn2)I 270004a_100000210449_100010254386 [0,2,0,0,0,0|2,0,0]=4 25398 B18R2.6544 Clc1ccc(c(c1)CNCc2cccnc2)Br 207a_100000210453_100000746314 [0,2,0,0,0,0|2,0,0]=4 25399 B18R2.6544 Clc1ccc(c(c1)CNCc2cccnc2)Br 270004a_100000210453_100000746314 [0,2,0,0,0,0|2,0,0]=4 25400 B18R2.6544 Clc1ccc(c(c1)CNCc2cccnc2)Cl 207a_100000210453_100000746308 [0,2,0,0,0,0|2,0,0]=4 25401 B18R2.6544 Clc1ccc(c(c1)CNCc2cccnc2)Cl 207a_100102946428_100000209961 [0,2,0,0,0,0|2,0,0]=4 25402 B18R2.6544 Clc1ccc(c(c1)CNCc2cccnc2)Cl 270004a_100000210453_100000746308 [0,2,0,0,0,0|2,0,0]=4 25403 B18R2.6544 Clc1ccc(c(c1)CNCc2cccnc2)Cl 270004a_100102946428_100000209961 [0,2,0,0,0,0|2,0,0]=4 25404 B18R2.6544 Clc1ccc(c(c1)CNCc2cccnc2)Cl 34a_100102946428_100000733263 [0,2,0,0,0,0|2,0,0]=4 25405 B18R2.6544 Clc1ccc(c(c1)CNCc2cccnc2)I 207a_100000210453_100010254386 [0,2,0,0,0,0|2,0,0]=4 25406 B18R2.6544 Clc1ccc(c(c1)CNCc2cccnc2)I 270004a_100000210453_100010254386 [0,2,0,0,0,0|2,0,0]=4 25407 B18R2.6544 Clc1ccc(c(c1)CNCc2ccncc2)Cl 207a_100102946428_100000186114 [0,2,0,0,0,0|2,0,0]=4 25408 B18R2.6544 Clc1ccc(c(c1)COCc2ccccc2)Br 34a_100000210790_100000733903 [0,2,0,0,0,0|0,0,0]=2 25409 B18R2.6544 Clc1ccc(c(c1)COCc2ccccc2)Br 34a_100012355668_100015291786 [0,2,0,0,0,0|0,0,0]=2 25410 B18R2.6544 Clc1ccc(c(c1)COCc2ccccc2)Br 7a_100000210790_100000733903 [0,2,0,0,0,0|0,0,0]=2 25411 B18R2.6544 Clc1ccc(c(c1)COCc2ccccc2)Br 7a_100012355668_100000211182 [0,2,0,0,0,0|0,0,0]=2 25412 B18R2.6544 Clc1ccc(c(c1)COCc2ccccc2)Cl 34a_100000210790_100000756322 [0,2,0,0,0,0|0,0,0]=2 25413 B18R2.6544 Clc1ccc(c(c1)COCc2ccccc2)Cl 34a_100000698905_100015291786 [0,2,0,0,0,0|0,0,0]=2 25414 B18R2.6544 Clc1ccc(c(c1)COCc2ccccc2)Cl 7a_100000210790_100000756322 [0,2,0,0,0,0|0,0,0]=2 25415 B18R2.6544 Clc1ccc(c(c1)COCc2ccccc2)Cl 7a_100000698905_100000211182 [0,2,0,0,0,0|0,0,0]=2 25416 B18R2.6544 Clc1ccc(c(c1)COCc2ccccc2)I 34a_100000210790_100012348826 [0,2,0,0,0,0|0,0,0]=2 25417 B18R2.6544 Clc1ccc(c(c1)COCc2ccccc2)I 7a_100000210790_100012348826 [0,2,0,0,0,0|0,0,0]=2 25418 B18R2.6544 Clc1ccc(c(c1)COCc2ccccn2)Br 34a_100012355668_100000721315 [0,2,0,0,0,0|1,0,0]=3 25419 B18R2.6544 Clc1ccc(c(c1)COCc2ccccn2)Br 7a_100012355668_100000721315 [0,2,0,0,0,0|1,0,0]=3 25420 B18R2.6544 Clc1ccc(c(c1)COCc2ccccn2)Cl 34a_100000698905_100000721315 [0,2,0,0,0,0|1,0,0]=3 25421 B18R2.6544 Clc1ccc(c(c1)COCc2ccccn2)Cl 7a_100000698905_100000721315 [0,2,0,0,0,0|1,0,0]=3 25422 B18R2.6544 Clc1ccc(c(c1)COCc2cccnc2)Br 34a_100012355668_100000733263 [0,2,0,0,0,0|1,0,0]=3 25423 B18R2.6544 Clc1ccc(c(c1)COCc2cccnc2)Br 7a_100012355668_100000741622 [0,2,0,0,0,0|1,0,0]=3 25424 B18R2.6544 Clc1ccc(c(c1)COCc2cccnc2)Cl 34a_100000698905_100000733263 [0,2,0,0,0,0|1,0,0]=3 25425 B18R2.6544 Clc1ccc(c(c1)COCc2cccnc2)Cl 7a_100000698905_100000741622 [0,2,0,0,0,0|1,0,0]=3 25426 B18R2.6544 Clc1ccc(c(c1)COCc2cccnn2)Br 34a_100012355668_100016990269 [0,2,0,0,0,0|2,0,0]=4 25427 B18R2.6544 Clc1ccc(c(c1)COCc2cccnn2)Br 7a_100012355668_100016990269 [0,2,0,0,0,0|2,0,0]=4 25428 B18R2.6544 Clc1ccc(c(c1)COCc2cccnn2)Cl 34a_100000698905_100016990269 [0,2,0,0,0,0|2,0,0]=4 25429 B18R2.6544 Clc1ccc(c(c1)COCc2cccnn2)Cl 7a_100000698905_100016990269 [0,2,0,0,0,0|2,0,0]=4 25430 B18R2.6544 Clc1ccc(c(c1)COCc2ccncc2)Br 7a_100012355668_100015193705 [0,2,0,0,0,0|1,0,0]=3 25431 B18R2.6544 Clc1ccc(c(c1)COCc2ccncc2)Cl 7a_100000698905_100015193705 [0,2,0,0,0,0|1,0,0]=3 25432 B18R2.6544 Clc1ccc(c(c1)COCc2cnccn2)Br 34a_100012355668_100016995436 [0,2,0,0,0,0|2,0,0]=4 25433 B18R2.6544 Clc1ccc(c(c1)COCc2cnccn2)Br 7a_100012355668_100016995436 [0,2,0,0,0,0|2,0,0]=4 25434 B18R2.6544 Clc1ccc(c(c1)COCc2cnccn2)Cl 34a_100000698905_100016995436 [0,2,0,0,0,0|2,0,0]=4 25435 B18R2.6544 Clc1ccc(c(c1)COCc2cnccn2)Cl 7a_100000698905_100016995436 [0,2,0,0,0,0|2,0,0]=4 25436 B18R2.6544 Clc1ccc(c(c1)COCc2cncnc2)Br 34a_100012355668_100015196519 [0,2,0,0,0,0|2,0,0]=4 25437 B18R2.6544 Clc1ccc(c(c1)COCc2cncnc2)Br 7a_100012355668_100015196519 [0,2,0,0,0,0|2,0,0]=4 25438 B18R2.6544 Clc1ccc(c(c1)COCc2cncnc2)Cl 34a_100000698905_100015196519 [0,2,0,0,0,0|2,0,0]=4 25439 B18R2.6544 Clc1ccc(c(c1)COCc2cncnc2)Cl 7a_100000698905_100015196519 [0,2,0,0,0,0|2,0,0]=4 25440 B18R2.6544 Clc1ccc(c(c1)COCc2ncccn2)Br 34a_100012355668_100000703007 [0,2,0,0,0,0|2,0,0]=4 25441 B18R2.6544 Clc1ccc(c(c1)COCc2ncccn2)Br 7a_100012355668_100000703007 [0,2,0,0,0,0|2,0,0]=4 25442 B18R2.6544 Clc1ccc(c(c1)COCc2ncccn2)Cl 34a_100000698905_100000703007 [0,2,0,0,0,0|2,0,0]=4 25443 B18R2.6544 Clc1ccc(c(c1)COCc2ncccn2)Cl 7a_100000698905_100000703007 [0,2,0,0,0,0|2,0,0]=4 25444 B18R2.6544 Clc1ccc(c(c1)CSCc2ccccc2)Br 62a_100000211182_100000733903 [0,2,0,0,0,0|0,1,0]=3 25445 B18R2.6544 Clc1ccc(c(c1)CSCc2ccccc2)Br 62a_100000733903_100015291786 [0,2,0,0,0,0|0,1,0]=3 25446 B18R2.6544 Clc1ccc(c(c1)CSCc2ccccc2)Cl 62a_100000211182_100000756322 [0,2,0,0,0,0|0,1,0]=3 25447 B18R2.6544 Clc1ccc(c(c1)CSCc2ccccc2)Cl 62a_100000756322_100015291786 [0,2,0,0,0,0|0,1,0]=3 25448 B18R2.6544 Clc1ccc(c(c1)CSCc2ccccc2)I 62a_100000211182_100012348826 [0,2,0,0,0,0|0,1,0]=3 25449 B18R2.6544 Clc1ccc(c(c1)CSCc2ccccc2)I 62a_100012348826_100015291786 [0,2,0,0,0,0|0,1,0]=3 25450 B18R2.6544 Clc1ccc(c(c1)CSCc2ccccn2)Br 62a_100000721315_100000733903 [0,2,0,0,0,0|1,1,0]=4 25451 B18R2.6544 Clc1ccc(c(c1)CSCc2ccccn2)Br 62a_100000733903_100000721315 [0,2,0,0,0,0|1,1,0]=4 25452 B18R2.6544 Clc1ccc(c(c1)CSCc2ccccn2)Cl 62a_100000721315_100000756322 [0,2,0,0,0,0|1,1,0]=4 25453 B18R2.6544 Clc1ccc(c(c1)CSCc2ccccn2)Cl 62a_100000756322_100000721315 [0,2,0,0,0,0|1,1,0]=4 25454 B18R2.6544 Clc1ccc(c(c1)CSCc2ccccn2)I 62a_100000721315_100012348826 [0,2,0,0,0,0|1,1,0]=4 25455 B18R2.6544 Clc1ccc(c(c1)CSCc2ccccn2)I 62a_100012348826_100000721315 [0,2,0,0,0,0|1,1,0]=4 25456 B18R2.6544 Clc1ccc(c(c1)CSCc2cccnc2)Br 62a_100000733903_100000741622 [0,2,0,0,0,0|1,1,0]=4 25457 B18R2.6544 Clc1ccc(c(c1)CSCc2cccnc2)Br 62a_100000741622_100000733903 [0,2,0,0,0,0|1,1,0]=4 25458 B18R2.6544 Clc1ccc(c(c1)CSCc2cccnc2)Cl 62a_100000741622_100000756322 [0,2,0,0,0,0|1,1,0]=4 25459 B18R2.6544 Clc1ccc(c(c1)CSCc2cccnc2)Cl 62a_100000756322_100000741622 [0,2,0,0,0,0|1,1,0]=4 25460 B18R2.6544 Clc1ccc(c(c1)CSCc2cccnc2)I 62a_100000741622_100012348826 [0,2,0,0,0,0|1,1,0]=4 25461 B18R2.6544 Clc1ccc(c(c1)CSCc2cccnc2)I 62a_100012348826_100000741622 [0,2,0,0,0,0|1,1,0]=4 25462 B18R2.6544 Clc1ccc(c(c1)CSCc2ccncc2)Br 62a_100000733903_100015193705 [0,2,0,0,0,0|1,1,0]=4 25463 B18R2.6544 Clc1ccc(c(c1)CSCc2ccncc2)Br 62a_100015193705_100000733903 [0,2,0,0,0,0|1,1,0]=4 25464 B18R2.6544 Clc1ccc(c(c1)CSCc2ccncc2)Cl 62a_100000756322_100015193705 [0,2,0,0,0,0|1,1,0]=4 25465 B18R2.6544 Clc1ccc(c(c1)CSCc2ccncc2)Cl 62a_100015193705_100000756322 [0,2,0,0,0,0|1,1,0]=4 25466 B18R2.6544 Clc1ccc(c(c1)CSCc2ccncc2)I 62a_100012348826_100015193705 [0,2,0,0,0,0|1,1,0]=4 25467 B18R2.6544 Clc1ccc(c(c1)CSCc2ccncc2)I 62a_100015193705_100012348826 [0,2,0,0,0,0|1,1,0]=4 25468 B18R2.6544 Clc1ccc(c(c1)NCCc2ccccc2)Br 34a_100000687073_100000765856 [0,2,0,0,0,0|2,0,0]=4 25469 B18R2.6544 Clc1ccc(c(c1)NCCc2ccccc2)Cl 34a_100000184485_100000765856 [0,2,0,0,0,0|2,0,0]=4 25470 B18R2.6544 Clc1ccc(c(c1)NCCc2ccccc2)I 34a_100000761886_100000765856 [0,2,0,0,0,0|2,0,0]=4 25471 B18R2.6544 Clc1ccc(c(c1)OCCc2ccccc2)Br 34a_100012339455_100000765856 [0,2,0,0,0,0|2,0,0]=4 25472 B18R2.6544 Clc1ccc(c(c1)OCCc2ccccc2)Br 7a_100012339455_100000765856 [0,2,0,0,0,0|2,0,0]=4 25473 B18R2.6544 Clc1ccc(c(c1)OCCc2ccccc2)Cl 34a_100000211422_100000765856 [0,2,0,0,0,0|2,0,0]=4 25474 B18R2.6544 Clc1ccc(c(c1)OCCc2ccccc2)Cl 7a_100000211422_100000765856 [0,2,0,0,0,0|2,0,0]=4 25475 B18R2.6544 Clc1ccc(c(c1)OCCc2ccccc2)I 34a_100000050036_100000765856 [0,2,0,0,0,0|2,0,0]=4 25476 B18R2.6544 Clc1ccc(c(c1)OCCc2ccccc2)I 7a_100000050036_100000765856 [0,2,0,0,0,0|2,0,0]=4 25477 B18R2.6544 Clc1ccc(c(c1)SCCc2ccccc2)Br 62a_100000765856_100012339723 [0,2,0,0,0,0|2,0,0]=4 25478 B18R2.6544 Clc1ccc(c(c1)SCCc2ccccc2)Br 62a_100012339723_100011218657 [0,2,0,0,0,0|2,0,0]=4 25479 B18R2.6544 Clc1ccc(c(c1)SCCc2ccccc2)Cl 62a_100000707729_100011218657 [0,2,0,0,0,0|2,0,0]=4 25480 B18R2.6544 Clc1ccc(c(c1)SCCc2ccccc2)Cl 62a_100000765856_100000707729 [0,2,0,0,0,0|2,0,0]=4 25481 B18R2.6544 Clc1ccc(c(n1)CNCc2ccccc2)Br 270004a_100015324214_100000734296 [0,2,0,0,0,0|2,0,0]=4 25482 B18R2.6544 Clc1ccc(c(n1)CNCc2ccccc2)Cl 2230a_100015324214_100000059412 [0,2,0,0,0,0|2,0,0]=4 25483 B18R2.6544 Clc1ccc(c(n1)CNCc2ccccc2)Cl 270004a_100015324214_100011935248 [0,2,0,0,0,0|2,0,0]=4 25484 B18R2.6544 Clc1ccc(c(n1)CNCc2ccccc2)Cl 34a_100015324214_100000059412 [0,2,0,0,0,0|2,0,0]=4 25485 B18R2.6544 Clc1ccc(c(n1)COCc2ccccc2)Br 34a_100010244999_100015291786 [0,2,0,0,0,0|1,0,0]=3 25486 B18R2.6544 Clc1ccc(c(n1)COCc2ccccc2)Cl 34a_100000210790_100000059412 [0,2,0,0,0,0|1,0,0]=3 25487 B18R2.6544 Clc1ccc(c(n1)COCc2ccccc2)Cl 34a_100000749784_100015291786 [0,2,0,0,0,0|1,0,0]=3 25488 B18R2.6544 Clc1ccc(c(n1)COCc2ccccc2)Cl 7a_100000210790_100000059412 [0,2,0,0,0,0|1,0,0]=3 25489 B18R2.6544 Clc1ccc(c(n1)COCc2ccccn2)Br 34a_100010244999_100000721315 [0,2,0,0,0,0|2,0,0]=4 25490 B18R2.6544 Clc1ccc(c(n1)COCc2ccccn2)Cl 34a_100000749784_100000721315 [0,2,0,0,0,0|2,0,0]=4 25491 B18R2.6544 Clc1ccc(c(n1)COCc2cccnc2)Br 34a_100010244999_100000733263 [0,2,0,0,0,0|2,0,0]=4 25492 B18R2.6544 Clc1ccc(c(n1)COCc2cccnc2)Cl 34a_100000749784_100000733263 [0,2,0,0,0,0|2,0,0]=4 25493 B18R2.6544 Clc1ccc(c(n1)CSCc2ccccc2)Cl 62a_100000059412_100015291786 [0,2,0,0,0,0|1,1,0]=4 25494 B18R2.6544 Clc1ccc(c(n1)CSCc2ccccc2)Cl 62a_100000211182_100000059412 [0,2,0,0,0,0|1,1,0]=4 25495 B18R2.6544 Clc1ccc(cc1C=CCc2ccccc2)Br 271570a_200016263579_100011772130 [0,2,0,0,0,0|1,0,1]=4 25496 B18R2.6544 Clc1ccc(cc1CNCc2ccccc2)Br 207a_100015324214_100000746309 [0,2,0,0,0,0|1,0,0]=3 25497 B18R2.6544 Clc1ccc(cc1CNCc2ccccc2)Br 207a_100025772652_100015611070 [0,2,0,0,0,0|1,0,0]=3 25498 B18R2.6544 Clc1ccc(cc1CNCc2ccccc2)Br 2230a_100015324214_100000763347 [0,2,0,0,0,0|1,0,0]=3 25499 B18R2.6544 Clc1ccc(cc1CNCc2ccccc2)Br 270004a_100015324214_100000746309 [0,2,0,0,0,0|1,0,0]=3 25500 B18R2.6544 Clc1ccc(cc1CNCc2ccccc2)Br 270004a_100025772652_100015611070 [0,2,0,0,0,0|1,0,0]=3 25501 B18R2.6544 Clc1ccc(cc1CNCc2ccccc2)Br 34a_100015324214_100000763347 [0,2,0,0,0,0|1,0,0]=3 25502 B18R2.6544 Clc1ccc(cc1CNCc2ccccc2)Br 34a_100025772652_100015291786 [0,2,0,0,0,0|1,0,0]=3 25503 B18R2.6544 Clc1ccc(cc1CNCc2ccccc2)I 207a_100015324214_100010254384 [0,2,0,0,0,0|1,0,0]=3 25504 B18R2.6544 Clc1ccc(cc1CNCc2ccccc2)I 2230a_100015324214_100010188191 [0,2,0,0,0,0|1,0,0]=3 25505 B18R2.6544 Clc1ccc(cc1CNCc2ccccc2)I 34a_100015324214_100010188191 [0,2,0,0,0,0|1,0,0]=3 25506 B18R2.6544 Clc1ccc(cc1CNCc2ccccn2)Br 207a_100025772652_100000209966 [0,2,0,0,0,0|2,0,0]=4 25507 B18R2.6544 Clc1ccc(cc1CNCc2ccccn2)Br 270004a_100000210449_100000746309 [0,2,0,0,0,0|2,0,0]=4 25508 B18R2.6544 Clc1ccc(cc1CNCc2ccccn2)Br 270004a_100025772652_100000209966 [0,2,0,0,0,0|2,0,0]=4 25509 B18R2.6544 Clc1ccc(cc1CNCc2ccccn2)Br 34a_100025772652_100000721315 [0,2,0,0,0,0|2,0,0]=4 25510 B18R2.6544 Clc1ccc(cc1CNCc2cccnc2)Br 207a_100000210453_100000746309 [0,2,0,0,0,0|2,0,0]=4 25511 B18R2.6544 Clc1ccc(cc1CNCc2cccnc2)Br 207a_100025772652_100000209961 [0,2,0,0,0,0|2,0,0]=4 25512 B18R2.6544 Clc1ccc(cc1CNCc2cccnc2)Br 270004a_100000210453_100000746309 [0,2,0,0,0,0|2,0,0]=4 25513 B18R2.6544 Clc1ccc(cc1CNCc2cccnc2)Br 270004a_100025772652_100000209961 [0,2,0,0,0,0|2,0,0]=4 25514 B18R2.6544 Clc1ccc(cc1CNCc2cccnc2)Br 34a_100025772652_100000733263 [0,2,0,0,0,0|2,0,0]=4 25515 B18R2.6544 Clc1ccc(cc1CNCc2cccnc2)I 207a_100000210453_100010254384 [0,2,0,0,0,0|2,0,0]=4 25516 B18R2.6544 Clc1ccc(cc1CNCc2ccncc2)Br 207a_100025772652_100000186114 [0,2,0,0,0,0|2,0,0]=4 25517 B18R2.6544 Clc1ccc(cc1COCc2ccccc2)Br 34a_100000210790_100000763347 [0,2,0,0,0,0|0,0,0]=2 25518 B18R2.6544 Clc1ccc(cc1COCc2ccccc2)Br 34a_100011215897_100015291786 [0,2,0,0,0,0|0,0,0]=2 25519 B18R2.6544 Clc1ccc(cc1COCc2ccccc2)Br 7a_100000210790_100000763347 [0,2,0,0,0,0|0,0,0]=2 25520 B18R2.6544 Clc1ccc(cc1COCc2ccccc2)Br 7a_100011215897_100000211182 [0,2,0,0,0,0|0,0,0]=2 25521 B18R2.6544 Clc1ccc(cc1COCc2ccccc2)I 34a_100000210790_100010188191 [0,2,0,0,0,0|0,0,0]=2 25522 B18R2.6544 Clc1ccc(cc1COCc2ccccc2)I 34a_100010128486_100015291786 [0,2,0,0,0,0|0,0,0]=2 25523 B18R2.6544 Clc1ccc(cc1COCc2ccccc2)I 7a_100000210790_100010188191 [0,2,0,0,0,0|0,0,0]=2 25524 B18R2.6544 Clc1ccc(cc1COCc2ccccc2)I 7a_100010128486_100000211182 [0,2,0,0,0,0|0,0,0]=2 25525 B18R2.6544 Clc1ccc(cc1COCc2ccccn2)Br 34a_100011215897_100000721315 [0,2,0,0,0,0|1,0,0]=3 25526 B18R2.6544 Clc1ccc(cc1COCc2ccccn2)Br 7a_100011215897_100000721315 [0,2,0,0,0,0|1,0,0]=3 25527 B18R2.6544 Clc1ccc(cc1COCc2ccccn2)I 34a_100010128486_100000721315 [0,2,0,0,0,0|1,0,0]=3 25528 B18R2.6544 Clc1ccc(cc1COCc2ccccn2)I 7a_100010128486_100000721315 [0,2,0,0,0,0|1,0,0]=3 25529 B18R2.6544 Clc1ccc(cc1COCc2cccnc2)Br 34a_100011215897_100000733263 [0,2,0,0,0,0|1,0,0]=3 25530 B18R2.6544 Clc1ccc(cc1COCc2cccnc2)Br 7a_100011215897_100000741622 [0,2,0,0,0,0|1,0,0]=3 25531 B18R2.6544 Clc1ccc(cc1COCc2cccnc2)I 34a_100010128486_100000733263 [0,2,0,0,0,0|1,0,0]=3 25532 B18R2.6544 Clc1ccc(cc1COCc2cccnc2)I 7a_100010128486_100000741622 [0,2,0,0,0,0|1,0,0]=3 25533 B18R2.6544 Clc1ccc(cc1COCc2cccnn2)Br 34a_100011215897_100016990269 [0,2,0,0,0,0|2,0,0]=4 25534 B18R2.6544 Clc1ccc(cc1COCc2cccnn2)Br 7a_100011215897_100016990269 [0,2,0,0,0,0|2,0,0]=4 25535 B18R2.6544 Clc1ccc(cc1COCc2cccnn2)I 34a_100010128486_100016990269 [0,2,0,0,0,0|2,0,0]=4 25536 B18R2.6544 Clc1ccc(cc1COCc2cccnn2)I 7a_100010128486_100016990269 [0,2,0,0,0,0|2,0,0]=4 25537 B18R2.6544 Clc1ccc(cc1COCc2ccncc2)Br 7a_100011215897_100015193705 [0,2,0,0,0,0|1,0,0]=3 25538 B18R2.6544 Clc1ccc(cc1COCc2ccncc2)I 7a_100010128486_100015193705 [0,2,0,0,0,0|1,0,0]=3 25539 B18R2.6544 Clc1ccc(cc1COCc2cnccn2)Br 34a_100011215897_100016995436 [0,2,0,0,0,0|2,0,0]=4 25540 B18R2.6544 Clc1ccc(cc1COCc2cnccn2)Br 7a_100011215897_100016995436 [0,2,0,0,0,0|2,0,0]=4 25541 B18R2.6544 Clc1ccc(cc1COCc2cnccn2)I 34a_100010128486_100016995436 [0,2,0,0,0,0|2,0,0]=4 25542 B18R2.6544 Clc1ccc(cc1COCc2cnccn2)I 7a_100010128486_100016995436 [0,2,0,0,0,0|2,0,0]=4 25543 B18R2.6544 Clc1ccc(cc1COCc2cncnc2)Br 34a_100011215897_100015196519 [0,2,0,0,0,0|2,0,0]=4 25544 B18R2.6544 Clc1ccc(cc1COCc2cncnc2)Br 7a_100011215897_100015196519 [0,2,0,0,0,0|2,0,0]=4 25545 B18R2.6544 Clc1ccc(cc1COCc2cncnc2)I 34a_100010128486_100015196519 [0,2,0,0,0,0|2,0,0]=4 25546 B18R2.6544 Clc1ccc(cc1COCc2cncnc2)I 7a_100010128486_100015196519 [0,2,0,0,0,0|2,0,0]=4 25547 B18R2.6544 Clc1ccc(cc1COCc2ncccn2)Br 34a_100011215897_100000703007 [0,2,0,0,0,0|2,0,0]=4 25548 B18R2.6544 Clc1ccc(cc1COCc2ncccn2)Br 7a_100011215897_100000703007 [0,2,0,0,0,0|2,0,0]=4 25549 B18R2.6544 Clc1ccc(cc1COCc2ncccn2)I 34a_100010128486_100000703007 [0,2,0,0,0,0|2,0,0]=4 25550 B18R2.6544 Clc1ccc(cc1COCc2ncccn2)I 7a_100010128486_100000703007 [0,2,0,0,0,0|2,0,0]=4 25551 B18R2.6544 Clc1ccc(cc1CSCc2ccccc2)Br 62a_100000211182_100000763347 [0,2,0,0,0,0|0,1,0]=3 25552 B18R2.6544 Clc1ccc(cc1CSCc2ccccc2)Br 62a_100000763347_100015291786 [0,2,0,0,0,0|0,1,0]=3 25553 B18R2.6544 Clc1ccc(cc1CSCc2ccccc2)I 62a_100000211182_100010188191 [0,2,0,0,0,0|0,1,0]=3 25554 B18R2.6544 Clc1ccc(cc1CSCc2ccccc2)I 62a_100010188191_100015291786 [0,2,0,0,0,0|0,1,0]=3 25555 B18R2.6544 Clc1ccc(cc1CSCc2ccccn2)Br 62a_100000721315_100000763347 [0,2,0,0,0,0|1,1,0]=4 25556 B18R2.6544 Clc1ccc(cc1CSCc2ccccn2)Br 62a_100000763347_100000721315 [0,2,0,0,0,0|1,1,0]=4 25557 B18R2.6544 Clc1ccc(cc1CSCc2ccccn2)I 62a_100000721315_100010188191 [0,2,0,0,0,0|1,1,0]=4 25558 B18R2.6544 Clc1ccc(cc1CSCc2ccccn2)I 62a_100010188191_100000721315 [0,2,0,0,0,0|1,1,0]=4 25559 B18R2.6544 Clc1ccc(cc1CSCc2cccnc2)Br 62a_100000741622_100000763347 [0,2,0,0,0,0|1,1,0]=4 25560 B18R2.6544 Clc1ccc(cc1CSCc2cccnc2)Br 62a_100000763347_100000741622 [0,2,0,0,0,0|1,1,0]=4 25561 B18R2.6544 Clc1ccc(cc1CSCc2cccnc2)I 62a_100000741622_100010188191 [0,2,0,0,0,0|1,1,0]=4 25562 B18R2.6544 Clc1ccc(cc1CSCc2cccnc2)I 62a_100010188191_100000741622 [0,2,0,0,0,0|1,1,0]=4 25563 B18R2.6544 Clc1ccc(cc1CSCc2ccncc2)Br 62a_100000763347_100015193705 [0,2,0,0,0,0|1,1,0]=4 25564 B18R2.6544 Clc1ccc(cc1CSCc2ccncc2)Br 62a_100015193705_100000763347 [0,2,0,0,0,0|1,1,0]=4 25565 B18R2.6544 Clc1ccc(cc1CSCc2ccncc2)I 62a_100010188191_100015193705 [0,2,0,0,0,0|1,1,0]=4 25566 B18R2.6544 Clc1ccc(cc1CSCc2ccncc2)I 62a_100015193705_100010188191 [0,2,0,0,0,0|1,1,0]=4 25567 B18R2.6544 Clc1ccc(cc1NCCc2ccccc2)Br 34a_100000750497_100000765856 [0,2,0,0,0,0|2,0,0]=4 25568 B18R2.6544 Clc1ccc(cc1NCCc2ccccc2)I 34a_200000761891_100000765856 [0,2,0,0,0,0|2,0,0]=4 25569 B18R2.6544 Clc1ccc(cc1OCCc2ccccc2)Br 34a_100000738945_100000765856 [0,2,0,0,0,0|2,0,0]=4 25570 B18R2.6544 Clc1ccc(cc1OCCc2ccccc2)Br 7a_100000738945_100000765856 [0,2,0,0,0,0|2,0,0]=4 25571 B18R2.6544 Clc1ccc(cc1OCCc2ccccc2)I 34a_100011356854_100000765856 [0,2,0,0,0,0|2,0,0]=4 25572 B18R2.6544 Clc1ccc(cc1OCCc2ccccc2)I 7a_100011356854_100000765856 [0,2,0,0,0,0|2,0,0]=4 25573 B18R2.6544 Clc1ccc(cc1SCCc2ccccc2)Br 62a_100000765856_100011772130 [0,2,0,0,0,0|2,0,0]=4 25574 B18R2.6544 Clc1ccc(cc1SCCc2ccccc2)Br 62a_100011772130_100011218657 [0,2,0,0,0,0|2,0,0]=4 25575 B18R2.6544 Clc1cnc(c(c1)CNCc2ccccc2)Cl 207a_100015324214_100000086932 [0,2,0,0,0,0|2,0,0]=4 25576 B18R2.6544 Clc1cnc(c(c1)COCc2ccccc2)Br 34a_200010065233_100015291786 [0,2,0,0,0,0|1,0,0]=3 25577 B18R2.6544 Clc1cnc(c(c1)COCc2ccccc2)Br 7a_200010065233_100000211182 [0,2,0,0,0,0|1,0,0]=3 25578 B18R2.6544 Clc1cnc(c(c1)COCc2ccccc2)Cl 34a_100000084153_100015291786 [0,2,0,0,0,0|1,0,0]=3 25579 B18R2.6544 Clc1cnc(c(c1)COCc2ccccc2)Cl 7a_100000084153_100000211182 [0,2,0,0,0,0|1,0,0]=3 25580 B18R2.6544 Clc1cnc(c(c1)COCc2ccccn2)Br 34a_200010065233_100000721315 [0,2,0,0,0,0|2,0,0]=4 25581 B18R2.6544 Clc1cnc(c(c1)COCc2ccccn2)Br 7a_200010065233_100000721315 [0,2,0,0,0,0|2,0,0]=4 25582 B18R2.6544 Clc1cnc(c(c1)COCc2ccccn2)Cl 34a_100000084153_100000721315 [0,2,0,0,0,0|2,0,0]=4 25583 B18R2.6544 Clc1cnc(c(c1)COCc2ccccn2)Cl 7a_100000084153_100000721315 [0,2,0,0,0,0|2,0,0]=4 25584 B18R2.6544 Clc1cnc(c(c1)COCc2cccnc2)Br 34a_200010065233_100000733263 [0,2,0,0,0,0|2,0,0]=4 25585 B18R2.6544 Clc1cnc(c(c1)COCc2cccnc2)Br 7a_200010065233_100000741622 [0,2,0,0,0,0|2,0,0]=4 25586 B18R2.6544 Clc1cnc(c(c1)COCc2cccnc2)Cl 34a_100000084153_100000733263 [0,2,0,0,0,0|2,0,0]=4 25587 B18R2.6544 Clc1cnc(c(c1)COCc2cccnc2)Cl 7a_100000084153_100000741622 [0,2,0,0,0,0|2,0,0]=4 25588 B18R2.6544 Clc1cnc(c(c1)COCc2ccncc2)Br 7a_200010065233_100015193705 [0,2,0,0,0,0|2,0,0]=4 25589 B18R2.6544 Clc1cnc(c(c1)COCc2ccncc2)Cl 7a_100000084153_100015193705 [0,2,0,0,0,0|2,0,0]=4 25590 B18R2.6544 Clc1cnc(cc1CNCc2ccccc2)Br 270004a_100015324214_100010214479 [0,2,0,0,0,0|2,0,0]=4 25591 B18R2.6544 Clc1ncc(cc1CNCc2ccccc2)Br 207a_100015324214_100009816941 [0,2,0,0,0,0|2,0,0]=4 25592 B18R2.6544 Clc1ncc(cc1CNCc2ccccc2)Br 2230a_100015324214_100009816982 [0,2,0,0,0,0|2,0,0]=4 25593 B18R2.6544 Clc1ncc(cc1CNCc2ccccc2)Br 34a_100015324214_100009816982 [0,2,0,0,0,0|2,0,0]=4 25594 B18R2.6544 Clc1ncc(cc1COCc2ccccc2)Br 34a_100000210790_100009816982 [0,2,0,0,0,0|1,0,0]=3 25595 B18R2.6544 Clc1ncc(cc1COCc2ccccc2)Br 34a_100000734252_100015291786 [0,2,0,0,0,0|1,0,0]=3 25596 B18R2.6544 Clc1ncc(cc1COCc2ccccc2)Br 7a_100000210790_100009816982 [0,2,0,0,0,0|1,0,0]=3 25597 B18R2.6544 Clc1ncc(cc1COCc2ccccc2)Br 7a_100000734252_100000211182 [0,2,0,0,0,0|1,0,0]=3 25598 B18R2.6544 Clc1ncc(cc1COCc2ccccn2)Br 34a_100000734252_100000721315 [0,2,0,0,0,0|2,0,0]=4 25599 B18R2.6544 Clc1ncc(cc1COCc2ccccn2)Br 7a_100000734252_100000721315 [0,2,0,0,0,0|2,0,0]=4 25600 B18R2.6544 Clc1ncc(cc1COCc2cccnc2)Br 34a_100000734252_100000733263 [0,2,0,0,0,0|2,0,0]=4 25601 B18R2.6544 Clc1ncc(cc1COCc2cccnc2)Br 7a_100000734252_100000741622 [0,2,0,0,0,0|2,0,0]=4 25602 B18R2.6544 Clc1ncc(cc1COCc2ccncc2)Br 7a_100000734252_100015193705 [0,2,0,0,0,0|2,0,0]=4 25603 B18R2.6544 Clc1ncc(cc1CSCc2ccccc2)Br 62a_100000211182_100009816982 [0,2,0,0,0,0|1,1,0]=4 25604 B18R2.6544 Clc1ncc(cc1CSCc2ccccc2)Br 62a_100009816982_100015291786 [0,2,0,0,0,0|1,1,0]=4 25605 B18R2.6544 Fc1cc(c(cn1)F)COCc2ccccc2 34a_100000730792_100015291786 [0,2,0,0,0,0|1,0,0]=3 25606 B18R2.6544 Fc1cc(c(cn1)F)COCc2ccccc2 7a_100000730792_100000211182 [0,2,0,0,0,0|1,0,0]=3 25607 B18R2.6544 Fc1cc(c(cn1)F)COCc2ccccn2 34a_100000730792_100000721315 [0,2,0,0,0,0|2,0,0]=4 25608 B18R2.6544 Fc1cc(c(cn1)F)COCc2ccccn2 7a_100000730792_100000721315 [0,2,0,0,0,0|2,0,0]=4 25609 B18R2.6544 Fc1cc(c(cn1)F)COCc2cccnc2 34a_100000730792_100000733263 [0,2,0,0,0,0|2,0,0]=4 25610 B18R2.6544 Fc1cc(c(cn1)F)COCc2cccnc2 7a_100000730792_100000741622 [0,2,0,0,0,0|2,0,0]=4 25611 B18R2.6544 Fc1cc(c(cn1)F)COCc2ccncc2 7a_100000730792_100015193705 [0,2,0,0,0,0|2,0,0]=4 25612 B18R2.6544 Fc1ccc(c(c1)C=CCc2ccccc2)Br 271570a_200016263579_100011217576 [0,2,0,0,0,0|1,0,1]=4 25613 B18R2.6544 Fc1ccc(c(c1)C=CCc2ccccc2)Cl 271570a_200016263579_100011217299 [0,2,0,0,0,0|1,0,1]=4 25614 B18R2.6544 Fc1ccc(c(c1)C=CCc2ccccc2)F 271570a_200016263579_100000750033 [0,2,0,0,0,0|1,0,1]=4 25615 B18R2.6544 Fc1ccc(c(c1)CCNc2ccccc2)F 34a_100000106764_100011755056 [0,2,0,0,0,0|2,0,0]=4 25616 B18R2.6544 Fc1ccc(c(c1)CCOc2ccccc2)F 34a_100000210340_100011755056 [0,2,0,0,0,0|2,0,0]=4 25617 B18R2.6544 Fc1ccc(c(c1)CCOc2ccccc2)F 7a_100000210340_100011755056 [0,2,0,0,0,0|2,0,0]=4 25618 B18R2.6544 Fc1ccc(c(c1)CCSc2ccccc2)F 62a_100000719477_100011755056 [0,2,0,0,0,0|2,0,0]=4 25619 B18R2.6544 Fc1ccc(c(c1)CCSc2ccccc2)F 62a_100011755056_100000041952 [0,2,0,0,0,0|2,0,0]=4 25620 B18R2.6544 Fc1ccc(c(c1)CNCc2ccccc2)Br 207a_100000742738_100015611070 [0,2,0,0,0,0|1,0,0]=3 25621 B18R2.6544 Fc1ccc(c(c1)CNCc2ccccc2)Br 207a_100015324214_100000766564 [0,2,0,0,0,0|1,0,0]=3 25622 B18R2.6544 Fc1ccc(c(c1)CNCc2ccccc2)Br 2230a_100000742738_100015291786 [0,2,0,0,0,0|1,0,0]=3 25623 B18R2.6544 Fc1ccc(c(c1)CNCc2ccccc2)Br 2230a_100015324214_100000736370 [0,2,0,0,0,0|1,0,0]=3 25624 B18R2.6544 Fc1ccc(c(c1)CNCc2ccccc2)Br 270004a_100000742738_100015611070 [0,2,0,0,0,0|1,0,0]=3 25625 B18R2.6544 Fc1ccc(c(c1)CNCc2ccccc2)Br 270004a_100015324214_100000766564 [0,2,0,0,0,0|1,0,0]=3 25626 B18R2.6544 Fc1ccc(c(c1)CNCc2ccccc2)Br 34a_100000742738_100015291786 [0,2,0,0,0,0|1,0,0]=3 25627 B18R2.6544 Fc1ccc(c(c1)CNCc2ccccc2)Br 34a_100015324214_100000736370 [0,2,0,0,0,0|1,0,0]=3 25628 B18R2.6544 Fc1ccc(c(c1)CNCc2ccccc2)Cl 207a_100011830483_100015611070 [0,2,0,0,0,0|1,0,0]=3 25629 B18R2.6544 Fc1ccc(c(c1)CNCc2ccccc2)Cl 207a_100015324214_100011218309 [0,2,0,0,0,0|1,0,0]=3 25630 B18R2.6544 Fc1ccc(c(c1)CNCc2ccccc2)Cl 2230a_100011830483_100015291786 [0,2,0,0,0,0|1,0,0]=3 25631 B18R2.6544 Fc1ccc(c(c1)CNCc2ccccc2)Cl 2230a_100015324214_100000709952 [0,2,0,0,0,0|1,0,0]=3 25632 B18R2.6544 Fc1ccc(c(c1)CNCc2ccccc2)Cl 270004a_100011830483_100015611070 [0,2,0,0,0,0|1,0,0]=3 25633 B18R2.6544 Fc1ccc(c(c1)CNCc2ccccc2)Cl 270004a_100015324214_100011218309 [0,2,0,0,0,0|1,0,0]=3 25634 B18R2.6544 Fc1ccc(c(c1)CNCc2ccccc2)Cl 34a_100011830483_100015291786 [0,2,0,0,0,0|1,0,0]=3 25635 B18R2.6544 Fc1ccc(c(c1)CNCc2ccccc2)Cl 34a_100015324214_100000709952 [0,2,0,0,0,0|1,0,0]=3 25636 B18R2.6544 Fc1ccc(c(c1)CNCc2ccccc2)F 207a_100000752317_100015611070 [0,2,0,0,0,0|1,0,0]=3 25637 B18R2.6544 Fc1ccc(c(c1)CNCc2ccccc2)F 207a_100015324214_100000740046 [0,2,0,0,0,0|1,0,0]=3 25638 B18R2.6544 Fc1ccc(c(c1)CNCc2ccccc2)F 2230a_100015324214_100000741279 [0,2,0,0,0,0|1,0,0]=3 25639 B18R2.6544 Fc1ccc(c(c1)CNCc2ccccc2)F 270004a_100000752317_100015611070 [0,2,0,0,0,0|1,0,0]=3 25640 B18R2.6544 Fc1ccc(c(c1)CNCc2ccccc2)F 270004a_100015324214_100000740046 [0,2,0,0,0,0|1,0,0]=3 25641 B18R2.6544 Fc1ccc(c(c1)CNCc2ccccc2)F 34a_100000752317_100015291786 [0,2,0,0,0,0|1,0,0]=3 25642 B18R2.6544 Fc1ccc(c(c1)CNCc2ccccc2)F 34a_100015324214_100000741279 [0,2,0,0,0,0|1,0,0]=3 25643 B18R2.6544 Fc1ccc(c(c1)CNCc2ccccc2)I 207a_100015324214_100010186294 [0,2,0,0,0,0|1,0,0]=3 25644 B18R2.6544 Fc1ccc(c(c1)CNCc2ccccc2)I 2230a_100015324214_100010149606 [0,2,0,0,0,0|1,0,0]=3 25645 B18R2.6544 Fc1ccc(c(c1)CNCc2ccccc2)I 270004a_100015324214_100010186294 [0,2,0,0,0,0|1,0,0]=3 25646 B18R2.6544 Fc1ccc(c(c1)CNCc2ccccc2)I 34a_100015324214_100010149606 [0,2,0,0,0,0|1,0,0]=3 25647 B18R2.6544 Fc1ccc(c(c1)CNCc2ccccn2)Br 207a_100000742738_100000209966 [0,2,0,0,0,0|2,0,0]=4 25648 B18R2.6544 Fc1ccc(c(c1)CNCc2ccccn2)Br 2230a_100000742738_100000721315 [0,2,0,0,0,0|2,0,0]=4 25649 B18R2.6544 Fc1ccc(c(c1)CNCc2ccccn2)Br 270004a_100000210449_100000766564 [0,2,0,0,0,0|2,0,0]=4 25650 B18R2.6544 Fc1ccc(c(c1)CNCc2ccccn2)Br 270004a_100000742738_100000209966 [0,2,0,0,0,0|2,0,0]=4 25651 B18R2.6544 Fc1ccc(c(c1)CNCc2ccccn2)Br 34a_100000742738_100000721315 [0,2,0,0,0,0|2,0,0]=4 25652 B18R2.6544 Fc1ccc(c(c1)CNCc2ccccn2)Cl 207a_100011830483_100000209966 [0,2,0,0,0,0|2,0,0]=4 25653 B18R2.6544 Fc1ccc(c(c1)CNCc2ccccn2)Cl 2230a_100011830483_100000721315 [0,2,0,0,0,0|2,0,0]=4 25654 B18R2.6544 Fc1ccc(c(c1)CNCc2ccccn2)Cl 270004a_100000210449_100011218309 [0,2,0,0,0,0|2,0,0]=4 25655 B18R2.6544 Fc1ccc(c(c1)CNCc2ccccn2)Cl 270004a_100011830483_100000209966 [0,2,0,0,0,0|2,0,0]=4 25656 B18R2.6544 Fc1ccc(c(c1)CNCc2ccccn2)Cl 34a_100011830483_100000721315 [0,2,0,0,0,0|2,0,0]=4 25657 B18R2.6544 Fc1ccc(c(c1)CNCc2ccccn2)F 207a_100000752317_100000209966 [0,2,0,0,0,0|2,0,0]=4 25658 B18R2.6544 Fc1ccc(c(c1)CNCc2ccccn2)F 270004a_100000210449_100000740046 [0,2,0,0,0,0|2,0,0]=4 25659 B18R2.6544 Fc1ccc(c(c1)CNCc2ccccn2)F 270004a_100000752317_100000209966 [0,2,0,0,0,0|2,0,0]=4 25660 B18R2.6544 Fc1ccc(c(c1)CNCc2ccccn2)F 34a_100000752317_100000721315 [0,2,0,0,0,0|2,0,0]=4 25661 B18R2.6544 Fc1ccc(c(c1)CNCc2ccccn2)I 270004a_100000210449_100010186294 [0,2,0,0,0,0|2,0,0]=4 25662 B18R2.6544 Fc1ccc(c(c1)CNCc2cccnc2)Br 207a_100000210453_100000766564 [0,2,0,0,0,0|2,0,0]=4 25663 B18R2.6544 Fc1ccc(c(c1)CNCc2cccnc2)Br 207a_100000742738_100000209961 [0,2,0,0,0,0|2,0,0]=4 25664 B18R2.6544 Fc1ccc(c(c1)CNCc2cccnc2)Br 2230a_100000742738_100000741622 [0,2,0,0,0,0|2,0,0]=4 25665 B18R2.6544 Fc1ccc(c(c1)CNCc2cccnc2)Br 270004a_100000210453_100000766564 [0,2,0,0,0,0|2,0,0]=4 25666 B18R2.6544 Fc1ccc(c(c1)CNCc2cccnc2)Br 270004a_100000742738_100000209961 [0,2,0,0,0,0|2,0,0]=4 25667 B18R2.6544 Fc1ccc(c(c1)CNCc2cccnc2)Br 34a_100000742738_100000733263 [0,2,0,0,0,0|2,0,0]=4 25668 B18R2.6544 Fc1ccc(c(c1)CNCc2cccnc2)Cl 207a_100000210453_100011218309 [0,2,0,0,0,0|2,0,0]=4 25669 B18R2.6544 Fc1ccc(c(c1)CNCc2cccnc2)Cl 207a_100011830483_100000209961 [0,2,0,0,0,0|2,0,0]=4 25670 B18R2.6544 Fc1ccc(c(c1)CNCc2cccnc2)Cl 2230a_100011830483_100000741622 [0,2,0,0,0,0|2,0,0]=4 25671 B18R2.6544 Fc1ccc(c(c1)CNCc2cccnc2)Cl 270004a_100000210453_100011218309 [0,2,0,0,0,0|2,0,0]=4 25672 B18R2.6544 Fc1ccc(c(c1)CNCc2cccnc2)Cl 270004a_100011830483_100000209961 [0,2,0,0,0,0|2,0,0]=4 25673 B18R2.6544 Fc1ccc(c(c1)CNCc2cccnc2)Cl 34a_100011830483_100000733263 [0,2,0,0,0,0|2,0,0]=4 25674 B18R2.6544 Fc1ccc(c(c1)CNCc2cccnc2)F 207a_100000210453_100000740046 [0,2,0,0,0,0|2,0,0]=4 25675 B18R2.6544 Fc1ccc(c(c1)CNCc2cccnc2)F 207a_100000752317_100000209961 [0,2,0,0,0,0|2,0,0]=4 25676 B18R2.6544 Fc1ccc(c(c1)CNCc2cccnc2)F 270004a_100000210453_100000740046 [0,2,0,0,0,0|2,0,0]=4 25677 B18R2.6544 Fc1ccc(c(c1)CNCc2cccnc2)F 270004a_100000752317_100000209961 [0,2,0,0,0,0|2,0,0]=4 25678 B18R2.6544 Fc1ccc(c(c1)CNCc2cccnc2)F 34a_100000752317_100000733263 [0,2,0,0,0,0|2,0,0]=4 25679 B18R2.6544 Fc1ccc(c(c1)CNCc2cccnc2)I 207a_100000210453_100010186294 [0,2,0,0,0,0|2,0,0]=4 25680 B18R2.6544 Fc1ccc(c(c1)CNCc2cccnc2)I 270004a_100000210453_100010186294 [0,2,0,0,0,0|2,0,0]=4 25681 B18R2.6544 Fc1ccc(c(c1)CNCc2ccncc2)Br 207a_100000742738_100000186114 [0,2,0,0,0,0|2,0,0]=4 25682 B18R2.6544 Fc1ccc(c(c1)CNCc2ccncc2)Br 2230a_100000742738_100015193705 [0,2,0,0,0,0|2,0,0]=4 25683 B18R2.6544 Fc1ccc(c(c1)CNCc2ccncc2)Cl 207a_100011830483_100000186114 [0,2,0,0,0,0|2,0,0]=4 25684 B18R2.6544 Fc1ccc(c(c1)CNCc2ccncc2)Cl 2230a_100011830483_100015193705 [0,2,0,0,0,0|2,0,0]=4 25685 B18R2.6544 Fc1ccc(c(c1)CNCc2ccncc2)F 207a_100000752317_100000186114 [0,2,0,0,0,0|2,0,0]=4 25686 B18R2.6544 Fc1ccc(c(c1)COCc2ccccc2)Br 34a_100000210790_100000736370 [0,2,0,0,0,0|0,0,0]=2 25687 B18R2.6544 Fc1ccc(c(c1)COCc2ccccc2)Br 34a_100011217561_100015291786 [0,2,0,0,0,0|0,0,0]=2 25688 B18R2.6544 Fc1ccc(c(c1)COCc2ccccc2)Br 7a_100000210790_100000736370 [0,2,0,0,0,0|0,0,0]=2 25689 B18R2.6544 Fc1ccc(c(c1)COCc2ccccc2)Br 7a_100011217561_100000211182 [0,2,0,0,0,0|0,0,0]=2 25690 B18R2.6544 Fc1ccc(c(c1)COCc2ccccc2)Cl 34a_100000210790_100000709952 [0,2,0,0,0,0|0,0,0]=2 25691 B18R2.6544 Fc1ccc(c(c1)COCc2ccccc2)Cl 34a_100011218361_100015291786 [0,2,0,0,0,0|0,0,0]=2 25692 B18R2.6544 Fc1ccc(c(c1)COCc2ccccc2)Cl 7a_100000210790_100000709952 [0,2,0,0,0,0|0,0,0]=2 25693 B18R2.6544 Fc1ccc(c(c1)COCc2ccccc2)Cl 7a_100011218361_100000211182 [0,2,0,0,0,0|0,0,0]=2 25694 B18R2.6544 Fc1ccc(c(c1)COCc2ccccc2)F 34a_100000210790_100000741279 [0,2,0,0,0,0|0,0,0]=2 25695 B18R2.6544 Fc1ccc(c(c1)COCc2ccccc2)F 34a_100011217725_100015291786 [0,2,0,0,0,0|0,0,0]=2 25696 B18R2.6544 Fc1ccc(c(c1)COCc2ccccc2)F 7a_100000210790_100000741279 [0,2,0,0,0,0|0,0,0]=2 25697 B18R2.6544 Fc1ccc(c(c1)COCc2ccccc2)F 7a_100011217725_100000211182 [0,2,0,0,0,0|0,0,0]=2 25698 B18R2.6544 Fc1ccc(c(c1)COCc2ccccc2)I 34a_100000210790_100010149606 [0,2,0,0,0,0|0,0,0]=2 25699 B18R2.6544 Fc1ccc(c(c1)COCc2ccccc2)I 34a_100010255287_100015291786 [0,2,0,0,0,0|0,0,0]=2 25700 B18R2.6544 Fc1ccc(c(c1)COCc2ccccc2)I 7a_100000210790_100010149606 [0,2,0,0,0,0|0,0,0]=2 25701 B18R2.6544 Fc1ccc(c(c1)COCc2ccccc2)I 7a_100010255287_100000211182 [0,2,0,0,0,0|0,0,0]=2 25702 B18R2.6544 Fc1ccc(c(c1)COCc2ccccn2)Br 34a_100011217561_100000721315 [0,2,0,0,0,0|1,0,0]=3 25703 B18R2.6544 Fc1ccc(c(c1)COCc2ccccn2)Br 7a_100011217561_100000721315 [0,2,0,0,0,0|1,0,0]=3 25704 B18R2.6544 Fc1ccc(c(c1)COCc2ccccn2)Cl 34a_100011218361_100000721315 [0,2,0,0,0,0|1,0,0]=3 25705 B18R2.6544 Fc1ccc(c(c1)COCc2ccccn2)Cl 7a_100011218361_100000721315 [0,2,0,0,0,0|1,0,0]=3 25706 B18R2.6544 Fc1ccc(c(c1)COCc2ccccn2)F 34a_100011217725_100000721315 [0,2,0,0,0,0|1,0,0]=3 25707 B18R2.6544 Fc1ccc(c(c1)COCc2ccccn2)F 7a_100011217725_100000721315 [0,2,0,0,0,0|1,0,0]=3 25708 B18R2.6544 Fc1ccc(c(c1)COCc2ccccn2)I 34a_100010255287_100000721315 [0,2,0,0,0,0|1,0,0]=3 25709 B18R2.6544 Fc1ccc(c(c1)COCc2ccccn2)I 7a_100010255287_100000721315 [0,2,0,0,0,0|1,0,0]=3 25710 B18R2.6544 Fc1ccc(c(c1)COCc2cccnc2)Br 34a_100011217561_100000733263 [0,2,0,0,0,0|1,0,0]=3 25711 B18R2.6544 Fc1ccc(c(c1)COCc2cccnc2)Br 7a_100011217561_100000741622 [0,2,0,0,0,0|1,0,0]=3 25712 B18R2.6544 Fc1ccc(c(c1)COCc2cccnc2)Cl 34a_100011218361_100000733263 [0,2,0,0,0,0|1,0,0]=3 25713 B18R2.6544 Fc1ccc(c(c1)COCc2cccnc2)Cl 7a_100011218361_100000741622 [0,2,0,0,0,0|1,0,0]=3 25714 B18R2.6544 Fc1ccc(c(c1)COCc2cccnc2)F 34a_100011217725_100000733263 [0,2,0,0,0,0|1,0,0]=3 25715 B18R2.6544 Fc1ccc(c(c1)COCc2cccnc2)F 7a_100011217725_100000741622 [0,2,0,0,0,0|1,0,0]=3 25716 B18R2.6544 Fc1ccc(c(c1)COCc2cccnc2)I 34a_100010255287_100000733263 [0,2,0,0,0,0|1,0,0]=3 25717 B18R2.6544 Fc1ccc(c(c1)COCc2cccnc2)I 7a_100010255287_100000741622 [0,2,0,0,0,0|1,0,0]=3 25718 B18R2.6544 Fc1ccc(c(c1)COCc2cccnn2)Br 34a_100011217561_100016990269 [0,2,0,0,0,0|2,0,0]=4 25719 B18R2.6544 Fc1ccc(c(c1)COCc2cccnn2)Br 7a_100011217561_100016990269 [0,2,0,0,0,0|2,0,0]=4 25720 B18R2.6544 Fc1ccc(c(c1)COCc2cccnn2)Cl 34a_100011218361_100016990269 [0,2,0,0,0,0|2,0,0]=4 25721 B18R2.6544 Fc1ccc(c(c1)COCc2cccnn2)Cl 7a_100011218361_100016990269 [0,2,0,0,0,0|2,0,0]=4 25722 B18R2.6544 Fc1ccc(c(c1)COCc2cccnn2)F 34a_100011217725_100016990269 [0,2,0,0,0,0|2,0,0]=4 25723 B18R2.6544 Fc1ccc(c(c1)COCc2cccnn2)F 7a_100011217725_100016990269 [0,2,0,0,0,0|2,0,0]=4 25724 B18R2.6544 Fc1ccc(c(c1)COCc2cccnn2)I 34a_100010255287_100016990269 [0,2,0,0,0,0|2,0,0]=4 25725 B18R2.6544 Fc1ccc(c(c1)COCc2cccnn2)I 7a_100010255287_100016990269 [0,2,0,0,0,0|2,0,0]=4 25726 B18R2.6544 Fc1ccc(c(c1)COCc2ccncc2)Br 7a_100011217561_100015193705 [0,2,0,0,0,0|1,0,0]=3 25727 B18R2.6544 Fc1ccc(c(c1)COCc2ccncc2)Cl 7a_100011218361_100015193705 [0,2,0,0,0,0|1,0,0]=3 25728 B18R2.6544 Fc1ccc(c(c1)COCc2ccncc2)F 7a_100011217725_100015193705 [0,2,0,0,0,0|1,0,0]=3 25729 B18R2.6544 Fc1ccc(c(c1)COCc2ccncc2)I 7a_100010255287_100015193705 [0,2,0,0,0,0|1,0,0]=3 25730 B18R2.6544 Fc1ccc(c(c1)COCc2cnccn2)Br 34a_100011217561_100016995436 [0,2,0,0,0,0|2,0,0]=4 25731 B18R2.6544 Fc1ccc(c(c1)COCc2cnccn2)Br 7a_100011217561_100016995436 [0,2,0,0,0,0|2,0,0]=4 25732 B18R2.6544 Fc1ccc(c(c1)COCc2cnccn2)Cl 34a_100011218361_100016995436 [0,2,0,0,0,0|2,0,0]=4 25733 B18R2.6544 Fc1ccc(c(c1)COCc2cnccn2)Cl 7a_100011218361_100016995436 [0,2,0,0,0,0|2,0,0]=4 25734 B18R2.6544 Fc1ccc(c(c1)COCc2cnccn2)F 34a_100011217725_100016995436 [0,2,0,0,0,0|2,0,0]=4 25735 B18R2.6544 Fc1ccc(c(c1)COCc2cnccn2)F 7a_100011217725_100016995436 [0,2,0,0,0,0|2,0,0]=4 25736 B18R2.6544 Fc1ccc(c(c1)COCc2cnccn2)I 34a_100010255287_100016995436 [0,2,0,0,0,0|2,0,0]=4 25737 B18R2.6544 Fc1ccc(c(c1)COCc2cnccn2)I 7a_100010255287_100016995436 [0,2,0,0,0,0|2,0,0]=4 25738 B18R2.6544 Fc1ccc(c(c1)COCc2cncnc2)Br 34a_100011217561_100015196519 [0,2,0,0,0,0|2,0,0]=4 25739 B18R2.6544 Fc1ccc(c(c1)COCc2cncnc2)Br 7a_100011217561_100015196519 [0,2,0,0,0,0|2,0,0]=4 25740 B18R2.6544 Fc1ccc(c(c1)COCc2cncnc2)Cl 34a_100011218361_100015196519 [0,2,0,0,0,0|2,0,0]=4 25741 B18R2.6544 Fc1ccc(c(c1)COCc2cncnc2)Cl 7a_100011218361_100015196519 [0,2,0,0,0,0|2,0,0]=4 25742 B18R2.6544 Fc1ccc(c(c1)COCc2cncnc2)F 34a_100011217725_100015196519 [0,2,0,0,0,0|2,0,0]=4 25743 B18R2.6544 Fc1ccc(c(c1)COCc2cncnc2)F 7a_100011217725_100015196519 [0,2,0,0,0,0|2,0,0]=4 25744 B18R2.6544 Fc1ccc(c(c1)COCc2cncnc2)I 34a_100010255287_100015196519 [0,2,0,0,0,0|2,0,0]=4 25745 B18R2.6544 Fc1ccc(c(c1)COCc2cncnc2)I 7a_100010255287_100015196519 [0,2,0,0,0,0|2,0,0]=4 25746 B18R2.6544 Fc1ccc(c(c1)COCc2ncccn2)Br 34a_100011217561_100000703007 [0,2,0,0,0,0|2,0,0]=4 25747 B18R2.6544 Fc1ccc(c(c1)COCc2ncccn2)Br 7a_100011217561_100000703007 [0,2,0,0,0,0|2,0,0]=4 25748 B18R2.6544 Fc1ccc(c(c1)COCc2ncccn2)Cl 34a_100011218361_100000703007 [0,2,0,0,0,0|2,0,0]=4 25749 B18R2.6544 Fc1ccc(c(c1)COCc2ncccn2)Cl 7a_100011218361_100000703007 [0,2,0,0,0,0|2,0,0]=4 25750 B18R2.6544 Fc1ccc(c(c1)COCc2ncccn2)F 34a_100011217725_100000703007 [0,2,0,0,0,0|2,0,0]=4 25751 B18R2.6544 Fc1ccc(c(c1)COCc2ncccn2)F 7a_100011217725_100000703007 [0,2,0,0,0,0|2,0,0]=4 25752 B18R2.6544 Fc1ccc(c(c1)COCc2ncccn2)I 34a_100010255287_100000703007 [0,2,0,0,0,0|2,0,0]=4 25753 B18R2.6544 Fc1ccc(c(c1)COCc2ncccn2)I 7a_100010255287_100000703007 [0,2,0,0,0,0|2,0,0]=4 25754 B18R2.6544 Fc1ccc(c(c1)CSCc2ccccc2)Br 62a_100000211182_100000736370 [0,2,0,0,0,0|0,1,0]=3 25755 B18R2.6544 Fc1ccc(c(c1)CSCc2ccccc2)Br 62a_100000736370_100015291786 [0,2,0,0,0,0|0,1,0]=3 25756 B18R2.6544 Fc1ccc(c(c1)CSCc2ccccc2)Cl 62a_100000211182_100000709952 [0,2,0,0,0,0|0,1,0]=3 25757 B18R2.6544 Fc1ccc(c(c1)CSCc2ccccc2)Cl 62a_100000709952_100015291786 [0,2,0,0,0,0|0,1,0]=3 25758 B18R2.6544 Fc1ccc(c(c1)CSCc2ccccc2)F 62a_100000211182_100000685659 [0,2,0,0,0,0|0,1,0]=3 25759 B18R2.6544 Fc1ccc(c(c1)CSCc2ccccc2)F 62a_100000685659_100015291786 [0,2,0,0,0,0|0,1,0]=3 25760 B18R2.6544 Fc1ccc(c(c1)CSCc2ccccc2)I 62a_100000211182_100010149606 [0,2,0,0,0,0|0,1,0]=3 25761 B18R2.6544 Fc1ccc(c(c1)CSCc2ccccc2)I 62a_100010149606_100015291786 [0,2,0,0,0,0|0,1,0]=3 25762 B18R2.6544 Fc1ccc(c(c1)CSCc2ccccn2)Br 62a_100000721315_100000736370 [0,2,0,0,0,0|1,1,0]=4 25763 B18R2.6544 Fc1ccc(c(c1)CSCc2ccccn2)Br 62a_100000736370_100000721315 [0,2,0,0,0,0|1,1,0]=4 25764 B18R2.6544 Fc1ccc(c(c1)CSCc2ccccn2)Cl 62a_100000709952_100000721315 [0,2,0,0,0,0|1,1,0]=4 25765 B18R2.6544 Fc1ccc(c(c1)CSCc2ccccn2)Cl 62a_100000721315_100000709952 [0,2,0,0,0,0|1,1,0]=4 25766 B18R2.6544 Fc1ccc(c(c1)CSCc2ccccn2)F 62a_100000685659_100000721315 [0,2,0,0,0,0|1,1,0]=4 25767 B18R2.6544 Fc1ccc(c(c1)CSCc2ccccn2)F 62a_100000721315_100000685659 [0,2,0,0,0,0|1,1,0]=4 25768 B18R2.6544 Fc1ccc(c(c1)CSCc2ccccn2)I 62a_100000721315_100010149606 [0,2,0,0,0,0|1,1,0]=4 25769 B18R2.6544 Fc1ccc(c(c1)CSCc2ccccn2)I 62a_100010149606_100000721315 [0,2,0,0,0,0|1,1,0]=4 25770 B18R2.6544 Fc1ccc(c(c1)CSCc2cccnc2)Br 62a_100000736370_100000741622 [0,2,0,0,0,0|1,1,0]=4 25771 B18R2.6544 Fc1ccc(c(c1)CSCc2cccnc2)Br 62a_100000741622_100000736370 [0,2,0,0,0,0|1,1,0]=4 25772 B18R2.6544 Fc1ccc(c(c1)CSCc2cccnc2)Cl 62a_100000709952_100000741622 [0,2,0,0,0,0|1,1,0]=4 25773 B18R2.6544 Fc1ccc(c(c1)CSCc2cccnc2)Cl 62a_100000741622_100000709952 [0,2,0,0,0,0|1,1,0]=4 25774 B18R2.6544 Fc1ccc(c(c1)CSCc2cccnc2)F 62a_100000685659_100000741622 [0,2,0,0,0,0|1,1,0]=4 25775 B18R2.6544 Fc1ccc(c(c1)CSCc2cccnc2)F 62a_100000741622_100000685659 [0,2,0,0,0,0|1,1,0]=4 25776 B18R2.6544 Fc1ccc(c(c1)CSCc2cccnc2)I 62a_100000741622_100010149606 [0,2,0,0,0,0|1,1,0]=4 25777 B18R2.6544 Fc1ccc(c(c1)CSCc2cccnc2)I 62a_100010149606_100000741622 [0,2,0,0,0,0|1,1,0]=4 25778 B18R2.6544 Fc1ccc(c(c1)CSCc2ccncc2)Br 62a_100000736370_100015193705 [0,2,0,0,0,0|1,1,0]=4 25779 B18R2.6544 Fc1ccc(c(c1)CSCc2ccncc2)Br 62a_100015193705_100000736370 [0,2,0,0,0,0|1,1,0]=4 25780 B18R2.6544 Fc1ccc(c(c1)CSCc2ccncc2)Cl 62a_100000709952_100015193705 [0,2,0,0,0,0|1,1,0]=4 25781 B18R2.6544 Fc1ccc(c(c1)CSCc2ccncc2)Cl 62a_100015193705_100000709952 [0,2,0,0,0,0|1,1,0]=4 25782 B18R2.6544 Fc1ccc(c(c1)CSCc2ccncc2)F 62a_100000685659_100015193705 [0,2,0,0,0,0|1,1,0]=4 25783 B18R2.6544 Fc1ccc(c(c1)CSCc2ccncc2)F 62a_100015193705_100000685659 [0,2,0,0,0,0|1,1,0]=4 25784 B18R2.6544 Fc1ccc(c(c1)CSCc2ccncc2)I 62a_100010149606_100015193705 [0,2,0,0,0,0|1,1,0]=4 25785 B18R2.6544 Fc1ccc(c(c1)CSCc2ccncc2)I 62a_100015193705_100010149606 [0,2,0,0,0,0|1,1,0]=4 25786 B18R2.6544 Fc1ccc(c(c1)NCCc2ccccc2)Br 34a_100000687223_100000765856 [0,2,0,0,0,0|2,0,0]=4 25787 B18R2.6544 Fc1ccc(c(c1)NCCc2ccccc2)Cl 34a_100000751338_100000765856 [0,2,0,0,0,0|2,0,0]=4 25788 B18R2.6544 Fc1ccc(c(c1)NCCc2ccccc2)F 34a_100000210742_100000765856 [0,2,0,0,0,0|2,0,0]=4 25789 B18R2.6544 Fc1ccc(c(c1)NCCc2ccccc2)I 34a_100011218093_100000765856 [0,2,0,0,0,0|2,0,0]=4 25790 B18R2.6544 Fc1ccc(c(c1)OCCc2ccccc2)Br 34a_100000690578_100000765856 [0,2,0,0,0,0|2,0,0]=4 25791 B18R2.6544 Fc1ccc(c(c1)OCCc2ccccc2)Br 7a_100000690578_100000765856 [0,2,0,0,0,0|2,0,0]=4 25792 B18R2.6544 Fc1ccc(c(c1)OCCc2ccccc2)Cl 34a_100000692107_100000765856 [0,2,0,0,0,0|2,0,0]=4 25793 B18R2.6544 Fc1ccc(c(c1)OCCc2ccccc2)Cl 7a_100000692107_100000765856 [0,2,0,0,0,0|2,0,0]=4 25794 B18R2.6544 Fc1ccc(c(c1)OCCc2ccccc2)F 34a_100000752141_100000765856 [0,2,0,0,0,0|2,0,0]=4 25795 B18R2.6544 Fc1ccc(c(c1)OCCc2ccccc2)F 7a_100000752141_100000765856 [0,2,0,0,0,0|2,0,0]=4 25796 B18R2.6544 Fc1ccc(c(c1)OCCc2ccccc2)I 34a_100010084537_100000765856 [0,2,0,0,0,0|2,0,0]=4 25797 B18R2.6544 Fc1ccc(c(c1)OCCc2ccccc2)I 7a_100010084537_100000765856 [0,2,0,0,0,0|2,0,0]=4 25798 B18R2.6544 Fc1ccc(c(c1)SCCc2ccccc2)Br 62a_100000765856_100011217576 [0,2,0,0,0,0|2,0,0]=4 25799 B18R2.6544 Fc1ccc(c(c1)SCCc2ccccc2)Br 62a_100011217576_100011218657 [0,2,0,0,0,0|2,0,0]=4 25800 B18R2.6544 Fc1ccc(c(c1)SCCc2ccccc2)Cl 62a_100000765856_100011217299 [0,2,0,0,0,0|2,0,0]=4 25801 B18R2.6544 Fc1ccc(c(c1)SCCc2ccccc2)Cl 62a_100011217299_100011218657 [0,2,0,0,0,0|2,0,0]=4 25802 B18R2.6544 Fc1ccc(c(c1)SCCc2ccccc2)F 62a_100000765856_100011219198 [0,2,0,0,0,0|2,0,0]=4 25803 B18R2.6544 Fc1ccc(c(c1)SCCc2ccccc2)F 62a_100011219198_100011218657 [0,2,0,0,0,0|2,0,0]=4 25804 B18R2.6544 Fc1ccc(c(n1)COCc2ccccc2)Br 34a_100000701195_100015291786 [0,2,0,0,0,0|1,0,0]=3 25805 B18R2.6544 Fc1ccc(c(n1)COCc2ccccn2)Br 34a_100000701195_100000721315 [0,2,0,0,0,0|2,0,0]=4 25806 B18R2.6544 Fc1ccc(c(n1)COCc2cccnc2)Br 34a_100000701195_100000733263 [0,2,0,0,0,0|2,0,0]=4 25807 B18R2.6544 Fc1ccc(cc1C=CCc2ccccc2)Br 271570a_200016263579_100011217312 [0,2,0,0,0,0|1,0,1]=4 25808 B18R2.6544 Fc1ccc(cc1C=CCc2ccccc2)Cl 271570a_200016263579_100011218116 [0,2,0,0,0,0|1,0,1]=4 25809 B18R2.6544 Fc1ccc(cc1CNCc2ccccc2)Br 207a_100009815772_100015611070 [0,2,0,0,0,0|1,0,0]=3 25810 B18R2.6544 Fc1ccc(cc1CNCc2ccccc2)Br 207a_100015324214_100000211465 [0,2,0,0,0,0|1,0,0]=3 25811 B18R2.6544 Fc1ccc(cc1CNCc2ccccc2)Br 2230a_100015324214_100000736399 [0,2,0,0,0,0|1,0,0]=3 25812 B18R2.6544 Fc1ccc(cc1CNCc2ccccc2)Br 270004a_100009815772_100015611070 [0,2,0,0,0,0|1,0,0]=3 25813 B18R2.6544 Fc1ccc(cc1CNCc2ccccc2)Br 270004a_100015324214_100000211465 [0,2,0,0,0,0|1,0,0]=3 25814 B18R2.6544 Fc1ccc(cc1CNCc2ccccc2)Br 34a_100009815772_100015291786 [0,2,0,0,0,0|1,0,0]=3 25815 B18R2.6544 Fc1ccc(cc1CNCc2ccccc2)Br 34a_100015324214_100000736399 [0,2,0,0,0,0|1,0,0]=3 25816 B18R2.6544 Fc1ccc(cc1CNCc2ccccc2)Cl 207a_100011211646_100015611070 [0,2,0,0,0,0|1,0,0]=3 25817 B18R2.6544 Fc1ccc(cc1CNCc2ccccc2)Cl 207a_100015324214_100000745245 [0,2,0,0,0,0|1,0,0]=3 25818 B18R2.6544 Fc1ccc(cc1CNCc2ccccc2)Cl 2230a_100015324214_100000716957 [0,2,0,0,0,0|1,0,0]=3 25819 B18R2.6544 Fc1ccc(cc1CNCc2ccccc2)Cl 270004a_100011211646_100015611070 [0,2,0,0,0,0|1,0,0]=3 25820 B18R2.6544 Fc1ccc(cc1CNCc2ccccc2)Cl 270004a_100015324214_100000745245 [0,2,0,0,0,0|1,0,0]=3 25821 B18R2.6544 Fc1ccc(cc1CNCc2ccccc2)Cl 34a_100011211646_100015291786 [0,2,0,0,0,0|1,0,0]=3 25822 B18R2.6544 Fc1ccc(cc1CNCc2ccccc2)Cl 34a_100015324214_100000716957 [0,2,0,0,0,0|1,0,0]=3 25823 B18R2.6544 Fc1ccc(cc1CNCc2ccccc2)I 207a_100015324214_100000050626 [0,2,0,0,0,0|1,0,0]=3 25824 B18R2.6544 Fc1ccc(cc1CNCc2ccccc2)I 2230a_100015324214_200010149601 [0,2,0,0,0,0|1,0,0]=3 25825 B18R2.6544 Fc1ccc(cc1CNCc2ccccc2)I 34a_100015324214_200010149601 [0,2,0,0,0,0|1,0,0]=3 25826 B18R2.6544 Fc1ccc(cc1CNCc2ccccn2)Br 207a_100009815772_100000209966 [0,2,0,0,0,0|2,0,0]=4 25827 B18R2.6544 Fc1ccc(cc1CNCc2ccccn2)Br 270004a_100000210449_100000211465 [0,2,0,0,0,0|2,0,0]=4 25828 B18R2.6544 Fc1ccc(cc1CNCc2ccccn2)Br 270004a_100009815772_100000209966 [0,2,0,0,0,0|2,0,0]=4 25829 B18R2.6544 Fc1ccc(cc1CNCc2ccccn2)Br 34a_100009815772_100000721315 [0,2,0,0,0,0|2,0,0]=4 25830 B18R2.6544 Fc1ccc(cc1CNCc2ccccn2)Cl 207a_100011211646_100000209966 [0,2,0,0,0,0|2,0,0]=4 25831 B18R2.6544 Fc1ccc(cc1CNCc2ccccn2)Cl 270004a_100000210449_100000745245 [0,2,0,0,0,0|2,0,0]=4 25832 B18R2.6544 Fc1ccc(cc1CNCc2ccccn2)Cl 270004a_100011211646_100000209966 [0,2,0,0,0,0|2,0,0]=4 25833 B18R2.6544 Fc1ccc(cc1CNCc2ccccn2)Cl 34a_100011211646_100000721315 [0,2,0,0,0,0|2,0,0]=4 25834 B18R2.6544 Fc1ccc(cc1CNCc2cccnc2)Br 207a_100000210453_100000211465 [0,2,0,0,0,0|2,0,0]=4 25835 B18R2.6544 Fc1ccc(cc1CNCc2cccnc2)Br 207a_100009815772_100000209961 [0,2,0,0,0,0|2,0,0]=4 25836 B18R2.6544 Fc1ccc(cc1CNCc2cccnc2)Br 270004a_100000210453_100000211465 [0,2,0,0,0,0|2,0,0]=4 25837 B18R2.6544 Fc1ccc(cc1CNCc2cccnc2)Br 270004a_100009815772_100000209961 [0,2,0,0,0,0|2,0,0]=4 25838 B18R2.6544 Fc1ccc(cc1CNCc2cccnc2)Br 34a_100009815772_100000733263 [0,2,0,0,0,0|2,0,0]=4 25839 B18R2.6544 Fc1ccc(cc1CNCc2cccnc2)Cl 207a_100000210453_100000745245 [0,2,0,0,0,0|2,0,0]=4 25840 B18R2.6544 Fc1ccc(cc1CNCc2cccnc2)Cl 207a_100011211646_100000209961 [0,2,0,0,0,0|2,0,0]=4 25841 B18R2.6544 Fc1ccc(cc1CNCc2cccnc2)Cl 270004a_100000210453_100000745245 [0,2,0,0,0,0|2,0,0]=4 25842 B18R2.6544 Fc1ccc(cc1CNCc2cccnc2)Cl 270004a_100011211646_100000209961 [0,2,0,0,0,0|2,0,0]=4 25843 B18R2.6544 Fc1ccc(cc1CNCc2cccnc2)Cl 34a_100011211646_100000733263 [0,2,0,0,0,0|2,0,0]=4 25844 B18R2.6544 Fc1ccc(cc1CNCc2cccnc2)I 207a_100000210453_100000050626 [0,2,0,0,0,0|2,0,0]=4 25845 B18R2.6544 Fc1ccc(cc1CNCc2ccncc2)Br 207a_100009815772_100000186114 [0,2,0,0,0,0|2,0,0]=4 25846 B18R2.6544 Fc1ccc(cc1CNCc2ccncc2)Cl 207a_100011211646_100000186114 [0,2,0,0,0,0|2,0,0]=4 25847 B18R2.6544 Fc1ccc(cc1COCc2ccccc2)Br 34a_100000210790_100000736399 [0,2,0,0,0,0|0,0,0]=2 25848 B18R2.6544 Fc1ccc(cc1COCc2ccccc2)Br 34a_100000246282_100015291786 [0,2,0,0,0,0|0,0,0]=2 25849 B18R2.6544 Fc1ccc(cc1COCc2ccccc2)Br 7a_100000210790_100000736399 [0,2,0,0,0,0|0,0,0]=2 25850 B18R2.6544 Fc1ccc(cc1COCc2ccccc2)Br 7a_100000246282_100000211182 [0,2,0,0,0,0|0,0,0]=2 25851 B18R2.6544 Fc1ccc(cc1COCc2ccccc2)Cl 34a_100000210790_100000716957 [0,2,0,0,0,0|0,0,0]=2 25852 B18R2.6544 Fc1ccc(cc1COCc2ccccc2)Cl 34a_100011217248_100015291786 [0,2,0,0,0,0|0,0,0]=2 25853 B18R2.6544 Fc1ccc(cc1COCc2ccccc2)Cl 7a_100000210790_100000716957 [0,2,0,0,0,0|0,0,0]=2 25854 B18R2.6544 Fc1ccc(cc1COCc2ccccc2)Cl 7a_100011217248_100000211182 [0,2,0,0,0,0|0,0,0]=2 25855 B18R2.6544 Fc1ccc(cc1COCc2ccccc2)I 34a_100000049604_100015291786 [0,2,0,0,0,0|0,0,0]=2 25856 B18R2.6544 Fc1ccc(cc1COCc2ccccc2)I 34a_100000210790_200010149601 [0,2,0,0,0,0|0,0,0]=2 25857 B18R2.6544 Fc1ccc(cc1COCc2ccccc2)I 7a_100000049604_100000211182 [0,2,0,0,0,0|0,0,0]=2 25858 B18R2.6544 Fc1ccc(cc1COCc2ccccc2)I 7a_100000210790_200010149601 [0,2,0,0,0,0|0,0,0]=2 25859 B18R2.6544 Fc1ccc(cc1COCc2ccccn2)Br 34a_100000246282_100000721315 [0,2,0,0,0,0|1,0,0]=3 25860 B18R2.6544 Fc1ccc(cc1COCc2ccccn2)Br 7a_100000246282_100000721315 [0,2,0,0,0,0|1,0,0]=3 25861 B18R2.6544 Fc1ccc(cc1COCc2ccccn2)Cl 34a_100011217248_100000721315 [0,2,0,0,0,0|1,0,0]=3 25862 B18R2.6544 Fc1ccc(cc1COCc2ccccn2)Cl 7a_100011217248_100000721315 [0,2,0,0,0,0|1,0,0]=3 25863 B18R2.6544 Fc1ccc(cc1COCc2ccccn2)I 34a_100000049604_100000721315 [0,2,0,0,0,0|1,0,0]=3 25864 B18R2.6544 Fc1ccc(cc1COCc2ccccn2)I 7a_100000049604_100000721315 [0,2,0,0,0,0|1,0,0]=3 25865 B18R2.6544 Fc1ccc(cc1COCc2cccnc2)Br 34a_100000246282_100000733263 [0,2,0,0,0,0|1,0,0]=3 25866 B18R2.6544 Fc1ccc(cc1COCc2cccnc2)Br 7a_100000246282_100000741622 [0,2,0,0,0,0|1,0,0]=3 25867 B18R2.6544 Fc1ccc(cc1COCc2cccnc2)Cl 34a_100011217248_100000733263 [0,2,0,0,0,0|1,0,0]=3 25868 B18R2.6544 Fc1ccc(cc1COCc2cccnc2)Cl 7a_100011217248_100000741622 [0,2,0,0,0,0|1,0,0]=3 25869 B18R2.6544 Fc1ccc(cc1COCc2cccnc2)I 34a_100000049604_100000733263 [0,2,0,0,0,0|1,0,0]=3 25870 B18R2.6544 Fc1ccc(cc1COCc2cccnc2)I 7a_100000049604_100000741622 [0,2,0,0,0,0|1,0,0]=3 25871 B18R2.6544 Fc1ccc(cc1COCc2cccnn2)Br 34a_100000246282_100016990269 [0,2,0,0,0,0|2,0,0]=4 25872 B18R2.6544 Fc1ccc(cc1COCc2cccnn2)Br 7a_100000246282_100016990269 [0,2,0,0,0,0|2,0,0]=4 25873 B18R2.6544 Fc1ccc(cc1COCc2cccnn2)Cl 34a_100011217248_100016990269 [0,2,0,0,0,0|2,0,0]=4 25874 B18R2.6544 Fc1ccc(cc1COCc2cccnn2)Cl 7a_100011217248_100016990269 [0,2,0,0,0,0|2,0,0]=4 25875 B18R2.6544 Fc1ccc(cc1COCc2cccnn2)I 34a_100000049604_100016990269 [0,2,0,0,0,0|2,0,0]=4 25876 B18R2.6544 Fc1ccc(cc1COCc2cccnn2)I 7a_100000049604_100016990269 [0,2,0,0,0,0|2,0,0]=4 25877 B18R2.6544 Fc1ccc(cc1COCc2ccncc2)Br 7a_100000246282_100015193705 [0,2,0,0,0,0|1,0,0]=3 25878 B18R2.6544 Fc1ccc(cc1COCc2ccncc2)Cl 7a_100011217248_100015193705 [0,2,0,0,0,0|1,0,0]=3 25879 B18R2.6544 Fc1ccc(cc1COCc2ccncc2)I 7a_100000049604_100015193705 [0,2,0,0,0,0|1,0,0]=3 25880 B18R2.6544 Fc1ccc(cc1COCc2cnccn2)Br 34a_100000246282_100016995436 [0,2,0,0,0,0|2,0,0]=4 25881 B18R2.6544 Fc1ccc(cc1COCc2cnccn2)Br 7a_100000246282_100016995436 [0,2,0,0,0,0|2,0,0]=4 25882 B18R2.6544 Fc1ccc(cc1COCc2cnccn2)Cl 34a_100011217248_100016995436 [0,2,0,0,0,0|2,0,0]=4 25883 B18R2.6544 Fc1ccc(cc1COCc2cnccn2)Cl 7a_100011217248_100016995436 [0,2,0,0,0,0|2,0,0]=4 25884 B18R2.6544 Fc1ccc(cc1COCc2cnccn2)I 34a_100000049604_100016995436 [0,2,0,0,0,0|2,0,0]=4 25885 B18R2.6544 Fc1ccc(cc1COCc2cnccn2)I 7a_100000049604_100016995436 [0,2,0,0,0,0|2,0,0]=4 25886 B18R2.6544 Fc1ccc(cc1COCc2cncnc2)Br 34a_100000246282_100015196519 [0,2,0,0,0,0|2,0,0]=4 25887 B18R2.6544 Fc1ccc(cc1COCc2cncnc2)Br 7a_100000246282_100015196519 [0,2,0,0,0,0|2,0,0]=4 25888 B18R2.6544 Fc1ccc(cc1COCc2cncnc2)Cl 34a_100011217248_100015196519 [0,2,0,0,0,0|2,0,0]=4 25889 B18R2.6544 Fc1ccc(cc1COCc2cncnc2)Cl 7a_100011217248_100015196519 [0,2,0,0,0,0|2,0,0]=4 25890 B18R2.6544 Fc1ccc(cc1COCc2cncnc2)I 34a_100000049604_100015196519 [0,2,0,0,0,0|2,0,0]=4 25891 B18R2.6544 Fc1ccc(cc1COCc2cncnc2)I 7a_100000049604_100015196519 [0,2,0,0,0,0|2,0,0]=4 25892 B18R2.6544 Fc1ccc(cc1COCc2ncccn2)Br 34a_100000246282_100000703007 [0,2,0,0,0,0|2,0,0]=4 25893 B18R2.6544 Fc1ccc(cc1COCc2ncccn2)Br 7a_100000246282_100000703007 [0,2,0,0,0,0|2,0,0]=4 25894 B18R2.6544 Fc1ccc(cc1COCc2ncccn2)Cl 34a_100011217248_100000703007 [0,2,0,0,0,0|2,0,0]=4 25895 B18R2.6544 Fc1ccc(cc1COCc2ncccn2)Cl 7a_100011217248_100000703007 [0,2,0,0,0,0|2,0,0]=4 25896 B18R2.6544 Fc1ccc(cc1COCc2ncccn2)I 34a_100000049604_100000703007 [0,2,0,0,0,0|2,0,0]=4 25897 B18R2.6544 Fc1ccc(cc1COCc2ncccn2)I 7a_100000049604_100000703007 [0,2,0,0,0,0|2,0,0]=4 25898 B18R2.6544 Fc1ccc(cc1CSCc2ccccc2)Br 62a_100000211182_100000736399 [0,2,0,0,0,0|0,1,0]=3 25899 B18R2.6544 Fc1ccc(cc1CSCc2ccccc2)Br 62a_100000736399_100015291786 [0,2,0,0,0,0|0,1,0]=3 25900 B18R2.6544 Fc1ccc(cc1CSCc2ccccc2)Cl 62a_100000211182_100000716957 [0,2,0,0,0,0|0,1,0]=3 25901 B18R2.6544 Fc1ccc(cc1CSCc2ccccc2)Cl 62a_100000716957_100015291786 [0,2,0,0,0,0|0,1,0]=3 25902 B18R2.6544 Fc1ccc(cc1CSCc2ccccc2)I 62a_100000211182_200010149601 [0,2,0,0,0,0|0,1,0]=3 25903 B18R2.6544 Fc1ccc(cc1CSCc2ccccc2)I 62a_200010149601_100015291786 [0,2,0,0,0,0|0,1,0]=3 25904 B18R2.6544 Fc1ccc(cc1CSCc2ccccn2)Br 62a_100000721315_100000736399 [0,2,0,0,0,0|1,1,0]=4 25905 B18R2.6544 Fc1ccc(cc1CSCc2ccccn2)Br 62a_100000736399_100000721315 [0,2,0,0,0,0|1,1,0]=4 25906 B18R2.6544 Fc1ccc(cc1CSCc2ccccn2)Cl 62a_100000716957_100000721315 [0,2,0,0,0,0|1,1,0]=4 25907 B18R2.6544 Fc1ccc(cc1CSCc2ccccn2)Cl 62a_100000721315_100000716957 [0,2,0,0,0,0|1,1,0]=4 25908 B18R2.6544 Fc1ccc(cc1CSCc2ccccn2)I 62a_100000721315_200010149601 [0,2,0,0,0,0|1,1,0]=4 25909 B18R2.6544 Fc1ccc(cc1CSCc2ccccn2)I 62a_200010149601_100000721315 [0,2,0,0,0,0|1,1,0]=4 25910 B18R2.6544 Fc1ccc(cc1CSCc2cccnc2)Br 62a_100000736399_100000741622 [0,2,0,0,0,0|1,1,0]=4 25911 B18R2.6544 Fc1ccc(cc1CSCc2cccnc2)Br 62a_100000741622_100000736399 [0,2,0,0,0,0|1,1,0]=4 25912 B18R2.6544 Fc1ccc(cc1CSCc2cccnc2)Cl 62a_100000716957_100000741622 [0,2,0,0,0,0|1,1,0]=4 25913 B18R2.6544 Fc1ccc(cc1CSCc2cccnc2)Cl 62a_100000741622_100000716957 [0,2,0,0,0,0|1,1,0]=4 25914 B18R2.6544 Fc1ccc(cc1CSCc2cccnc2)I 62a_100000741622_200010149601 [0,2,0,0,0,0|1,1,0]=4 25915 B18R2.6544 Fc1ccc(cc1CSCc2cccnc2)I 62a_200010149601_100000741622 [0,2,0,0,0,0|1,1,0]=4 25916 B18R2.6544 Fc1ccc(cc1CSCc2ccncc2)Br 62a_100000736399_100015193705 [0,2,0,0,0,0|1,1,0]=4 25917 B18R2.6544 Fc1ccc(cc1CSCc2ccncc2)Br 62a_100015193705_100000736399 [0,2,0,0,0,0|1,1,0]=4 25918 B18R2.6544 Fc1ccc(cc1CSCc2ccncc2)Cl 62a_100000716957_100015193705 [0,2,0,0,0,0|1,1,0]=4 25919 B18R2.6544 Fc1ccc(cc1CSCc2ccncc2)Cl 62a_100015193705_100000716957 [0,2,0,0,0,0|1,1,0]=4 25920 B18R2.6544 Fc1ccc(cc1CSCc2ccncc2)I 62a_100015193705_200010149601 [0,2,0,0,0,0|1,1,0]=4 25921 B18R2.6544 Fc1ccc(cc1CSCc2ccncc2)I 62a_200010149601_100015193705 [0,2,0,0,0,0|1,1,0]=4 25922 B18R2.6544 Fc1ccc(cc1NCCc2ccccc2)Br 34a_100000740924_100000765856 [0,2,0,0,0,0|2,0,0]=4 25923 B18R2.6544 Fc1ccc(cc1NCCc2ccccc2)Cl 34a_100000212115_100000765856 [0,2,0,0,0,0|2,0,0]=4 25924 B18R2.6544 Fc1ccc(cc1NCCc2ccccc2)I 34a_100011464823_100000765856 [0,2,0,0,0,0|2,0,0]=4 25925 B18R2.6544 Fc1ccc(cc1OCCc2ccccc2)Br 34a_100000686035_100000765856 [0,2,0,0,0,0|2,0,0]=4 25926 B18R2.6544 Fc1ccc(cc1OCCc2ccccc2)Br 7a_100000686035_100000765856 [0,2,0,0,0,0|2,0,0]=4 25927 B18R2.6544 Fc1ccc(cc1OCCc2ccccc2)Cl 34a_100000757397_100000765856 [0,2,0,0,0,0|2,0,0]=4 25928 B18R2.6544 Fc1ccc(cc1OCCc2ccccc2)Cl 7a_100000757397_100000765856 [0,2,0,0,0,0|2,0,0]=4 25929 B18R2.6544 Fc1ccc(cc1OCCc2ccccc2)I 34a_100009958187_100000765856 [0,2,0,0,0,0|2,0,0]=4 25930 B18R2.6544 Fc1ccc(cc1OCCc2ccccc2)I 7a_100009958187_100000765856 [0,2,0,0,0,0|2,0,0]=4 25931 B18R2.6544 Fc1ccc(cc1SCCc2ccccc2)Br 62a_100000765856_100011217312 [0,2,0,0,0,0|2,0,0]=4 25932 B18R2.6544 Fc1ccc(cc1SCCc2ccccc2)Br 62a_100011217312_100011218657 [0,2,0,0,0,0|2,0,0]=4 25933 B18R2.6544 Fc1ccc(cc1SCCc2ccccc2)Cl 62a_100000765856_100011218116 [0,2,0,0,0,0|2,0,0]=4 25934 B18R2.6544 Fc1ccc(cc1SCCc2ccccc2)Cl 62a_100011218116_100011218657 [0,2,0,0,0,0|2,0,0]=4 25935 B18R2.6544 Fc1ccc(nc1CNCc2ccccc2)Br 2230a_100015324214_100010065826 [0,2,0,0,0,0|2,0,0]=4 25936 B18R2.6544 Fc1ccc(nc1CNCc2ccccc2)Br 270004a_100015324214_100009814804 [0,2,0,0,0,0|2,0,0]=4 25937 B18R2.6544 Fc1ccc(nc1CNCc2ccccc2)Br 34a_100015324214_100010065826 [0,2,0,0,0,0|2,0,0]=4 25938 B18R2.6544 Fc1ccc(nc1CNCc2ccccc2)Cl 2230a_100009887702_100015291786 [0,2,0,0,0,0|2,0,0]=4 25939 B18R2.6544 Fc1ccc(nc1CNCc2ccccc2)Cl 2230a_100015324214_100009881012 [0,2,0,0,0,0|2,0,0]=4 25940 B18R2.6544 Fc1ccc(nc1CNCc2ccccc2)Cl 270004a_100015324214_100000050918 [0,2,0,0,0,0|2,0,0]=4 25941 B18R2.6544 Fc1ccc(nc1CNCc2ccccc2)Cl 34a_100009887702_100015291786 [0,2,0,0,0,0|2,0,0]=4 25942 B18R2.6544 Fc1ccc(nc1CNCc2ccccc2)Cl 34a_100015324214_100009881012 [0,2,0,0,0,0|2,0,0]=4 25943 B18R2.6544 Fc1ccc(nc1COCc2ccccc2)Br 34a_100000210790_100010065826 [0,2,0,0,0,0|1,0,0]=3 25944 B18R2.6544 Fc1ccc(nc1COCc2ccccc2)Br 7a_100000210790_100010065826 [0,2,0,0,0,0|1,0,0]=3 25945 B18R2.6544 Fc1ccc(nc1COCc2ccccc2)Cl 34a_100000210790_100009881012 [0,2,0,0,0,0|1,0,0]=3 25946 B18R2.6544 Fc1ccc(nc1COCc2ccccc2)Cl 7a_100000210790_100009881012 [0,2,0,0,0,0|1,0,0]=3 25947 B18R2.6544 Fc1ccc(nc1CSCc2ccccc2)Br 62a_100000211182_100010065826 [0,2,0,0,0,0|1,1,0]=4 25948 B18R2.6544 Fc1ccc(nc1CSCc2ccccc2)Br 62a_100010065826_100015291786 [0,2,0,0,0,0|1,1,0]=4 25949 B18R2.6544 Fc1ccc(nc1CSCc2ccccc2)Cl 62a_100000211182_100009881012 [0,2,0,0,0,0|1,1,0]=4 25950 B18R2.6544 Fc1ccc(nc1CSCc2ccccc2)Cl 62a_100009881012_100015291786 [0,2,0,0,0,0|1,1,0]=4 25951 B18R2.6544 Fc1cnc(c(c1)CNCc2ccccc2)Br 2230a_100010760786_100015291786 [0,2,0,0,0,0|2,0,0]=4 25952 B18R2.6544 Fc1cnc(c(c1)CNCc2ccccc2)Br 34a_100010760786_100015291786 [0,2,0,0,0,0|2,0,0]=4 25953 B18R2.6544 Fc1cnc(c(c1)CNCc2ccccc2)Cl 207a_100015324214_100000079965 [0,2,0,0,0,0|2,0,0]=4 25954 B18R2.6544 Fc1cnc(c(c1)COCc2ccccc2)Cl 34a_100000079972_100015291786 [0,2,0,0,0,0|1,0,0]=3 25955 B18R2.6544 Fc1cnc(c(c1)COCc2ccccc2)Cl 7a_100000079972_100000211182 [0,2,0,0,0,0|1,0,0]=3 25956 B18R2.6544 Fc1cnc(c(c1)COCc2ccccn2)Cl 34a_100000079972_100000721315 [0,2,0,0,0,0|2,0,0]=4 25957 B18R2.6544 Fc1cnc(c(c1)COCc2ccccn2)Cl 7a_100000079972_100000721315 [0,2,0,0,0,0|2,0,0]=4 25958 B18R2.6544 Fc1cnc(c(c1)COCc2cccnc2)Cl 34a_100000079972_100000733263 [0,2,0,0,0,0|2,0,0]=4 25959 B18R2.6544 Fc1cnc(c(c1)COCc2cccnc2)Cl 7a_100000079972_100000741622 [0,2,0,0,0,0|2,0,0]=4 25960 B18R2.6544 Fc1cnc(c(c1)COCc2ccncc2)Cl 7a_100000079972_100015193705 [0,2,0,0,0,0|2,0,0]=4 25961 B18R2.6544 Fc1cnc(cc1CNCc2ccccc2)Br 270004a_100015324214_100000707870 [0,2,0,0,0,0|2,0,0]=4 25962 B18R2.6544 Fc1cnc(cc1COCc2ccccc2)Cl 34a_100000081974_100015291786 [0,2,0,0,0,0|1,0,0]=3 25963 B18R2.6544 Fc1cnc(cc1COCc2ccccc2)Cl 7a_100000081974_100000211182 [0,2,0,0,0,0|1,0,0]=3 25964 B18R2.6544 Fc1cnc(cc1COCc2ccccn2)Cl 34a_100000081974_100000721315 [0,2,0,0,0,0|2,0,0]=4 25965 B18R2.6544 Fc1cnc(cc1COCc2ccccn2)Cl 7a_100000081974_100000721315 [0,2,0,0,0,0|2,0,0]=4 25966 B18R2.6544 Fc1cnc(cc1COCc2cccnc2)Cl 34a_100000081974_100000733263 [0,2,0,0,0,0|2,0,0]=4 25967 B18R2.6544 Fc1cnc(cc1COCc2cccnc2)Cl 7a_100000081974_100000741622 [0,2,0,0,0,0|2,0,0]=4 25968 B18R2.6544 Fc1cnc(cc1COCc2ccncc2)Cl 7a_100000081974_100015193705 [0,2,0,0,0,0|2,0,0]=4 25969 B18R2.6544 Fc1ncc(cc1COCc2ccccc2)Br 34a_100010202234_100015291786 [0,2,0,0,0,0|1,0,0]=3 25970 B18R2.6544 Fc1ncc(cc1COCc2ccccc2)Br 7a_100010202234_100000211182 [0,2,0,0,0,0|1,0,0]=3 25971 B18R2.6544 Fc1ncc(cc1COCc2ccccc2)Cl 34a_200000081815_100015291786 [0,2,0,0,0,0|1,0,0]=3 25972 B18R2.6544 Fc1ncc(cc1COCc2ccccc2)Cl 7a_200000081815_100000211182 [0,2,0,0,0,0|1,0,0]=3 25973 B18R2.6544 Fc1ncc(cc1COCc2ccccn2)Br 34a_100010202234_100000721315 [0,2,0,0,0,0|2,0,0]=4 25974 B18R2.6544 Fc1ncc(cc1COCc2ccccn2)Br 7a_100010202234_100000721315 [0,2,0,0,0,0|2,0,0]=4 25975 B18R2.6544 Fc1ncc(cc1COCc2ccccn2)Cl 34a_200000081815_100000721315 [0,2,0,0,0,0|2,0,0]=4 25976 B18R2.6544 Fc1ncc(cc1COCc2ccccn2)Cl 7a_200000081815_100000721315 [0,2,0,0,0,0|2,0,0]=4 25977 B18R2.6544 Fc1ncc(cc1COCc2cccnc2)Br 34a_100010202234_100000733263 [0,2,0,0,0,0|2,0,0]=4 25978 B18R2.6544 Fc1ncc(cc1COCc2cccnc2)Br 7a_100010202234_100000741622 [0,2,0,0,0,0|2,0,0]=4 25979 B18R2.6544 Fc1ncc(cc1COCc2cccnc2)Cl 34a_200000081815_100000733263 [0,2,0,0,0,0|2,0,0]=4 25980 B18R2.6544 Fc1ncc(cc1COCc2cccnc2)Cl 7a_200000081815_100000741622 [0,2,0,0,0,0|2,0,0]=4 25981 B18R2.6544 Fc1ncc(cc1COCc2ccncc2)Br 7a_100010202234_100015193705 [0,2,0,0,0,0|2,0,0]=4 25982 B18R2.6544 Fc1ncc(cc1COCc2ccncc2)Cl 7a_200000081815_100015193705 [0,2,0,0,0,0|2,0,0]=4 25983 B18R2.6544 Nc1ccc(c(c1)C=CCc2ccccc2)Br 271570a_200016263579_100000750459 [0,2,0,0,0,0|1,0,1]=4 25984 B18R2.6544 Nc1ccc(c(c1)C=CCc2ccccc2)Cl 271570a_200016263579_100012360549 [0,2,0,0,0,0|1,0,1]=4 25985 B18R2.6544 Nc1ccc(c(c1)C=CCc2ccccc2)F 271570a_200016263579_100000760356 [0,2,0,0,0,0|1,0,1]=4 25986 B18R2.6544 Nc1ccc(c(c1)C=CCc2ccccc2)N 271570a_200016263579_100011534242 [0,2,0,0,0,0|1,0,1]=4 25987 B18R2.6544 Nc1ccc(c(c1)C=CCc2ccccc2)O 271570a_200016263579_100011534360 [0,2,0,0,0,0|1,0,1]=4 25988 B18R2.6544 Nc1ccc(c(c1)COCc2ccccc2)Br 34a_100012347228_100015291786 [0,2,0,0,0,0|0,0,0]=2 25989 B18R2.6544 Nc1ccc(c(c1)COCc2ccccc2)Cl 34a_100011273577_100015291786 [0,2,0,0,0,0|0,0,0]=2 25990 B18R2.6544 Nc1ccc(c(c1)COCc2ccccc2)F 34a_100011218011_100015291786 [0,2,0,0,0,0|0,0,0]=2 25991 B18R2.6544 Nc1ccc(c(c1)COCc2ccccn2)Br 34a_100012347228_100000721315 [0,2,0,0,0,0|1,0,0]=3 25992 B18R2.6544 Nc1ccc(c(c1)COCc2ccccn2)Cl 34a_100011273577_100000721315 [0,2,0,0,0,0|1,0,0]=3 25993 B18R2.6544 Nc1ccc(c(c1)COCc2ccccn2)F 34a_100011218011_100000721315 [0,2,0,0,0,0|1,0,0]=3 25994 B18R2.6544 Nc1ccc(c(c1)COCc2cccnc2)Br 34a_100012347228_100000733263 [0,2,0,0,0,0|1,0,0]=3 25995 B18R2.6544 Nc1ccc(c(c1)COCc2cccnc2)Cl 34a_100011273577_100000733263 [0,2,0,0,0,0|1,0,0]=3 25996 B18R2.6544 Nc1ccc(c(c1)COCc2cccnc2)F 34a_100011218011_100000733263 [0,2,0,0,0,0|1,0,0]=3 25997 B18R2.6544 Nc1ccc(c(c1)COCc2cccnn2)Br 34a_100012347228_100016990269 [0,2,0,0,0,0|2,0,0]=4 25998 B18R2.6544 Nc1ccc(c(c1)COCc2cccnn2)Cl 34a_100011273577_100016990269 [0,2,0,0,0,0|2,0,0]=4 25999 B18R2.6544 Nc1ccc(c(c1)COCc2cccnn2)F 34a_100011218011_100016990269 [0,2,0,0,0,0|2,0,0]=4 26000 B18R2.6544 Nc1ccc(c(c1)COCc2cnccn2)Br 34a_100012347228_100016995436 [0,2,0,0,0,0|2,0,0]=4 26001 B18R2.6544 Nc1ccc(c(c1)COCc2cnccn2)Cl 34a_100011273577_100016995436 [0,2,0,0,0,0|2,0,0]=4 26002 B18R2.6544 Nc1ccc(c(c1)COCc2cnccn2)F 34a_100011218011_100016995436 [0,2,0,0,0,0|2,0,0]=4 26003 B18R2.6544 Nc1ccc(c(c1)COCc2cncnc2)Br 34a_100012347228_100015196519 [0,2,0,0,0,0|2,0,0]=4 26004 B18R2.6544 Nc1ccc(c(c1)COCc2cncnc2)Cl 34a_100011273577_100015196519 [0,2,0,0,0,0|2,0,0]=4 26005 B18R2.6544 Nc1ccc(c(c1)COCc2cncnc2)F 34a_100011218011_100015196519 [0,2,0,0,0,0|2,0,0]=4 26006 B18R2.6544 Nc1ccc(c(c1)COCc2ncccn2)Br 34a_100012347228_100000703007 [0,2,0,0,0,0|2,0,0]=4 26007 B18R2.6544 Nc1ccc(c(c1)COCc2ncccn2)Cl 34a_100011273577_100000703007 [0,2,0,0,0,0|2,0,0]=4 26008 B18R2.6544 Nc1ccc(c(c1)COCc2ncccn2)F 34a_100011218011_100000703007 [0,2,0,0,0,0|2,0,0]=4 26009 B18R2.6544 Nc1ccc(c(c1)OCCc2ccccc2)Cl 34a_100011934209_100000765856 [0,2,0,0,0,0|2,0,0]=4 26010 B18R2.6544 Nc1ccc(c(c1)OCCc2ccccc2)F 34a_100012017398_100000765856 [0,2,0,0,0,0|2,0,0]=4 26011 B18R2.6544 Nc1ccc(c(c1)OCCc2ccccc2)F 7a_100012017398_100000765856 [0,2,0,0,0,0|2,0,0]=4 26012 B18R2.6544 Nc1ccc(c(c1)OCCc2ccccc2)N 34a_100025717382_100000765856 [0,2,0,0,0,0|2,0,0]=4 26013 B18R2.6544 Nc1ccc(c(c1)SCCc2ccccc2)Br 62a_100000750459_100011218657 [0,2,0,0,0,0|2,0,0]=4 26014 B18R2.6544 Nc1ccc(c(c1)SCCc2ccccc2)Br 62a_100000765856_100000750459 [0,2,0,0,0,0|2,0,0]=4 26015 B18R2.6544 Nc1ccc(c(c1)SCCc2ccccc2)Cl 62a_100000765856_100012360549 [0,2,0,0,0,0|2,0,0]=4 26016 B18R2.6544 Nc1ccc(c(c1)SCCc2ccccc2)Cl 62a_100012360549_100011218657 [0,2,0,0,0,0|2,0,0]=4 26017 B18R2.6544 Nc1ccc(c(c1)SCCc2ccccc2)F 62a_100000760356_100011218657 [0,2,0,0,0,0|2,0,0]=4 26018 B18R2.6544 Nc1ccc(c(c1)SCCc2ccccc2)F 62a_100000765856_100000760356 [0,2,0,0,0,0|2,0,0]=4 26019 B18R2.6544 Nc1ccc(c(c1)SCCc2ccccc2)N 62a_100000765856_100011534242 [0,2,0,0,0,0|2,0,0]=4 26020 B18R2.6544 Nc1ccc(c(c1)SCCc2ccccc2)N 62a_100011534242_100011218657 [0,2,0,0,0,0|2,0,0]=4 26021 B18R2.6544 Nc1ccc(c(c1)SCCc2ccccc2)O 62a_100000765856_100011534360 [0,2,0,0,0,0|2,0,0]=4 26022 B18R2.6544 Nc1ccc(c(c1)SCCc2ccccc2)O 62a_100011534360_100011218657 [0,2,0,0,0,0|2,0,0]=4 26023 B18R2.6544 Nc1ccc(cc1C=CCc2ccccc2)Br 271570a_200016263579_100000187925 [0,2,0,0,0,0|1,0,1]=4 26024 B18R2.6544 Nc1ccc(cc1C=CCc2ccccc2)Cl 271570a_200016263579_100000761889 [0,2,0,0,0,0|1,0,1]=4 26025 B18R2.6544 Nc1ccc(cc1C=CCc2ccccc2)F 271570a_200016263579_100000760547 [0,2,0,0,0,0|1,0,1]=4 26026 B18R2.6544 Nc1ccc(cc1C=CCc2ccccc2)O 271570a_200016263579_100012001276 [0,2,0,0,0,0|1,0,1]=4 26027 B18R2.6544 Nc1ccc(cc1COCc2ccccc2)Br 34a_100012353972_100015291786 [0,2,0,0,0,0|0,0,0]=2 26028 B18R2.6544 Nc1ccc(cc1COCc2ccccc2)Br 7a_100012353972_100000211182 [0,2,0,0,0,0|0,0,0]=2 26029 B18R2.6544 Nc1ccc(cc1COCc2ccccc2)Cl 34a_100011214999_100015291786 [0,2,0,0,0,0|0,0,0]=2 26030 B18R2.6544 Nc1ccc(cc1COCc2ccccc2)Cl 7a_100011214999_100000211182 [0,2,0,0,0,0|0,0,0]=2 26031 B18R2.6544 Nc1ccc(cc1COCc2ccccc2)F 34a_100011296978_100015291786 [0,2,0,0,0,0|0,0,0]=2 26032 B18R2.6544 Nc1ccc(cc1COCc2ccccc2)F 7a_100011296978_100000211182 [0,2,0,0,0,0|0,0,0]=2 26033 B18R2.6544 Nc1ccc(cc1COCc2ccccn2)Br 34a_100012353972_100000721315 [0,2,0,0,0,0|1,0,0]=3 26034 B18R2.6544 Nc1ccc(cc1COCc2ccccn2)Br 7a_100012353972_100000721315 [0,2,0,0,0,0|1,0,0]=3 26035 B18R2.6544 Nc1ccc(cc1COCc2ccccn2)Cl 34a_100011214999_100000721315 [0,2,0,0,0,0|1,0,0]=3 26036 B18R2.6544 Nc1ccc(cc1COCc2ccccn2)Cl 7a_100011214999_100000721315 [0,2,0,0,0,0|1,0,0]=3 26037 B18R2.6544 Nc1ccc(cc1COCc2ccccn2)F 34a_100011296978_100000721315 [0,2,0,0,0,0|1,0,0]=3 26038 B18R2.6544 Nc1ccc(cc1COCc2ccccn2)F 7a_100011296978_100000721315 [0,2,0,0,0,0|1,0,0]=3 26039 B18R2.6544 Nc1ccc(cc1COCc2cccnc2)Br 34a_100012353972_100000733263 [0,2,0,0,0,0|1,0,0]=3 26040 B18R2.6544 Nc1ccc(cc1COCc2cccnc2)Br 7a_100012353972_100000741622 [0,2,0,0,0,0|1,0,0]=3 26041 B18R2.6544 Nc1ccc(cc1COCc2cccnc2)Cl 34a_100011214999_100000733263 [0,2,0,0,0,0|1,0,0]=3 26042 B18R2.6544 Nc1ccc(cc1COCc2cccnc2)Cl 7a_100011214999_100000741622 [0,2,0,0,0,0|1,0,0]=3 26043 B18R2.6544 Nc1ccc(cc1COCc2cccnc2)F 34a_100011296978_100000733263 [0,2,0,0,0,0|1,0,0]=3 26044 B18R2.6544 Nc1ccc(cc1COCc2cccnc2)F 7a_100011296978_100000741622 [0,2,0,0,0,0|1,0,0]=3 26045 B18R2.6544 Nc1ccc(cc1COCc2cccnn2)Br 34a_100012353972_100016990269 [0,2,0,0,0,0|2,0,0]=4 26046 B18R2.6544 Nc1ccc(cc1COCc2cccnn2)Br 7a_100012353972_100016990269 [0,2,0,0,0,0|2,0,0]=4 26047 B18R2.6544 Nc1ccc(cc1COCc2cccnn2)Cl 34a_100011214999_100016990269 [0,2,0,0,0,0|2,0,0]=4 26048 B18R2.6544 Nc1ccc(cc1COCc2cccnn2)Cl 7a_100011214999_100016990269 [0,2,0,0,0,0|2,0,0]=4 26049 B18R2.6544 Nc1ccc(cc1COCc2cccnn2)F 34a_100011296978_100016990269 [0,2,0,0,0,0|2,0,0]=4 26050 B18R2.6544 Nc1ccc(cc1COCc2cccnn2)F 7a_100011296978_100016990269 [0,2,0,0,0,0|2,0,0]=4 26051 B18R2.6544 Nc1ccc(cc1COCc2ccncc2)Br 7a_100012353972_100015193705 [0,2,0,0,0,0|1,0,0]=3 26052 B18R2.6544 Nc1ccc(cc1COCc2ccncc2)Cl 7a_100011214999_100015193705 [0,2,0,0,0,0|1,0,0]=3 26053 B18R2.6544 Nc1ccc(cc1COCc2ccncc2)F 7a_100011296978_100015193705 [0,2,0,0,0,0|1,0,0]=3 26054 B18R2.6544 Nc1ccc(cc1COCc2cnccn2)Br 34a_100012353972_100016995436 [0,2,0,0,0,0|2,0,0]=4 26055 B18R2.6544 Nc1ccc(cc1COCc2cnccn2)Br 7a_100012353972_100016995436 [0,2,0,0,0,0|2,0,0]=4 26056 B18R2.6544 Nc1ccc(cc1COCc2cnccn2)Cl 34a_100011214999_100016995436 [0,2,0,0,0,0|2,0,0]=4 26057 B18R2.6544 Nc1ccc(cc1COCc2cnccn2)Cl 7a_100011214999_100016995436 [0,2,0,0,0,0|2,0,0]=4 26058 B18R2.6544 Nc1ccc(cc1COCc2cnccn2)F 34a_100011296978_100016995436 [0,2,0,0,0,0|2,0,0]=4 26059 B18R2.6544 Nc1ccc(cc1COCc2cnccn2)F 7a_100011296978_100016995436 [0,2,0,0,0,0|2,0,0]=4 26060 B18R2.6544 Nc1ccc(cc1COCc2cncnc2)Br 34a_100012353972_100015196519 [0,2,0,0,0,0|2,0,0]=4 26061 B18R2.6544 Nc1ccc(cc1COCc2cncnc2)Br 7a_100012353972_100015196519 [0,2,0,0,0,0|2,0,0]=4 26062 B18R2.6544 Nc1ccc(cc1COCc2cncnc2)Cl 34a_100011214999_100015196519 [0,2,0,0,0,0|2,0,0]=4 26063 B18R2.6544 Nc1ccc(cc1COCc2cncnc2)Cl 7a_100011214999_100015196519 [0,2,0,0,0,0|2,0,0]=4 26064 B18R2.6544 Nc1ccc(cc1COCc2cncnc2)F 34a_100011296978_100015196519 [0,2,0,0,0,0|2,0,0]=4 26065 B18R2.6544 Nc1ccc(cc1COCc2cncnc2)F 7a_100011296978_100015196519 [0,2,0,0,0,0|2,0,0]=4 26066 B18R2.6544 Nc1ccc(cc1COCc2ncccn2)Br 34a_100012353972_100000703007 [0,2,0,0,0,0|2,0,0]=4 26067 B18R2.6544 Nc1ccc(cc1COCc2ncccn2)Br 7a_100012353972_100000703007 [0,2,0,0,0,0|2,0,0]=4 26068 B18R2.6544 Nc1ccc(cc1COCc2ncccn2)Cl 34a_100011214999_100000703007 [0,2,0,0,0,0|2,0,0]=4 26069 B18R2.6544 Nc1ccc(cc1COCc2ncccn2)Cl 7a_100011214999_100000703007 [0,2,0,0,0,0|2,0,0]=4 26070 B18R2.6544 Nc1ccc(cc1COCc2ncccn2)F 34a_100011296978_100000703007 [0,2,0,0,0,0|2,0,0]=4 26071 B18R2.6544 Nc1ccc(cc1COCc2ncccn2)F 7a_100011296978_100000703007 [0,2,0,0,0,0|2,0,0]=4 26072 B18R2.6544 Nc1ccc(cc1OCCc2ccccc2)Br 34a_100000739049_100000765856 [0,2,0,0,0,0|2,0,0]=4 26073 B18R2.6544 Nc1ccc(cc1OCCc2ccccc2)Br 7a_100000739049_100000765856 [0,2,0,0,0,0|2,0,0]=4 26074 B18R2.6544 Nc1ccc(cc1OCCc2ccccc2)Cl 34a_100000185728_100000765856 [0,2,0,0,0,0|2,0,0]=4 26075 B18R2.6544 Nc1ccc(cc1OCCc2ccccc2)Cl 7a_100000185728_100000765856 [0,2,0,0,0,0|2,0,0]=4 26076 B18R2.6544 Nc1ccc(cc1OCCc2ccccc2)F 34a_100000753323_100000765856 [0,2,0,0,0,0|2,0,0]=4 26077 B18R2.6544 Nc1ccc(cc1OCCc2ccccc2)F 7a_100000753323_100000765856 [0,2,0,0,0,0|2,0,0]=4 26078 B18R2.6544 Nc1ccc(cc1OCCc2ccccc2)I 34a_100000057187_100000765856 [0,2,0,0,0,0|2,0,0]=4 26079 B18R2.6544 Nc1ccc(cc1OCCc2ccccc2)I 7a_100000057187_100000765856 [0,2,0,0,0,0|2,0,0]=4 26080 B18R2.6544 Nc1ccc(cc1SCCc2ccccc2)Br 62a_100000187925_100011218657 [0,2,0,0,0,0|2,0,0]=4 26081 B18R2.6544 Nc1ccc(cc1SCCc2ccccc2)Br 62a_100000765856_100000187925 [0,2,0,0,0,0|2,0,0]=4 26082 B18R2.6544 Nc1ccc(cc1SCCc2ccccc2)Cl 62a_100000761889_100011218657 [0,2,0,0,0,0|2,0,0]=4 26083 B18R2.6544 Nc1ccc(cc1SCCc2ccccc2)Cl 62a_100000765856_100000761889 [0,2,0,0,0,0|2,0,0]=4 26084 B18R2.6544 Nc1ccc(cc1SCCc2ccccc2)F 62a_100000760547_100011218657 [0,2,0,0,0,0|2,0,0]=4 26085 B18R2.6544 Nc1ccc(cc1SCCc2ccccc2)F 62a_100000765856_100000760547 [0,2,0,0,0,0|2,0,0]=4 26086 B18R2.6544 Nc1ccc(cc1SCCc2ccccc2)O 62a_100000765856_100012001276 [0,2,0,0,0,0|2,0,0]=4 26087 B18R2.6544 Nc1ccc(cc1SCCc2ccccc2)O 62a_100012001276_100011218657 [0,2,0,0,0,0|2,0,0]=4 26088 B18R2.6544 Nc1ncc(cc1COCc2ccccc2)Br 34a_100011934449_100015291786 [0,2,0,0,0,0|1,0,0]=3 26089 B18R2.6544 Nc1ncc(cc1COCc2ccccc2)Br 7a_100011934449_100000211182 [0,2,0,0,0,0|1,0,0]=3 26090 B18R2.6544 Nc1ncc(cc1COCc2ccccn2)Br 34a_100011934449_100000721315 [0,2,0,0,0,0|2,0,0]=4 26091 B18R2.6544 Nc1ncc(cc1COCc2ccccn2)Br 7a_100011934449_100000721315 [0,2,0,0,0,0|2,0,0]=4 26092 B18R2.6544 Nc1ncc(cc1COCc2cccnc2)Br 34a_100011934449_100000733263 [0,2,0,0,0,0|2,0,0]=4 26093 B18R2.6544 Nc1ncc(cc1COCc2cccnc2)Br 7a_100011934449_100000741622 [0,2,0,0,0,0|2,0,0]=4 26094 B18R2.6544 Nc1ncc(cc1COCc2ccncc2)Br 7a_100011934449_100015193705 [0,2,0,0,0,0|2,0,0]=4 26095 B18R2.6544 O=c1[nH]cc(cc1CNCc2ccccc2)F 207a_100015324214_100000137007 [0,2,0,0,0,0|2,0,0]=4 26096 B18R2.6544 O=c1[nH]cc(cc1CNCc2ccccc2)F 270004a_100015324214_100000137007 [0,2,0,0,0,0|2,0,0]=4 26097 B18R2.6544 Oc1ccc(c(c1)C=CCc2ccccc2)Br 271570a_200016263579_100012339312 [0,2,0,0,0,0|1,0,1]=4 26098 B18R2.6544 Oc1ccc(c(c1)C=CCc2ccccc2)Cl 271570a_200016263579_100000049588 [0,2,0,0,0,0|1,0,1]=4 26099 B18R2.6544 Oc1ccc(c(c1)C=CCc2ccccc2)F 271570a_200016263579_100000693481 [0,2,0,0,0,0|1,0,1]=4 26100 B18R2.6544 Oc1ccc(c(c1)C=CCc2ccccc2)O 271570a_200016263579_100009813629 [0,2,0,0,0,0|1,0,1]=4 26101 B18R2.6544 Oc1ccc(c(c1)NCCc2ccccc2)Br 34a_100011999798_100000765856 [0,2,0,0,0,0|2,0,0]=4 26102 B18R2.6544 Oc1ccc(c(c1)NCCc2ccccc2)Cl 34a_100011934297_100000765856 [0,2,0,0,0,0|2,0,0]=4 26103 B18R2.6544 Oc1ccc(c(c1)NCCc2ccccc2)F 34a_100012017239_100000765856 [0,2,0,0,0,0|2,0,0]=4 26104 B18R2.6544 Oc1ccc(c(c1)SCCc2ccccc2)Br 62a_100000765856_100012339312 [0,2,0,0,0,0|2,0,0]=4 26105 B18R2.6544 Oc1ccc(c(c1)SCCc2ccccc2)Br 62a_100012339312_100011218657 [0,2,0,0,0,0|2,0,0]=4 26106 B18R2.6544 Oc1ccc(c(c1)SCCc2ccccc2)Cl 62a_100000049588_100011218657 [0,2,0,0,0,0|2,0,0]=4 26107 B18R2.6544 Oc1ccc(c(c1)SCCc2ccccc2)Cl 62a_100000765856_100000049588 [0,2,0,0,0,0|2,0,0]=4 26108 B18R2.6544 Oc1ccc(c(c1)SCCc2ccccc2)F 62a_100000693481_100011218657 [0,2,0,0,0,0|2,0,0]=4 26109 B18R2.6544 Oc1ccc(c(c1)SCCc2ccccc2)F 62a_100000765856_100000693481 [0,2,0,0,0,0|2,0,0]=4 26110 B18R2.6544 Oc1ccc(c(c1)SCCc2ccccc2)O 62a_100000765856_100009813629 [0,2,0,0,0,0|2,0,0]=4 26111 B18R2.6544 Oc1ccc(cc1C=CCc2ccccc2)Br 271570a_200016263579_100012355227 [0,2,0,0,0,0|1,0,1]=4 26112 B18R2.6544 Oc1ccc(cc1C=CCc2ccccc2)Cl 271570a_200016263579_100011356953 [0,2,0,0,0,0|1,0,1]=4 26113 B18R2.6544 Oc1ccc(cc1C=CCc2ccccc2)F 271570a_200016263579_100000211999 [0,2,0,0,0,0|1,0,1]=4 26114 B18R2.6544 Oc1ccc(cc1CNCc2ccccc2)Br 270004a_100000730032_100015611070 [0,2,0,0,0,0|1,0,0]=3 26115 B18R2.6544 Oc1ccc(cc1CNCc2ccccc2)Br 34a_100000730032_100015291786 [0,2,0,0,0,0|1,0,0]=3 26116 B18R2.6544 Oc1ccc(cc1CNCc2ccccc2)Cl 270004a_100000238540_100015611070 [0,2,0,0,0,0|1,0,0]=3 26117 B18R2.6544 Oc1ccc(cc1CNCc2ccccc2)Cl 34a_100000238540_100015291786 [0,2,0,0,0,0|1,0,0]=3 26118 B18R2.6544 Oc1ccc(cc1CNCc2ccccc2)F 34a_100015324214_100010161318 [0,2,0,0,0,0|1,0,0]=3 26119 B18R2.6544 Oc1ccc(cc1CNCc2ccccn2)Br 270004a_100000730032_100000209966 [0,2,0,0,0,0|2,0,0]=4 26120 B18R2.6544 Oc1ccc(cc1CNCc2ccccn2)Br 34a_100000730032_100000721315 [0,2,0,0,0,0|2,0,0]=4 26121 B18R2.6544 Oc1ccc(cc1CNCc2ccccn2)Cl 270004a_100000238540_100000209966 [0,2,0,0,0,0|2,0,0]=4 26122 B18R2.6544 Oc1ccc(cc1CNCc2ccccn2)Cl 34a_100000238540_100000721315 [0,2,0,0,0,0|2,0,0]=4 26123 B18R2.6544 Oc1ccc(cc1CNCc2cccnc2)Br 270004a_100000730032_100000209961 [0,2,0,0,0,0|2,0,0]=4 26124 B18R2.6544 Oc1ccc(cc1CNCc2cccnc2)Br 34a_100000730032_100000733263 [0,2,0,0,0,0|2,0,0]=4 26125 B18R2.6544 Oc1ccc(cc1CNCc2cccnc2)Cl 270004a_100000238540_100000209961 [0,2,0,0,0,0|2,0,0]=4 26126 B18R2.6544 Oc1ccc(cc1CNCc2cccnc2)Cl 34a_100000238540_100000733263 [0,2,0,0,0,0|2,0,0]=4 26127 B18R2.6544 Oc1ccc(cc1COCc2ccccc2)F 34a_100000210790_100010161318 [0,2,0,0,0,0|0,0,0]=2 26128 B18R2.6544 Oc1ccc(cc1COCc2ccccc2)F 7a_100000210790_100010161318 [0,2,0,0,0,0|0,0,0]=2 26129 B18R2.6544 Oc1ccc(cc1CSCc2ccccc2)F 62a_100000211182_100010161318 [0,2,0,0,0,0|0,1,0]=3 26130 B18R2.6544 Oc1ccc(cc1CSCc2ccccc2)F 62a_100010161318_100015291786 [0,2,0,0,0,0|0,1,0]=3 26131 B18R2.6544 Oc1ccc(cc1CSCc2ccccn2)F 62a_100000721315_100010161318 [0,2,0,0,0,0|1,1,0]=4 26132 B18R2.6544 Oc1ccc(cc1CSCc2ccccn2)F 62a_100010161318_100000721315 [0,2,0,0,0,0|1,1,0]=4 26133 B18R2.6544 Oc1ccc(cc1CSCc2cccnc2)F 62a_100000741622_100010161318 [0,2,0,0,0,0|1,1,0]=4 26134 B18R2.6544 Oc1ccc(cc1CSCc2cccnc2)F 62a_100010161318_100000741622 [0,2,0,0,0,0|1,1,0]=4 26135 B18R2.6544 Oc1ccc(cc1CSCc2ccncc2)F 62a_100010161318_100015193705 [0,2,0,0,0,0|1,1,0]=4 26136 B18R2.6544 Oc1ccc(cc1CSCc2ccncc2)F 62a_100015193705_100010161318 [0,2,0,0,0,0|1,1,0]=4 26137 B18R2.6544 Oc1ccc(cc1NCCc2ccccc2)Br 34a_100000752626_100000765856 [0,2,0,0,0,0|2,0,0]=4 26138 B18R2.6544 Oc1ccc(cc1NCCc2ccccc2)Cl 34a_100000210500_100000765856 [0,2,0,0,0,0|2,0,0]=4 26139 B18R2.6544 Oc1ccc(cc1NCCc2ccccc2)F 34a_100000759472_100000765856 [0,2,0,0,0,0|2,0,0]=4 26140 B18R2.6544 Oc1ccc(cc1SCCc2ccccc2)Br 62a_100000765856_100012355227 [0,2,0,0,0,0|2,0,0]=4 26141 B18R2.6544 Oc1ccc(cc1SCCc2ccccc2)Br 62a_100012355227_100011218657 [0,2,0,0,0,0|2,0,0]=4 26142 B18R2.6544 Oc1ccc(cc1SCCc2ccccc2)Cl 62a_100000765856_100011356953 [0,2,0,0,0,0|2,0,0]=4 26143 B18R2.6544 Oc1ccc(cc1SCCc2ccccc2)Cl 62a_100011356953_100011218657 [0,2,0,0,0,0|2,0,0]=4 26144 B18R2.6544 Oc1ccc(cc1SCCc2ccccc2)F 62a_100000211999_100011218657 [0,2,0,0,0,0|2,0,0]=4 26145 B18R2.6544 Oc1ccc(cc1SCCc2ccccc2)F 62a_100000765856_100000211999 [0,2,0,0,0,0|2,0,0]=4 26146 B18R2.6544 Oc1ncc(cc1CNCc2ccccc2)Br 207a_100015324214_100010064889 [0,2,0,0,0,0|2,0,0]=4 26147 B18R2.6544 Oc1ncc(cc1CNCc2ccccc2)Br 270004a_100015324214_100010064889 [0,2,0,0,0,0|2,0,0]=4 26148 B18R2.32674 Brc1ccccc1CCNc2ccccc2Br 34a_100000210017_100012161201 [0,2,0,0,0,0|2,0,0]=4 26149 B18R2.32674 Brc1ccccc1CCNc2ccccc2I 34a_100000210053_100012161201 [0,2,0,0,0,0|2,0,0]=4 26150 B18R2.32674 Brc1ccccc1CCOc2ccccc2Br 34a_100000181306_100012161201 [0,2,0,0,0,0|2,0,0]=4 26151 B18R2.32674 Brc1ccccc1CCOc2ccccc2Br 7a_100000181306_100012161201 [0,2,0,0,0,0|2,0,0]=4 26152 B18R2.32674 Brc1ccccc1CCOc2ccccc2I 34a_100000739446_100012161201 [0,2,0,0,0,0|2,0,0]=4 26153 B18R2.32674 Brc1ccccc1CCOc2ccccc2I 7a_100000739446_100012161201 [0,2,0,0,0,0|2,0,0]=4 26154 B18R2.32674 Brc1ccccc1CCSc2ccccc2Br 62a_100000695589_100012161201 [0,2,0,0,0,0|2,0,0]=4 26155 B18R2.32674 Brc1ccccc1CCSc2ccccc2Br 62a_100012161201_100000695589 [0,2,0,0,0,0|2,0,0]=4 26156 B18R2.32674 Brc1ccccc1CNCc2ccccc2Br 207a_100000689332_100000211189 [0,2,0,0,0,0|1,0,0]=3 26157 B18R2.32674 Brc1ccccc1CNCc2ccccc2Br 2230a_100000689332_100000184730 [0,2,0,0,0,0|1,0,0]=3 26158 B18R2.32674 Brc1ccccc1CNCc2ccccc2Br 26a_100000689332_100000181306 [0,2,0,0,0,0|1,0,0]=3 26159 B18R2.32674 Brc1ccccc1CNCc2ccccc2Br 270004a_100000689332_100000211189 [0,2,0,0,0,0|1,0,0]=3 26160 B18R2.32674 Brc1ccccc1CNCc2ccccc2Br 34a_100000689332_100000184730 [0,2,0,0,0,0|1,0,0]=3 26161 B18R2.32674 Brc1ccccc1CNCc2ccccc2I 207a_100000689332_100000010305 [0,2,0,0,0,0|1,0,0]=3 26162 B18R2.32674 Brc1ccccc1CNCc2ccccc2I 207a_100015347259_100000211189 [0,2,0,0,0,0|1,0,0]=3 26163 B18R2.32674 Brc1ccccc1CNCc2ccccc2I 2230a_100000689332_100011215278 [0,2,0,0,0,0|1,0,0]=3 26164 B18R2.32674 Brc1ccccc1CNCc2ccccc2I 270004a_100000689332_100000010305 [0,2,0,0,0,0|1,0,0]=3 26165 B18R2.32674 Brc1ccccc1CNCc2ccccc2I 270004a_100015347259_100000211189 [0,2,0,0,0,0|1,0,0]=3 26166 B18R2.32674 Brc1ccccc1CNCc2ccccc2I 34a_100000689332_100011215278 [0,2,0,0,0,0|1,0,0]=3 26167 B18R2.32674 Brc1ccccc1CNCc2cccnc2Br 2230a_100000689332_100010140945 [0,2,0,0,0,0|2,0,0]=4 26168 B18R2.32674 Brc1ccccc1CNCc2cccnc2Br 2230a_100009818023_100000184730 [0,2,0,0,0,0|2,0,0]=4 26169 B18R2.32674 Brc1ccccc1CNCc2cccnc2Br 270004a_100009818023_100000211189 [0,2,0,0,0,0|2,0,0]=4 26170 B18R2.32674 Brc1ccccc1CNCc2cccnc2Br 34a_100000689332_100010140945 [0,2,0,0,0,0|2,0,0]=4 26171 B18R2.32674 Brc1ccccc1CNCc2cccnc2Br 34a_100009818023_100000184730 [0,2,0,0,0,0|2,0,0]=4 26172 B18R2.32674 Brc1ccccc1CNCc2ccncc2Br 207a_100020640021_100000211189 [0,2,0,0,0,0|2,0,0]=4 26173 B18R2.32674 Brc1ccccc1CNCc2ccncc2Br 270004a_100000689332_100000755692 [0,2,0,0,0,0|2,0,0]=4 26174 B18R2.32674 Brc1ccccc1CNCc2ccncc2Br 270004a_100020640021_100000211189 [0,2,0,0,0,0|2,0,0]=4 26175 B18R2.32674 Brc1ccccc1CNCc2cnccc2Br 270004a_100000689332_100009816821 [0,2,0,0,0,0|2,0,0]=4 26176 B18R2.32674 Brc1ccccc1CNCc2ncccc2Br 207a_100000689332_100011934733 [0,2,0,0,0,0|2,0,0]=4 26177 B18R2.32674 Brc1ccccc1CNCc2ncccc2Br 2230a_100000689332_100025702911 [0,2,0,0,0,0|2,0,0]=4 26178 B18R2.32674 Brc1ccccc1CNCc2ncccc2Br 270004a_100000689332_100011934733 [0,2,0,0,0,0|2,0,0]=4 26179 B18R2.32674 Brc1ccccc1CNCc2ncccc2Br 270004a_100020591323_100000211189 [0,2,0,0,0,0|2,0,0]=4 26180 B18R2.32674 Brc1ccccc1CNCc2ncccc2Br 34a_100000689332_100025702911 [0,2,0,0,0,0|2,0,0]=4 26181 B18R2.32674 Brc1ccccc1COCc2ccccc2Br 34a_100000756307_100000184730 [0,2,0,0,0,0|0,0,0]=2 26182 B18R2.32674 Brc1ccccc1COCc2ccccc2Br 7a_100000756307_100000184730 [0,2,0,0,0,0|0,0,0]=2 26183 B18R2.32674 Brc1ccccc1COCc2ccccc2I 34a_100000187465_100000184730 [0,2,0,0,0,0|0,0,0]=2 26184 B18R2.32674 Brc1ccccc1COCc2ccccc2I 34a_100000756307_100011215278 [0,2,0,0,0,0|0,0,0]=2 26185 B18R2.32674 Brc1ccccc1COCc2ccccc2I 7a_100000187465_100000184730 [0,2,0,0,0,0|0,0,0]=2 26186 B18R2.32674 Brc1ccccc1COCc2ccccc2I 7a_100000756307_100011215278 [0,2,0,0,0,0|0,0,0]=2 26187 B18R2.32674 Brc1ccccc1COCc2cccnc2Br 34a_100000719692_100000184730 [0,2,0,0,0,0|1,0,0]=3 26188 B18R2.32674 Brc1ccccc1COCc2cccnc2Br 34a_100000756307_100010140945 [0,2,0,0,0,0|1,0,0]=3 26189 B18R2.32674 Brc1ccccc1COCc2cccnc2Br 7a_100000719692_100000184730 [0,2,0,0,0,0|1,0,0]=3 26190 B18R2.32674 Brc1ccccc1COCc2cccnc2Br 7a_100000756307_100010140945 [0,2,0,0,0,0|1,0,0]=3 26191 B18R2.32674 Brc1ccccc1COCc2ncccc2Br 34a_100000756307_100025702911 [0,2,0,0,0,0|1,0,0]=3 26192 B18R2.32674 Brc1ccccc1COCc2ncccc2Br 34a_100011996772_100000184730 [0,2,0,0,0,0|1,0,0]=3 26193 B18R2.32674 Brc1ccccc1COCc2ncccc2Br 7a_100000756307_100025702911 [0,2,0,0,0,0|1,0,0]=3 26194 B18R2.32674 Brc1ccccc1CSCc2ccccc2Br 62a_100000184730_100000184730 [0,2,0,0,0,0|0,1,0]=3 26195 B18R2.32674 Brc1ccccc1CSCc2ccccc2I 62a_100000184730_100011216222 [0,2,0,0,0,0|0,1,0]=3 26196 B18R2.32674 Brc1ccccc1CSCc2ccccc2I 62a_100011216222_100000184730 [0,2,0,0,0,0|0,1,0]=3 26197 B18R2.32674 Brc1ccccc1CSCc2cccnc2Br 62a_100000184730_100010140945 [0,2,0,0,0,0|1,1,0]=4 26198 B18R2.32674 Brc1ccccc1CSCc2cccnc2Br 62a_100010140945_100000184730 [0,2,0,0,0,0|1,1,0]=4 26199 B18R2.32674 Brc1ccccc1CSCc2ncccc2Br 62a_100000184730_100025702911 [0,2,0,0,0,0|1,1,0]=4 26200 B18R2.32674 Brc1ccccc1CSCc2ncccc2Br 62a_100025702911_100000184730 [0,2,0,0,0,0|1,1,0]=4 26201 B18R2.32674 Brc1cccnc1CNCc2ccccc2I 207a_100015347259_100011934733 [0,2,0,0,0,0|2,0,0]=4 26202 B18R2.32674 Brc1cccnc1CNCc2ccccc2I 270004a_100015347259_100011934733 [0,2,0,0,0,0|2,0,0]=4 26203 B18R2.32674 Brc1cccnc1CNCc2ccccc2I 270004a_100020591323_100000010305 [0,2,0,0,0,0|2,0,0]=4 26204 B18R2.32674 Brc1cccnc1COCc2ccccc2I 34a_100000187465_100025702911 [0,2,0,0,0,0|1,0,0]=3 26205 B18R2.32674 Brc1cccnc1COCc2ccccc2I 34a_100011996772_100011215278 [0,2,0,0,0,0|1,0,0]=3 26206 B18R2.32674 Brc1cccnc1COCc2ccccc2I 7a_100000187465_100025702911 [0,2,0,0,0,0|1,0,0]=3 26207 B18R2.32674 Brc1cccnc1COCc2cccnc2Br 34a_100000719692_100025702911 [0,2,0,0,0,0|2,0,0]=4 26208 B18R2.32674 Brc1cccnc1COCc2cccnc2Br 34a_100011996772_100010140945 [0,2,0,0,0,0|2,0,0]=4 26209 B18R2.32674 Brc1cccnc1COCc2cccnc2Br 7a_100000719692_100025702911 [0,2,0,0,0,0|2,0,0]=4 26210 B18R2.32674 Brc1cccnc1COCc2ncccc2Br 34a_100011996772_100025702911 [0,2,0,0,0,0|2,0,0]=4 26211 B18R2.32674 Brc1cccnc1CSCc2ccccc2I 62a_100011216222_100025702911 [0,2,0,0,0,0|1,1,0]=4 26212 B18R2.32674 Brc1cccnc1CSCc2ccccc2I 62a_100025702911_100011216222 [0,2,0,0,0,0|1,1,0]=4 26213 B18R2.32674 Brc1ccncc1CNCc2ccccc2I 270004a_100015347259_100009816821 [0,2,0,0,0,0|2,0,0]=4 26214 B18R2.32674 Brc1cnccc1CNCc2ccccc2I 207a_100020640021_100000010305 [0,2,0,0,0,0|2,0,0]=4 26215 B18R2.32674 Brc1cnccc1CNCc2ccccc2I 270004a_100015347259_100000755692 [0,2,0,0,0,0|2,0,0]=4 26216 B18R2.32674 Brc1cnccc1CNCc2ccccc2I 270004a_100020640021_100000010305 [0,2,0,0,0,0|2,0,0]=4 26217 B18R2.32674 Brc1ncccc1CNCc2ccccc2I 2230a_100009818023_100011215278 [0,2,0,0,0,0|2,0,0]=4 26218 B18R2.32674 Brc1ncccc1CNCc2ccccc2I 270004a_100009818023_100000010305 [0,2,0,0,0,0|2,0,0]=4 26219 B18R2.32674 Brc1ncccc1CNCc2ccccc2I 34a_100009818023_100011215278 [0,2,0,0,0,0|2,0,0]=4 26220 B18R2.32674 Brc1ncccc1COCc2ccccc2I 34a_100000187465_100010140945 [0,2,0,0,0,0|1,0,0]=3 26221 B18R2.32674 Brc1ncccc1COCc2ccccc2I 34a_100000719692_100011215278 [0,2,0,0,0,0|1,0,0]=3 26222 B18R2.32674 Brc1ncccc1COCc2ccccc2I 7a_100000187465_100010140945 [0,2,0,0,0,0|1,0,0]=3 26223 B18R2.32674 Brc1ncccc1COCc2ccccc2I 7a_100000719692_100011215278 [0,2,0,0,0,0|1,0,0]=3 26224 B18R2.32674 Brc1ncccc1COCc2cccnc2Br 34a_100000719692_100010140945 [0,2,0,0,0,0|2,0,0]=4 26225 B18R2.32674 Brc1ncccc1COCc2cccnc2Br 7a_100000719692_100010140945 [0,2,0,0,0,0|2,0,0]=4 26226 B18R2.32674 Brc1ncccc1CSCc2ccccc2I 62a_100010140945_100011216222 [0,2,0,0,0,0|1,1,0]=4 26227 B18R2.32674 Brc1ncccc1CSCc2ccccc2I 62a_100011216222_100010140945 [0,2,0,0,0,0|1,1,0]=4 26228 B18R2.32674 Cc1ccccc1CCNc2ccccc2Br 34a_100000210017_100011713688 [0,2,0,0,0,0|2,0,0]=4 26229 B18R2.32674 Cc1ccccc1CCNc2ccccc2C 34a_100015192222_100011713688 [0,2,0,0,0,0|2,0,0]=4 26230 B18R2.32674 Cc1ccccc1CCNc2ccccc2Cl 34a_100000185783_100011713688 [0,2,0,0,0,0|2,0,0]=4 26231 B18R2.32674 Cc1ccccc1CCNc2ccccc2F 34a_100000210422_100011713688 [0,2,0,0,0,0|2,0,0]=4 26232 B18R2.32674 Cc1ccccc1CCNc2ccccc2I 34a_100000210053_100011713688 [0,2,0,0,0,0|2,0,0]=4 26233 B18R2.32674 Cc1ccccc1CCNc2ccccc2O 34a_100000185747_100011713688 [0,2,0,0,0,0|2,0,0]=4 26234 B18R2.32674 Cc1ccccc1CCOc2ccccc2Br 34a_100000181306_100011713688 [0,2,0,0,0,0|2,0,0]=4 26235 B18R2.32674 Cc1ccccc1CCOc2ccccc2Br 7a_100000181306_100011713688 [0,2,0,0,0,0|2,0,0]=4 26236 B18R2.32674 Cc1ccccc1CCOc2ccccc2C 34a_100000210338_100011713688 [0,2,0,0,0,0|2,0,0]=4 26237 B18R2.32674 Cc1ccccc1CCOc2ccccc2C 7a_100000210338_100011713688 [0,2,0,0,0,0|2,0,0]=4 26238 B18R2.32674 Cc1ccccc1CCOc2ccccc2Cl 34a_100000210172_100011713688 [0,2,0,0,0,0|2,0,0]=4 26239 B18R2.32674 Cc1ccccc1CCOc2ccccc2Cl 7a_100000210172_100011713688 [0,2,0,0,0,0|2,0,0]=4 26240 B18R2.32674 Cc1ccccc1CCOc2ccccc2F 34a_100000210171_100011713688 [0,2,0,0,0,0|2,0,0]=4 26241 B18R2.32674 Cc1ccccc1CCOc2ccccc2F 7a_100000210171_100011713688 [0,2,0,0,0,0|2,0,0]=4 26242 B18R2.32674 Cc1ccccc1CCOc2ccccc2I 34a_100000739446_100011713688 [0,2,0,0,0,0|2,0,0]=4 26243 B18R2.32674 Cc1ccccc1CCOc2ccccc2I 7a_100000739446_100011713688 [0,2,0,0,0,0|2,0,0]=4 26244 B18R2.32674 Cc1ccccc1CCOc2ccccc2N 34a_100000185747_100011713688 [0,2,0,0,0,0|2,0,0]=4 26245 B18R2.32674 Cc1ccccc1CCOc2ccccc2N 7a_100000185747_100011713688 [0,2,0,0,0,0|2,0,0]=4 26246 B18R2.32674 Cc1ccccc1CCSc2ccccc2Br 62a_100000695589_100011713688 [0,2,0,0,0,0|2,0,0]=4 26247 B18R2.32674 Cc1ccccc1CCSc2ccccc2Br 62a_100011713688_100000695589 [0,2,0,0,0,0|2,0,0]=4 26248 B18R2.32674 Cc1ccccc1CCSc2ccccc2C 62a_100000210755_100011713688 [0,2,0,0,0,0|2,0,0]=4 26249 B18R2.32674 Cc1ccccc1CCSc2ccccc2C 62a_100011713688_100000210755 [0,2,0,0,0,0|2,0,0]=4 26250 B18R2.32674 Cc1ccccc1CCSc2ccccc2Cl 62a_100000764095_100011713688 [0,2,0,0,0,0|2,0,0]=4 26251 B18R2.32674 Cc1ccccc1CCSc2ccccc2Cl 62a_100011713688_100000764095 [0,2,0,0,0,0|2,0,0]=4 26252 B18R2.32674 Cc1ccccc1CCSc2ccccc2F 62a_100011215700_100011713688 [0,2,0,0,0,0|2,0,0]=4 26253 B18R2.32674 Cc1ccccc1CCSc2ccccc2F 62a_100011713688_100011215700 [0,2,0,0,0,0|2,0,0]=4 26254 B18R2.32674 Cc1ccccc1CCSc2ccccc2N 62a_100000210017_100011713688 [0,2,0,0,0,0|2,0,0]=4 26255 B18R2.32674 Cc1ccccc1CCSc2ccccc2N 62a_100011713688_100000210017 [0,2,0,0,0,0|2,0,0]=4 26256 B18R2.32674 Cc1ccccc1CCSc2ccccc2O 62a_100000739446_100011713688 [0,2,0,0,0,0|2,0,0]=4 26257 B18R2.32674 Cc1ccccc1CCSc2ccccc2O 62a_100011713688_100000739446 [0,2,0,0,0,0|2,0,0]=4 26258 B18R2.32674 Cc1ccccc1CNCc2ccccc2Br 207a_100000174972_100000211189 [0,2,0,0,0,0|1,0,0]=3 26259 B18R2.32674 Cc1ccccc1CNCc2ccccc2Br 207a_100000689332_100000211143 [0,2,0,0,0,0|1,0,0]=3 26260 B18R2.32674 Cc1ccccc1CNCc2ccccc2Br 2230a_100000689332_100000211839 [0,2,0,0,0,0|1,0,0]=3 26261 B18R2.32674 Cc1ccccc1CNCc2ccccc2Br 270004a_100000174972_100000211189 [0,2,0,0,0,0|1,0,0]=3 26262 B18R2.32674 Cc1ccccc1CNCc2ccccc2Br 270004a_100000689332_100000211143 [0,2,0,0,0,0|1,0,0]=3 26263 B18R2.32674 Cc1ccccc1CNCc2ccccc2Br 34a_100000174972_100000184730 [0,2,0,0,0,0|1,0,0]=3 26264 B18R2.32674 Cc1ccccc1CNCc2ccccc2Br 34a_100000689332_100000211839 [0,2,0,0,0,0|1,0,0]=3 26265 B18R2.32674 Cc1ccccc1CNCc2ccccc2C 207a_100000174972_100000211143 [0,2,0,0,0,0|1,0,0]=3 26266 B18R2.32674 Cc1ccccc1CNCc2ccccc2C 270004a_100000174972_100000211143 [0,2,0,0,0,0|1,0,0]=3 26267 B18R2.32674 Cc1ccccc1CNCc2ccccc2C 34a_100000174972_100000211839 [0,2,0,0,0,0|1,0,0]=3 26268 B18R2.32674 Cc1ccccc1CNCc2ccccc2Cl 207a_100000174879_100000211143 [0,2,0,0,0,0|1,0,0]=3 26269 B18R2.32674 Cc1ccccc1CNCc2ccccc2Cl 207a_100000174972_100000210073 [0,2,0,0,0,0|1,0,0]=3 26270 B18R2.32674 Cc1ccccc1CNCc2ccccc2Cl 2230a_100000174879_100000211839 [0,2,0,0,0,0|1,0,0]=3 26271 B18R2.32674 Cc1ccccc1CNCc2ccccc2Cl 270004a_100000174879_100000211143 [0,2,0,0,0,0|1,0,0]=3 26272 B18R2.32674 Cc1ccccc1CNCc2ccccc2Cl 270004a_100000174972_100000210073 [0,2,0,0,0,0|1,0,0]=3 26273 B18R2.32674 Cc1ccccc1CNCc2ccccc2Cl 34a_100000174879_100000211839 [0,2,0,0,0,0|1,0,0]=3 26274 B18R2.32674 Cc1ccccc1CNCc2ccccc2Cl 34a_100000174972_100000187162 [0,2,0,0,0,0|1,0,0]=3 26275 B18R2.32674 Cc1ccccc1CNCc2ccccc2F 207a_100000174869_100000211143 [0,2,0,0,0,0|1,0,0]=3 26276 B18R2.32674 Cc1ccccc1CNCc2ccccc2F 207a_100000174972_100000210811 [0,2,0,0,0,0|1,0,0]=3 26277 B18R2.32674 Cc1ccccc1CNCc2ccccc2F 270004a_100000174869_100000211143 [0,2,0,0,0,0|1,0,0]=3 26278 B18R2.32674 Cc1ccccc1CNCc2ccccc2F 270004a_100000174972_100000210811 [0,2,0,0,0,0|1,0,0]=3 26279 B18R2.32674 Cc1ccccc1CNCc2ccccc2F 34a_100000174869_100000211839 [0,2,0,0,0,0|1,0,0]=3 26280 B18R2.32674 Cc1ccccc1CNCc2ccccc2F 34a_100000174972_100000211605 [0,2,0,0,0,0|1,0,0]=3 26281 B18R2.32674 Cc1ccccc1CNCc2ccccc2I 207a_100000174972_100000010305 [0,2,0,0,0,0|1,0,0]=3 26282 B18R2.32674 Cc1ccccc1CNCc2ccccc2I 207a_100015347259_100000211143 [0,2,0,0,0,0|1,0,0]=3 26283 B18R2.32674 Cc1ccccc1CNCc2ccccc2I 270004a_100000174972_100000010305 [0,2,0,0,0,0|1,0,0]=3 26284 B18R2.32674 Cc1ccccc1CNCc2ccccc2I 270004a_100015347259_100000211143 [0,2,0,0,0,0|1,0,0]=3 26285 B18R2.32674 Cc1ccccc1CNCc2ccccc2I 34a_100000174972_100011215278 [0,2,0,0,0,0|1,0,0]=3 26286 B18R2.32674 Cc1ccccc1CNCc2ccccc2O 207a_100000185550_100000211143 [0,2,0,0,0,0|1,0,0]=3 26287 B18R2.32674 Cc1ccccc1CNCc2ccccc2O 270004a_100000185550_100000211143 [0,2,0,0,0,0|1,0,0]=3 26288 B18R2.32674 Cc1ccccc1CNCc2ccccc2O 34a_100000185550_100000211839 [0,2,0,0,0,0|1,0,0]=3 26289 B18R2.32674 Cc1ccccc1CNCc2cccnc2Br 2230a_100009818023_100000211839 [0,2,0,0,0,0|2,0,0]=4 26290 B18R2.32674 Cc1ccccc1CNCc2cccnc2Br 270004a_100009818023_100000211143 [0,2,0,0,0,0|2,0,0]=4 26291 B18R2.32674 Cc1ccccc1CNCc2cccnc2Br 34a_100000174972_100010140945 [0,2,0,0,0,0|2,0,0]=4 26292 B18R2.32674 Cc1ccccc1CNCc2cccnc2Br 34a_100009818023_100000211839 [0,2,0,0,0,0|2,0,0]=4 26293 B18R2.32674 Cc1ccccc1CNCc2cccnc2C 207a_100000174972_100000751968 [0,2,0,0,0,0|2,0,0]=4 26294 B18R2.32674 Cc1ccccc1CNCc2cccnc2C 270004a_100000174972_100000751968 [0,2,0,0,0,0|2,0,0]=4 26295 B18R2.32674 Cc1ccccc1CNCc2cccnc2C 34a_100000174972_100000732876 [0,2,0,0,0,0|2,0,0]=4 26296 B18R2.32674 Cc1ccccc1CNCc2cccnc2Cl 207a_100015189234_100000211143 [0,2,0,0,0,0|2,0,0]=4 26297 B18R2.32674 Cc1ccccc1CNCc2cccnc2Cl 2230a_100015189234_100000211839 [0,2,0,0,0,0|2,0,0]=4 26298 B18R2.32674 Cc1ccccc1CNCc2cccnc2Cl 34a_100000174972_100000045678 [0,2,0,0,0,0|2,0,0]=4 26299 B18R2.32674 Cc1ccccc1CNCc2cccnc2Cl 34a_100015189234_100000211839 [0,2,0,0,0,0|2,0,0]=4 26300 B18R2.32674 Cc1ccccc1CNCc2cccnc2F 270004a_100000724633_100000211143 [0,2,0,0,0,0|2,0,0]=4 26301 B18R2.32674 Cc1ccccc1CNCc2cccnc2F 34a_100000174972_100000099810 [0,2,0,0,0,0|2,0,0]=4 26302 B18R2.32674 Cc1ccccc1CNCc2cccnc2F 34a_100000724633_100000211839 [0,2,0,0,0,0|2,0,0]=4 26303 B18R2.32674 Cc1ccccc1CNCc2cccnc2O 207a_100000174972_100011998315 [0,2,0,0,0,0|2,0,0]=4 26304 B18R2.32674 Cc1ccccc1CNCc2cccnc2O 270004a_100000174972_100011998315 [0,2,0,0,0,0|2,0,0]=4 26305 B18R2.32674 Cc1ccccc1CNCc2ccncc2Br 207a_100020640021_100000211143 [0,2,0,0,0,0|2,0,0]=4 26306 B18R2.32674 Cc1ccccc1CNCc2ccncc2Br 270004a_100000174972_100000755692 [0,2,0,0,0,0|2,0,0]=4 26307 B18R2.32674 Cc1ccccc1CNCc2ccncc2Br 270004a_100020640021_100000211143 [0,2,0,0,0,0|2,0,0]=4 26308 B18R2.32674 Cc1ccccc1CNCc2ccncc2C 207a_100000708811_100000211143 [0,2,0,0,0,0|2,0,0]=4 26309 B18R2.32674 Cc1ccccc1CNCc2ccncc2C 270004a_100000708811_100000211143 [0,2,0,0,0,0|2,0,0]=4 26310 B18R2.32674 Cc1ccccc1CNCc2ccncc2C 34a_100000174972_100020672809 [0,2,0,0,0,0|2,0,0]=4 26311 B18R2.32674 Cc1ccccc1CNCc2ccncc2Cl 207a_100000174972_100011934409 [0,2,0,0,0,0|2,0,0]=4 26312 B18R2.32674 Cc1ccccc1CNCc2ccncc2Cl 270004a_100000174972_100011934409 [0,2,0,0,0,0|2,0,0]=4 26313 B18R2.32674 Cc1ccccc1CNCc2ccncc2F 207a_100011935246_100000211143 [0,2,0,0,0,0|2,0,0]=4 26314 B18R2.32674 Cc1ccccc1CNCc2ccncc2F 270004a_100011935246_100000211143 [0,2,0,0,0,0|2,0,0]=4 26315 B18R2.32674 Cc1ccccc1CNCc2ccncc2F 34a_100011935246_100000211839 [0,2,0,0,0,0|2,0,0]=4 26316 B18R2.32674 Cc1ccccc1CNCc2cnccc2Br 270004a_100000174972_100009816821 [0,2,0,0,0,0|2,0,0]=4 26317 B18R2.32674 Cc1ccccc1CNCc2cnccc2C 207a_100000174972_100000685662 [0,2,0,0,0,0|2,0,0]=4 26318 B18R2.32674 Cc1ccccc1CNCc2cnccc2C 207a_100011997553_100000211143 [0,2,0,0,0,0|2,0,0]=4 26319 B18R2.32674 Cc1ccccc1CNCc2cnccc2C 270004a_100000174972_100000685662 [0,2,0,0,0,0|2,0,0]=4 26320 B18R2.32674 Cc1ccccc1CNCc2cnccc2C 270004a_100011997553_100000211143 [0,2,0,0,0,0|2,0,0]=4 26321 B18R2.32674 Cc1ccccc1CNCc2cnccc2C 34a_100000174972_100000690890 [0,2,0,0,0,0|2,0,0]=4 26322 B18R2.32674 Cc1ccccc1CNCc2cnccc2Cl 270004a_100000174972_100000050567 [0,2,0,0,0,0|2,0,0]=4 26323 B18R2.32674 Cc1ccccc1CNCc2ncccc2Br 207a_100000174972_100011934733 [0,2,0,0,0,0|2,0,0]=4 26324 B18R2.32674 Cc1ccccc1CNCc2ncccc2Br 270004a_100000174972_100011934733 [0,2,0,0,0,0|2,0,0]=4 26325 B18R2.32674 Cc1ccccc1CNCc2ncccc2Br 270004a_100020591323_100000211143 [0,2,0,0,0,0|2,0,0]=4 26326 B18R2.32674 Cc1ccccc1CNCc2ncccc2Br 34a_100000174972_100025702911 [0,2,0,0,0,0|2,0,0]=4 26327 B18R2.32674 Cc1ccccc1CNCc2ncccc2C 207a_100000174972_100000698913 [0,2,0,0,0,0|2,0,0]=4 26328 B18R2.32674 Cc1ccccc1CNCc2ncccc2C 270004a_100000174972_100000698913 [0,2,0,0,0,0|2,0,0]=4 26329 B18R2.32674 Cc1ccccc1CNCc2ncccc2C 34a_100000174972_100000696600 [0,2,0,0,0,0|2,0,0]=4 26330 B18R2.32674 Cc1ccccc1CNCc2ncccc2C 34a_100011223789_100000211839 [0,2,0,0,0,0|2,0,0]=4 26331 B18R2.32674 Cc1ccccc1CNCc2ncccc2Cl 207a_100000174972_100012001307 [0,2,0,0,0,0|2,0,0]=4 26332 B18R2.32674 Cc1ccccc1CNCc2ncccc2Cl 2230a_100015189233_100000211839 [0,2,0,0,0,0|2,0,0]=4 26333 B18R2.32674 Cc1ccccc1CNCc2ncccc2Cl 270004a_100000174972_100012001307 [0,2,0,0,0,0|2,0,0]=4 26334 B18R2.32674 Cc1ccccc1CNCc2ncccc2Cl 270004a_100015189233_100000211143 [0,2,0,0,0,0|2,0,0]=4 26335 B18R2.32674 Cc1ccccc1CNCc2ncccc2F 207a_100000174972_100011934734 [0,2,0,0,0,0|2,0,0]=4 26336 B18R2.32674 Cc1ccccc1CNCc2ncccc2F 270004a_100000174972_100011934734 [0,2,0,0,0,0|2,0,0]=4 26337 B18R2.32674 Cc1ccccc1CNCc2ncccc2F 270004a_100000690088_100000211143 [0,2,0,0,0,0|2,0,0]=4 26338 B18R2.32674 Cc1ccccc1CNCc2ncccc2F 34a_100000174972_100000104219 [0,2,0,0,0,0|2,0,0]=4 26339 B18R2.32674 Cc1ccccc1CNCc2ncccc2F 34a_100000690088_100000211839 [0,2,0,0,0,0|2,0,0]=4 26340 B18R2.32674 Cc1ccccc1CNCc2ncccc2O 34a_100000174972_200020655725 [0,2,0,0,0,0|2,0,0]=4 26341 B18R2.32674 Cc1ccccc1COCc2ccccc2Br 34a_100000698903_100000184730 [0,2,0,0,0,0|0,0,0]=2 26342 B18R2.32674 Cc1ccccc1COCc2ccccc2Br 34a_100000756307_100000211839 [0,2,0,0,0,0|0,0,0]=2 26343 B18R2.32674 Cc1ccccc1COCc2ccccc2Br 7a_100000698903_100000184730 [0,2,0,0,0,0|0,0,0]=2 26344 B18R2.32674 Cc1ccccc1COCc2ccccc2Br 7a_100000756307_100000211839 [0,2,0,0,0,0|0,0,0]=2 26345 B18R2.32674 Cc1ccccc1COCc2ccccc2C 34a_100000698903_100000211839 [0,2,0,0,0,0|0,0,0]=2 26346 B18R2.32674 Cc1ccccc1COCc2ccccc2C 7a_100000698903_100000211839 [0,2,0,0,0,0|0,0,0]=2 26347 B18R2.32674 Cc1ccccc1COCc2ccccc2Cl 34a_100000210847_100000211839 [0,2,0,0,0,0|0,0,0]=2 26348 B18R2.32674 Cc1ccccc1COCc2ccccc2Cl 34a_100000698903_100000187162 [0,2,0,0,0,0|0,0,0]=2 26349 B18R2.32674 Cc1ccccc1COCc2ccccc2Cl 7a_100000210847_100000211839 [0,2,0,0,0,0|0,0,0]=2 26350 B18R2.32674 Cc1ccccc1COCc2ccccc2Cl 7a_100000698903_100000187162 [0,2,0,0,0,0|0,0,0]=2 26351 B18R2.32674 Cc1ccccc1COCc2ccccc2F 34a_100000211962_100000211839 [0,2,0,0,0,0|0,0,0]=2 26352 B18R2.32674 Cc1ccccc1COCc2ccccc2F 34a_100000698903_100000211605 [0,2,0,0,0,0|0,0,0]=2 26353 B18R2.32674 Cc1ccccc1COCc2ccccc2F 7a_100000211962_100000211839 [0,2,0,0,0,0|0,0,0]=2 26354 B18R2.32674 Cc1ccccc1COCc2ccccc2F 7a_100000698903_100000211605 [0,2,0,0,0,0|0,0,0]=2 26355 B18R2.32674 Cc1ccccc1COCc2ccccc2I 34a_100000187465_100000211839 [0,2,0,0,0,0|0,0,0]=2 26356 B18R2.32674 Cc1ccccc1COCc2ccccc2I 34a_100000698903_100011215278 [0,2,0,0,0,0|0,0,0]=2 26357 B18R2.32674 Cc1ccccc1COCc2ccccc2I 7a_100000187465_100000211839 [0,2,0,0,0,0|0,0,0]=2 26358 B18R2.32674 Cc1ccccc1COCc2ccccc2I 7a_100000698903_100011215278 [0,2,0,0,0,0|0,0,0]=2 26359 B18R2.32674 Cc1ccccc1COCc2ccccc2N 34a_100000212039_100000211839 [0,2,0,0,0,0|0,0,0]=2 26360 B18R2.32674 Cc1ccccc1COCc2cccnc2Br 34a_100000698903_100010140945 [0,2,0,0,0,0|1,0,0]=3 26361 B18R2.32674 Cc1ccccc1COCc2cccnc2Br 34a_100000719692_100000211839 [0,2,0,0,0,0|1,0,0]=3 26362 B18R2.32674 Cc1ccccc1COCc2cccnc2Br 7a_100000698903_100010140945 [0,2,0,0,0,0|1,0,0]=3 26363 B18R2.32674 Cc1ccccc1COCc2cccnc2Br 7a_100000719692_100000211839 [0,2,0,0,0,0|1,0,0]=3 26364 B18R2.32674 Cc1ccccc1COCc2cccnc2C 34a_100000698903_100000732876 [0,2,0,0,0,0|1,0,0]=3 26365 B18R2.32674 Cc1ccccc1COCc2cccnc2C 34a_100000729262_100000211839 [0,2,0,0,0,0|1,0,0]=3 26366 B18R2.32674 Cc1ccccc1COCc2cccnc2C 7a_100000698903_100000732876 [0,2,0,0,0,0|1,0,0]=3 26367 B18R2.32674 Cc1ccccc1COCc2cccnc2C 7a_100000729262_100000211839 [0,2,0,0,0,0|1,0,0]=3 26368 B18R2.32674 Cc1ccccc1COCc2cccnc2Cl 34a_100000698903_100000045678 [0,2,0,0,0,0|1,0,0]=3 26369 B18R2.32674 Cc1ccccc1COCc2cccnc2Cl 34a_100000748726_100000211839 [0,2,0,0,0,0|1,0,0]=3 26370 B18R2.32674 Cc1ccccc1COCc2cccnc2Cl 7a_100000698903_100000045678 [0,2,0,0,0,0|1,0,0]=3 26371 B18R2.32674 Cc1ccccc1COCc2cccnc2Cl 7a_100000748726_100000211839 [0,2,0,0,0,0|1,0,0]=3 26372 B18R2.32674 Cc1ccccc1COCc2cccnc2F 34a_100000079888_100000211839 [0,2,0,0,0,0|1,0,0]=3 26373 B18R2.32674 Cc1ccccc1COCc2cccnc2F 34a_100000698903_100000099810 [0,2,0,0,0,0|1,0,0]=3 26374 B18R2.32674 Cc1ccccc1COCc2cccnc2F 7a_100000079888_100000211839 [0,2,0,0,0,0|1,0,0]=3 26375 B18R2.32674 Cc1ccccc1COCc2cccnc2F 7a_100000698903_100000099810 [0,2,0,0,0,0|1,0,0]=3 26376 B18R2.32674 Cc1ccccc1COCc2ccncc2C 34a_100000698903_100020672809 [0,2,0,0,0,0|1,0,0]=3 26377 B18R2.32674 Cc1ccccc1COCc2ccncc2C 34a_100011997032_100000211839 [0,2,0,0,0,0|1,0,0]=3 26378 B18R2.32674 Cc1ccccc1COCc2ccncc2C 7a_100000698903_100020672808 [0,2,0,0,0,0|1,0,0]=3 26379 B18R2.32674 Cc1ccccc1COCc2ccncc2Cl 7a_100000698903_100000763264 [0,2,0,0,0,0|1,0,0]=3 26380 B18R2.32674 Cc1ccccc1COCc2ccncc2F 34a_100012172863_100000211839 [0,2,0,0,0,0|1,0,0]=3 26381 B18R2.32674 Cc1ccccc1COCc2cnccc2C 34a_100000698903_100000690890 [0,2,0,0,0,0|1,0,0]=3 26382 B18R2.32674 Cc1ccccc1COCc2cnccc2C 34a_100011996381_100000211839 [0,2,0,0,0,0|1,0,0]=3 26383 B18R2.32674 Cc1ccccc1COCc2cnccc2C 7a_100000698903_100000690890 [0,2,0,0,0,0|1,0,0]=3 26384 B18R2.32674 Cc1ccccc1COCc2cnccc2Cl 34a_100000117392_100000211839 [0,2,0,0,0,0|1,0,0]=3 26385 B18R2.32674 Cc1ccccc1COCc2ncccc2Br 34a_100000698903_100025702911 [0,2,0,0,0,0|1,0,0]=3 26386 B18R2.32674 Cc1ccccc1COCc2ncccc2Br 34a_100011996772_100000211839 [0,2,0,0,0,0|1,0,0]=3 26387 B18R2.32674 Cc1ccccc1COCc2ncccc2Br 7a_100000698903_100025702911 [0,2,0,0,0,0|1,0,0]=3 26388 B18R2.32674 Cc1ccccc1COCc2ncccc2C 34a_100000698903_100000696600 [0,2,0,0,0,0|1,0,0]=3 26389 B18R2.32674 Cc1ccccc1COCc2ncccc2C 34a_100000698912_100000211839 [0,2,0,0,0,0|1,0,0]=3 26390 B18R2.32674 Cc1ccccc1COCc2ncccc2C 7a_100000698903_100000696600 [0,2,0,0,0,0|1,0,0]=3 26391 B18R2.32674 Cc1ccccc1COCc2ncccc2Cl 34a_100012002383_100000211839 [0,2,0,0,0,0|1,0,0]=3 26392 B18R2.32674 Cc1ccccc1COCc2ncccc2Cl 7a_100000698903_100000099807 [0,2,0,0,0,0|1,0,0]=3 26393 B18R2.32674 Cc1ccccc1COCc2ncccc2F 34a_100000698903_100000104219 [0,2,0,0,0,0|1,0,0]=3 26394 B18R2.32674 Cc1ccccc1COCc2ncccc2F 34a_100011934865_100000211839 [0,2,0,0,0,0|1,0,0]=3 26395 B18R2.32674 Cc1ccccc1COCc2ncccc2F 7a_100000698903_100000104219 [0,2,0,0,0,0|1,0,0]=3 26396 B18R2.32674 Cc1ccccc1COCc2ncccc2N 34a_114873767017_100000211839 [0,2,0,0,0,0|1,0,0]=3 26397 B18R2.32674 Cc1ccccc1COCc2ncccc2O 34a_100000698903_200020655725 [0,2,0,0,0,0|1,0,0]=3 26398 B18R2.32674 Cc1ccccc1COCc2ncccc2O 7a_100000698903_200020655725 [0,2,0,0,0,0|1,0,0]=3 26399 B18R2.32674 Cc1ccccc1COCc2nccnc2Cl 34a_100000057004_100000211839 [0,2,0,0,0,0|2,0,0]=4 26400 B18R2.32674 Cc1ccccc1CSCc2ccccc2Br 62a_100000184730_100000211839 [0,2,0,0,0,0|0,1,0]=3 26401 B18R2.32674 Cc1ccccc1CSCc2ccccc2Br 62a_100000211839_100000184730 [0,2,0,0,0,0|0,1,0]=3 26402 B18R2.32674 Cc1ccccc1CSCc2ccccc2C 62a_100000211839_100000211839 [0,2,0,0,0,0|0,1,0]=3 26403 B18R2.32674 Cc1ccccc1CSCc2ccccc2Cl 62a_100000187162_100000211839 [0,2,0,0,0,0|0,1,0]=3 26404 B18R2.32674 Cc1ccccc1CSCc2ccccc2Cl 62a_100000211839_100000187162 [0,2,0,0,0,0|0,1,0]=3 26405 B18R2.32674 Cc1ccccc1CSCc2ccccc2F 62a_100000211605_100000211839 [0,2,0,0,0,0|0,1,0]=3 26406 B18R2.32674 Cc1ccccc1CSCc2ccccc2F 62a_100000211839_100000211605 [0,2,0,0,0,0|0,1,0]=3 26407 B18R2.32674 Cc1ccccc1CSCc2ccccc2I 62a_100000211839_100011216222 [0,2,0,0,0,0|0,1,0]=3 26408 B18R2.32674 Cc1ccccc1CSCc2ccccc2I 62a_100011216222_100000211839 [0,2,0,0,0,0|0,1,0]=3 26409 B18R2.32674 Cc1ccccc1CSCc2cccnc2Br 62a_100000211839_100010140945 [0,2,0,0,0,0|1,1,0]=4 26410 B18R2.32674 Cc1ccccc1CSCc2cccnc2Br 62a_100010140945_100000211839 [0,2,0,0,0,0|1,1,0]=4 26411 B18R2.32674 Cc1ccccc1CSCc2cccnc2C 62a_100000211839_100000732876 [0,2,0,0,0,0|1,1,0]=4 26412 B18R2.32674 Cc1ccccc1CSCc2cccnc2C 62a_100000732876_100000211839 [0,2,0,0,0,0|1,1,0]=4 26413 B18R2.32674 Cc1ccccc1CSCc2cccnc2Cl 62a_100000045678_100000211839 [0,2,0,0,0,0|1,1,0]=4 26414 B18R2.32674 Cc1ccccc1CSCc2cccnc2Cl 62a_100000211839_100000045678 [0,2,0,0,0,0|1,1,0]=4 26415 B18R2.32674 Cc1ccccc1CSCc2cccnc2F 62a_100000099810_100000211839 [0,2,0,0,0,0|1,1,0]=4 26416 B18R2.32674 Cc1ccccc1CSCc2cccnc2F 62a_100000211839_100000099810 [0,2,0,0,0,0|1,1,0]=4 26417 B18R2.32674 Cc1ccccc1CSCc2ccncc2C 62a_100000211839_100020672808 [0,2,0,0,0,0|1,1,0]=4 26418 B18R2.32674 Cc1ccccc1CSCc2ccncc2C 62a_100020672808_100000211839 [0,2,0,0,0,0|1,1,0]=4 26419 B18R2.32674 Cc1ccccc1CSCc2ccncc2Cl 62a_100000211839_100000763264 [0,2,0,0,0,0|1,1,0]=4 26420 B18R2.32674 Cc1ccccc1CSCc2ccncc2Cl 62a_100000763264_100000211839 [0,2,0,0,0,0|1,1,0]=4 26421 B18R2.32674 Cc1ccccc1CSCc2cnccc2C 62a_100000211839_100000690890 [0,2,0,0,0,0|1,1,0]=4 26422 B18R2.32674 Cc1ccccc1CSCc2cnccc2C 62a_100000690890_100000211839 [0,2,0,0,0,0|1,1,0]=4 26423 B18R2.32674 Cc1ccccc1CSCc2ncccc2Br 62a_100000211839_100025702911 [0,2,0,0,0,0|1,1,0]=4 26424 B18R2.32674 Cc1ccccc1CSCc2ncccc2Br 62a_100025702911_100000211839 [0,2,0,0,0,0|1,1,0]=4 26425 B18R2.32674 Cc1ccccc1CSCc2ncccc2C 62a_100000211839_100000696600 [0,2,0,0,0,0|1,1,0]=4 26426 B18R2.32674 Cc1ccccc1CSCc2ncccc2C 62a_100000696600_100000211839 [0,2,0,0,0,0|1,1,0]=4 26427 B18R2.32674 Cc1ccccc1CSCc2ncccc2Cl 62a_100000099807_100000211839 [0,2,0,0,0,0|1,1,0]=4 26428 B18R2.32674 Cc1ccccc1CSCc2ncccc2Cl 62a_100000211839_100000099807 [0,2,0,0,0,0|1,1,0]=4 26429 B18R2.32674 Cc1ccccc1CSCc2ncccc2F 62a_100000104219_100000211839 [0,2,0,0,0,0|1,1,0]=4 26430 B18R2.32674 Cc1ccccc1CSCc2ncccc2F 62a_100000211839_100000104219 [0,2,0,0,0,0|1,1,0]=4 26431 B18R2.32674 Cc1ccccc1CSCc2ncccc2O 62a_100000211839_200020655725 [0,2,0,0,0,0|1,1,0]=4 26432 B18R2.32674 Cc1ccccc1CSCc2ncccc2O 62a_200020655725_100000211839 [0,2,0,0,0,0|1,1,0]=4 26433 B18R2.32674 Cc1ccccc1NCCc2ccccc2Br 34a_100015192222_100012161201 [0,2,0,0,0,0|2,0,0]=4 26434 B18R2.32674 Cc1ccccc1NCCc2ccccc2Cl 34a_100015192222_100011713703 [0,2,0,0,0,0|2,0,0]=4 26435 B18R2.32674 Cc1ccccc1NCCc2ccccc2F 34a_100015192222_100000720011 [0,2,0,0,0,0|2,0,0]=4 26436 B18R2.32674 Cc1ccccc1NCCc2ccccc2O 34a_100015192222_100000722297 [0,2,0,0,0,0|2,0,0]=4 26437 B18R2.32674 Cc1ccccc1OCCc2ccccc2Br 34a_100000210338_100012161201 [0,2,0,0,0,0|2,0,0]=4 26438 B18R2.32674 Cc1ccccc1OCCc2ccccc2Br 7a_100000210338_100012161201 [0,2,0,0,0,0|2,0,0]=4 26439 B18R2.32674 Cc1ccccc1OCCc2ccccc2Cl 34a_100000210338_100011713703 [0,2,0,0,0,0|2,0,0]=4 26440 B18R2.32674 Cc1ccccc1OCCc2ccccc2Cl 7a_100000210338_100011713703 [0,2,0,0,0,0|2,0,0]=4 26441 B18R2.32674 Cc1ccccc1OCCc2ccccc2F 34a_100000210338_100000720011 [0,2,0,0,0,0|2,0,0]=4 26442 B18R2.32674 Cc1ccccc1OCCc2ccccc2F 7a_100000210338_100000720011 [0,2,0,0,0,0|2,0,0]=4 26443 B18R2.32674 Cc1ccccc1OCCc2ccccc2O 34a_100000210338_100000722297 [0,2,0,0,0,0|2,0,0]=4 26444 B18R2.32674 Cc1ccccc1OCCc2ccccc2O 7a_100000210338_100000722297 [0,2,0,0,0,0|2,0,0]=4 26445 B18R2.32674 Cc1ccccc1SCCc2ccccc2Br 62a_100000210755_100012161201 [0,2,0,0,0,0|2,0,0]=4 26446 B18R2.32674 Cc1ccccc1SCCc2ccccc2Br 62a_100012161201_100000210755 [0,2,0,0,0,0|2,0,0]=4 26447 B18R2.32674 Cc1ccccc1SCCc2ccccc2Cl 62a_100000210755_100011713703 [0,2,0,0,0,0|2,0,0]=4 26448 B18R2.32674 Cc1ccccc1SCCc2ccccc2Cl 62a_100011713703_100000210755 [0,2,0,0,0,0|2,0,0]=4 26449 B18R2.32674 Cc1ccccc1SCCc2ccccc2F 62a_100000210755_100011713696 [0,2,0,0,0,0|2,0,0]=4 26450 B18R2.32674 Cc1ccccc1SCCc2ccccc2F 62a_100011713696_100000210755 [0,2,0,0,0,0|2,0,0]=4 26451 B18R2.32674 Cc1ccccc1SCCc2ccccc2O 62a_100000210755_100000722297 [0,2,0,0,0,0|2,0,0]=4 26452 B18R2.32674 Cc1ccccc1SCCc2ccccc2O 62a_100000722297_100000210755 [0,2,0,0,0,0|2,0,0]=4 26453 B18R2.32674 Cc1cccnc1CNCc2ccccc2Br 207a_100000689332_100000698913 [0,2,0,0,0,0|2,0,0]=4 26454 B18R2.32674 Cc1cccnc1CNCc2ccccc2Br 2230a_100000689332_100000696600 [0,2,0,0,0,0|2,0,0]=4 26455 B18R2.32674 Cc1cccnc1CNCc2ccccc2Br 270004a_100000689332_100000698913 [0,2,0,0,0,0|2,0,0]=4 26456 B18R2.32674 Cc1cccnc1CNCc2ccccc2Br 34a_100000689332_100000696600 [0,2,0,0,0,0|2,0,0]=4 26457 B18R2.32674 Cc1cccnc1CNCc2ccccc2Br 34a_100011223789_100000184730 [0,2,0,0,0,0|2,0,0]=4 26458 B18R2.32674 Cc1cccnc1CNCc2ccccc2Cl 207a_100000174879_100000698913 [0,2,0,0,0,0|2,0,0]=4 26459 B18R2.32674 Cc1cccnc1CNCc2ccccc2Cl 2230a_100000174879_100000696600 [0,2,0,0,0,0|2,0,0]=4 26460 B18R2.32674 Cc1cccnc1CNCc2ccccc2Cl 270004a_100000174879_100000698913 [0,2,0,0,0,0|2,0,0]=4 26461 B18R2.32674 Cc1cccnc1CNCc2ccccc2Cl 34a_100000174879_100000696600 [0,2,0,0,0,0|2,0,0]=4 26462 B18R2.32674 Cc1cccnc1CNCc2ccccc2Cl 34a_100011223789_100000187162 [0,2,0,0,0,0|2,0,0]=4 26463 B18R2.32674 Cc1cccnc1CNCc2ccccc2F 207a_100000174869_100000698913 [0,2,0,0,0,0|2,0,0]=4 26464 B18R2.32674 Cc1cccnc1CNCc2ccccc2F 270004a_100000174869_100000698913 [0,2,0,0,0,0|2,0,0]=4 26465 B18R2.32674 Cc1cccnc1CNCc2ccccc2F 34a_100000174869_100000696600 [0,2,0,0,0,0|2,0,0]=4 26466 B18R2.32674 Cc1cccnc1CNCc2ccccc2F 34a_100011223789_100000211605 [0,2,0,0,0,0|2,0,0]=4 26467 B18R2.32674 Cc1cccnc1CNCc2ccccc2I 207a_100015347259_100000698913 [0,2,0,0,0,0|2,0,0]=4 26468 B18R2.32674 Cc1cccnc1CNCc2ccccc2I 270004a_100015347259_100000698913 [0,2,0,0,0,0|2,0,0]=4 26469 B18R2.32674 Cc1cccnc1CNCc2ccccc2I 34a_100011223789_100011215278 [0,2,0,0,0,0|2,0,0]=4 26470 B18R2.32674 Cc1cccnc1CNCc2ccccc2O 207a_100000185550_100000698913 [0,2,0,0,0,0|2,0,0]=4 26471 B18R2.32674 Cc1cccnc1CNCc2ccccc2O 270004a_100000185550_100000698913 [0,2,0,0,0,0|2,0,0]=4 26472 B18R2.32674 Cc1cccnc1CNCc2ccccc2O 34a_100000185550_100000696600 [0,2,0,0,0,0|2,0,0]=4 26473 B18R2.32674 Cc1cccnc1COCc2ccccc2Br 34a_100000698912_100000184730 [0,2,0,0,0,0|1,0,0]=3 26474 B18R2.32674 Cc1cccnc1COCc2ccccc2Br 34a_100000756307_100000696600 [0,2,0,0,0,0|1,0,0]=3 26475 B18R2.32674 Cc1cccnc1COCc2ccccc2Br 7a_100000756307_100000696600 [0,2,0,0,0,0|1,0,0]=3 26476 B18R2.32674 Cc1cccnc1COCc2ccccc2Cl 34a_100000210847_100000696600 [0,2,0,0,0,0|1,0,0]=3 26477 B18R2.32674 Cc1cccnc1COCc2ccccc2Cl 34a_100000698912_100000187162 [0,2,0,0,0,0|1,0,0]=3 26478 B18R2.32674 Cc1cccnc1COCc2ccccc2Cl 7a_100000210847_100000696600 [0,2,0,0,0,0|1,0,0]=3 26479 B18R2.32674 Cc1cccnc1COCc2ccccc2F 34a_100000211962_100000696600 [0,2,0,0,0,0|1,0,0]=3 26480 B18R2.32674 Cc1cccnc1COCc2ccccc2F 34a_100000698912_100000211605 [0,2,0,0,0,0|1,0,0]=3 26481 B18R2.32674 Cc1cccnc1COCc2ccccc2F 7a_100000211962_100000696600 [0,2,0,0,0,0|1,0,0]=3 26482 B18R2.32674 Cc1cccnc1COCc2ccccc2I 34a_100000187465_100000696600 [0,2,0,0,0,0|1,0,0]=3 26483 B18R2.32674 Cc1cccnc1COCc2ccccc2I 34a_100000698912_100011215278 [0,2,0,0,0,0|1,0,0]=3 26484 B18R2.32674 Cc1cccnc1COCc2ccccc2I 7a_100000187465_100000696600 [0,2,0,0,0,0|1,0,0]=3 26485 B18R2.32674 Cc1cccnc1COCc2ccccc2N 34a_100000212039_100000696600 [0,2,0,0,0,0|1,0,0]=3 26486 B18R2.32674 Cc1cccnc1COCc2cccnc2Br 34a_100000698912_100010140945 [0,2,0,0,0,0|2,0,0]=4 26487 B18R2.32674 Cc1cccnc1COCc2cccnc2Br 34a_100000719692_100000696600 [0,2,0,0,0,0|2,0,0]=4 26488 B18R2.32674 Cc1cccnc1COCc2cccnc2Br 7a_100000719692_100000696600 [0,2,0,0,0,0|2,0,0]=4 26489 B18R2.32674 Cc1cccnc1COCc2cccnc2C 34a_100000698912_100000732876 [0,2,0,0,0,0|2,0,0]=4 26490 B18R2.32674 Cc1cccnc1COCc2cccnc2C 34a_100000729262_100000696600 [0,2,0,0,0,0|2,0,0]=4 26491 B18R2.32674 Cc1cccnc1COCc2cccnc2C 7a_100000729262_100000696600 [0,2,0,0,0,0|2,0,0]=4 26492 B18R2.32674 Cc1cccnc1COCc2cccnc2Cl 34a_100000698912_100000045678 [0,2,0,0,0,0|2,0,0]=4 26493 B18R2.32674 Cc1cccnc1COCc2cccnc2Cl 34a_100000748726_100000696600 [0,2,0,0,0,0|2,0,0]=4 26494 B18R2.32674 Cc1cccnc1COCc2cccnc2Cl 7a_100000748726_100000696600 [0,2,0,0,0,0|2,0,0]=4 26495 B18R2.32674 Cc1cccnc1COCc2cccnc2F 34a_100000079888_100000696600 [0,2,0,0,0,0|2,0,0]=4 26496 B18R2.32674 Cc1cccnc1COCc2cccnc2F 34a_100000698912_100000099810 [0,2,0,0,0,0|2,0,0]=4 26497 B18R2.32674 Cc1cccnc1COCc2cccnc2F 7a_100000079888_100000696600 [0,2,0,0,0,0|2,0,0]=4 26498 B18R2.32674 Cc1cccnc1COCc2ccncc2F 34a_100012172863_100000696600 [0,2,0,0,0,0|2,0,0]=4 26499 B18R2.32674 Cc1cccnc1COCc2cnccc2Cl 34a_100000117392_100000696600 [0,2,0,0,0,0|2,0,0]=4 26500 B18R2.32674 Cc1cccnc1COCc2ncccc2Br 34a_100000698912_100025702911 [0,2,0,0,0,0|2,0,0]=4 26501 B18R2.32674 Cc1cccnc1COCc2ncccc2Br 34a_100011996772_100000696600 [0,2,0,0,0,0|2,0,0]=4 26502 B18R2.32674 Cc1cccnc1COCc2ncccc2C 34a_100000698912_100000696600 [0,2,0,0,0,0|2,0,0]=4 26503 B18R2.32674 Cc1cccnc1COCc2ncccc2Cl 34a_100012002383_100000696600 [0,2,0,0,0,0|2,0,0]=4 26504 B18R2.32674 Cc1cccnc1COCc2ncccc2F 34a_100000698912_100000104219 [0,2,0,0,0,0|2,0,0]=4 26505 B18R2.32674 Cc1cccnc1COCc2ncccc2F 34a_100011934865_100000696600 [0,2,0,0,0,0|2,0,0]=4 26506 B18R2.32674 Cc1cccnc1COCc2ncccc2N 34a_114873767017_100000696600 [0,2,0,0,0,0|2,0,0]=4 26507 B18R2.32674 Cc1cccnc1COCc2ncccc2O 34a_100000698912_200020655725 [0,2,0,0,0,0|2,0,0]=4 26508 B18R2.32674 Cc1cccnc1CSCc2ccccc2Br 62a_100000184730_100000696600 [0,2,0,0,0,0|1,1,0]=4 26509 B18R2.32674 Cc1cccnc1CSCc2ccccc2Br 62a_100000696600_100000184730 [0,2,0,0,0,0|1,1,0]=4 26510 B18R2.32674 Cc1cccnc1CSCc2ccccc2Cl 62a_100000187162_100000696600 [0,2,0,0,0,0|1,1,0]=4 26511 B18R2.32674 Cc1cccnc1CSCc2ccccc2Cl 62a_100000696600_100000187162 [0,2,0,0,0,0|1,1,0]=4 26512 B18R2.32674 Cc1cccnc1CSCc2ccccc2F 62a_100000211605_100000696600 [0,2,0,0,0,0|1,1,0]=4 26513 B18R2.32674 Cc1cccnc1CSCc2ccccc2F 62a_100000696600_100000211605 [0,2,0,0,0,0|1,1,0]=4 26514 B18R2.32674 Cc1cccnc1CSCc2ccccc2I 62a_100000696600_100011216222 [0,2,0,0,0,0|1,1,0]=4 26515 B18R2.32674 Cc1cccnc1CSCc2ccccc2I 62a_100011216222_100000696600 [0,2,0,0,0,0|1,1,0]=4 26516 B18R2.32674 Cc1ccncc1CNCc2ccccc2Br 207a_100000689332_100000685662 [0,2,0,0,0,0|2,0,0]=4 26517 B18R2.32674 Cc1ccncc1CNCc2ccccc2Br 207a_100011997553_100000211189 [0,2,0,0,0,0|2,0,0]=4 26518 B18R2.32674 Cc1ccncc1CNCc2ccccc2Br 2230a_100000689332_100000690890 [0,2,0,0,0,0|2,0,0]=4 26519 B18R2.32674 Cc1ccncc1CNCc2ccccc2Br 270004a_100000689332_100000685662 [0,2,0,0,0,0|2,0,0]=4 26520 B18R2.32674 Cc1ccncc1CNCc2ccccc2Br 270004a_100011997553_100000211189 [0,2,0,0,0,0|2,0,0]=4 26521 B18R2.32674 Cc1ccncc1CNCc2ccccc2Br 34a_100000689332_100000690890 [0,2,0,0,0,0|2,0,0]=4 26522 B18R2.32674 Cc1ccncc1CNCc2ccccc2Cl 207a_100000174879_100000685662 [0,2,0,0,0,0|2,0,0]=4 26523 B18R2.32674 Cc1ccncc1CNCc2ccccc2Cl 207a_100011997553_100000210073 [0,2,0,0,0,0|2,0,0]=4 26524 B18R2.32674 Cc1ccncc1CNCc2ccccc2Cl 2230a_100000174879_100000690890 [0,2,0,0,0,0|2,0,0]=4 26525 B18R2.32674 Cc1ccncc1CNCc2ccccc2Cl 270004a_100000174879_100000685662 [0,2,0,0,0,0|2,0,0]=4 26526 B18R2.32674 Cc1ccncc1CNCc2ccccc2Cl 270004a_100011997553_100000210073 [0,2,0,0,0,0|2,0,0]=4 26527 B18R2.32674 Cc1ccncc1CNCc2ccccc2Cl 34a_100000174879_100000690890 [0,2,0,0,0,0|2,0,0]=4 26528 B18R2.32674 Cc1ccncc1CNCc2ccccc2F 207a_100000174869_100000685662 [0,2,0,0,0,0|2,0,0]=4 26529 B18R2.32674 Cc1ccncc1CNCc2ccccc2F 207a_100011997553_100000210811 [0,2,0,0,0,0|2,0,0]=4 26530 B18R2.32674 Cc1ccncc1CNCc2ccccc2F 270004a_100000174869_100000685662 [0,2,0,0,0,0|2,0,0]=4 26531 B18R2.32674 Cc1ccncc1CNCc2ccccc2F 270004a_100011997553_100000210811 [0,2,0,0,0,0|2,0,0]=4 26532 B18R2.32674 Cc1ccncc1CNCc2ccccc2F 34a_100000174869_100000690890 [0,2,0,0,0,0|2,0,0]=4 26533 B18R2.32674 Cc1ccncc1CNCc2ccccc2I 207a_100011997553_100000010305 [0,2,0,0,0,0|2,0,0]=4 26534 B18R2.32674 Cc1ccncc1CNCc2ccccc2I 207a_100015347259_100000685662 [0,2,0,0,0,0|2,0,0]=4 26535 B18R2.32674 Cc1ccncc1CNCc2ccccc2I 270004a_100011997553_100000010305 [0,2,0,0,0,0|2,0,0]=4 26536 B18R2.32674 Cc1ccncc1CNCc2ccccc2I 270004a_100015347259_100000685662 [0,2,0,0,0,0|2,0,0]=4 26537 B18R2.32674 Cc1ccncc1CNCc2ccccc2O 207a_100000185550_100000685662 [0,2,0,0,0,0|2,0,0]=4 26538 B18R2.32674 Cc1ccncc1CNCc2ccccc2O 270004a_100000185550_100000685662 [0,2,0,0,0,0|2,0,0]=4 26539 B18R2.32674 Cc1ccncc1CNCc2ccccc2O 34a_100000185550_100000690890 [0,2,0,0,0,0|2,0,0]=4 26540 B18R2.32674 Cc1ccncc1COCc2ccccc2Br 34a_100000756307_100000690890 [0,2,0,0,0,0|1,0,0]=3 26541 B18R2.32674 Cc1ccncc1COCc2ccccc2Br 34a_100011996381_100000184730 [0,2,0,0,0,0|1,0,0]=3 26542 B18R2.32674 Cc1ccncc1COCc2ccccc2Br 7a_100000756307_100000690890 [0,2,0,0,0,0|1,0,0]=3 26543 B18R2.32674 Cc1ccncc1COCc2ccccc2Cl 34a_100000210847_100000690890 [0,2,0,0,0,0|1,0,0]=3 26544 B18R2.32674 Cc1ccncc1COCc2ccccc2Cl 34a_100011996381_100000187162 [0,2,0,0,0,0|1,0,0]=3 26545 B18R2.32674 Cc1ccncc1COCc2ccccc2Cl 7a_100000210847_100000690890 [0,2,0,0,0,0|1,0,0]=3 26546 B18R2.32674 Cc1ccncc1COCc2ccccc2F 34a_100000211962_100000690890 [0,2,0,0,0,0|1,0,0]=3 26547 B18R2.32674 Cc1ccncc1COCc2ccccc2F 34a_100011996381_100000211605 [0,2,0,0,0,0|1,0,0]=3 26548 B18R2.32674 Cc1ccncc1COCc2ccccc2F 7a_100000211962_100000690890 [0,2,0,0,0,0|1,0,0]=3 26549 B18R2.32674 Cc1ccncc1COCc2ccccc2I 34a_100000187465_100000690890 [0,2,0,0,0,0|1,0,0]=3 26550 B18R2.32674 Cc1ccncc1COCc2ccccc2I 34a_100011996381_100011215278 [0,2,0,0,0,0|1,0,0]=3 26551 B18R2.32674 Cc1ccncc1COCc2ccccc2I 7a_100000187465_100000690890 [0,2,0,0,0,0|1,0,0]=3 26552 B18R2.32674 Cc1ccncc1COCc2ccccc2N 34a_100000212039_100000690890 [0,2,0,0,0,0|1,0,0]=3 26553 B18R2.32674 Cc1ccncc1COCc2cccnc2Br 34a_100000719692_100000690890 [0,2,0,0,0,0|2,0,0]=4 26554 B18R2.32674 Cc1ccncc1COCc2cccnc2Br 34a_100011996381_100010140945 [0,2,0,0,0,0|2,0,0]=4 26555 B18R2.32674 Cc1ccncc1COCc2cccnc2Br 7a_100000719692_100000690890 [0,2,0,0,0,0|2,0,0]=4 26556 B18R2.32674 Cc1ccncc1COCc2cccnc2C 34a_100000729262_100000690890 [0,2,0,0,0,0|2,0,0]=4 26557 B18R2.32674 Cc1ccncc1COCc2cccnc2C 34a_100011996381_100000732876 [0,2,0,0,0,0|2,0,0]=4 26558 B18R2.32674 Cc1ccncc1COCc2cccnc2C 7a_100000729262_100000690890 [0,2,0,0,0,0|2,0,0]=4 26559 B18R2.32674 Cc1ccncc1COCc2cccnc2Cl 34a_100000748726_100000690890 [0,2,0,0,0,0|2,0,0]=4 26560 B18R2.32674 Cc1ccncc1COCc2cccnc2Cl 34a_100011996381_100000045678 [0,2,0,0,0,0|2,0,0]=4 26561 B18R2.32674 Cc1ccncc1COCc2cccnc2Cl 7a_100000748726_100000690890 [0,2,0,0,0,0|2,0,0]=4 26562 B18R2.32674 Cc1ccncc1COCc2cccnc2F 34a_100000079888_100000690890 [0,2,0,0,0,0|2,0,0]=4 26563 B18R2.32674 Cc1ccncc1COCc2cccnc2F 34a_100011996381_100000099810 [0,2,0,0,0,0|2,0,0]=4 26564 B18R2.32674 Cc1ccncc1COCc2cccnc2F 7a_100000079888_100000690890 [0,2,0,0,0,0|2,0,0]=4 26565 B18R2.32674 Cc1ccncc1COCc2ccncc2F 34a_100012172863_100000690890 [0,2,0,0,0,0|2,0,0]=4 26566 B18R2.32674 Cc1ccncc1COCc2cnccc2C 34a_100011996381_100000690890 [0,2,0,0,0,0|2,0,0]=4 26567 B18R2.32674 Cc1ccncc1COCc2cnccc2Cl 34a_100000117392_100000690890 [0,2,0,0,0,0|2,0,0]=4 26568 B18R2.32674 Cc1ccncc1COCc2ncccc2Br 34a_100011996381_100025702911 [0,2,0,0,0,0|2,0,0]=4 26569 B18R2.32674 Cc1ccncc1COCc2ncccc2Br 34a_100011996772_100000690890 [0,2,0,0,0,0|2,0,0]=4 26570 B18R2.32674 Cc1ccncc1COCc2ncccc2C 34a_100000698912_100000690890 [0,2,0,0,0,0|2,0,0]=4 26571 B18R2.32674 Cc1ccncc1COCc2ncccc2C 34a_100011996381_100000696600 [0,2,0,0,0,0|2,0,0]=4 26572 B18R2.32674 Cc1ccncc1COCc2ncccc2Cl 34a_100012002383_100000690890 [0,2,0,0,0,0|2,0,0]=4 26573 B18R2.32674 Cc1ccncc1COCc2ncccc2F 34a_100011934865_100000690890 [0,2,0,0,0,0|2,0,0]=4 26574 B18R2.32674 Cc1ccncc1COCc2ncccc2F 34a_100011996381_100000104219 [0,2,0,0,0,0|2,0,0]=4 26575 B18R2.32674 Cc1ccncc1COCc2ncccc2N 34a_114873767017_100000690890 [0,2,0,0,0,0|2,0,0]=4 26576 B18R2.32674 Cc1ccncc1COCc2ncccc2O 34a_100011996381_200020655725 [0,2,0,0,0,0|2,0,0]=4 26577 B18R2.32674 Cc1ccncc1CSCc2ccccc2Br 62a_100000184730_100000690890 [0,2,0,0,0,0|1,1,0]=4 26578 B18R2.32674 Cc1ccncc1CSCc2ccccc2Br 62a_100000690890_100000184730 [0,2,0,0,0,0|1,1,0]=4 26579 B18R2.32674 Cc1ccncc1CSCc2ccccc2Cl 62a_100000187162_100000690890 [0,2,0,0,0,0|1,1,0]=4 26580 B18R2.32674 Cc1ccncc1CSCc2ccccc2Cl 62a_100000690890_100000187162 [0,2,0,0,0,0|1,1,0]=4 26581 B18R2.32674 Cc1ccncc1CSCc2ccccc2F 62a_100000211605_100000690890 [0,2,0,0,0,0|1,1,0]=4 26582 B18R2.32674 Cc1ccncc1CSCc2ccccc2F 62a_100000690890_100000211605 [0,2,0,0,0,0|1,1,0]=4 26583 B18R2.32674 Cc1ccncc1CSCc2ccccc2I 62a_100000690890_100011216222 [0,2,0,0,0,0|1,1,0]=4 26584 B18R2.32674 Cc1ccncc1CSCc2ccccc2I 62a_100011216222_100000690890 [0,2,0,0,0,0|1,1,0]=4 26585 B18R2.32674 Cc1cnccc1CNCc2ccccc2Br 207a_100000708811_100000211189 [0,2,0,0,0,0|2,0,0]=4 26586 B18R2.32674 Cc1cnccc1CNCc2ccccc2Br 2230a_100000689332_100020672808 [0,2,0,0,0,0|2,0,0]=4 26587 B18R2.32674 Cc1cnccc1CNCc2ccccc2Br 270004a_100000708811_100000211189 [0,2,0,0,0,0|2,0,0]=4 26588 B18R2.32674 Cc1cnccc1CNCc2ccccc2Br 34a_100000689332_100020672809 [0,2,0,0,0,0|2,0,0]=4 26589 B18R2.32674 Cc1cnccc1CNCc2ccccc2Cl 207a_100000708811_100000210073 [0,2,0,0,0,0|2,0,0]=4 26590 B18R2.32674 Cc1cnccc1CNCc2ccccc2Cl 2230a_100000174879_100020672808 [0,2,0,0,0,0|2,0,0]=4 26591 B18R2.32674 Cc1cnccc1CNCc2ccccc2Cl 270004a_100000708811_100000210073 [0,2,0,0,0,0|2,0,0]=4 26592 B18R2.32674 Cc1cnccc1CNCc2ccccc2Cl 34a_100000174879_100020672809 [0,2,0,0,0,0|2,0,0]=4 26593 B18R2.32674 Cc1cnccc1CNCc2ccccc2F 207a_100000708811_100000210811 [0,2,0,0,0,0|2,0,0]=4 26594 B18R2.32674 Cc1cnccc1CNCc2ccccc2F 270004a_100000708811_100000210811 [0,2,0,0,0,0|2,0,0]=4 26595 B18R2.32674 Cc1cnccc1CNCc2ccccc2F 34a_100000174869_100020672809 [0,2,0,0,0,0|2,0,0]=4 26596 B18R2.32674 Cc1cnccc1CNCc2ccccc2I 207a_100000708811_100000010305 [0,2,0,0,0,0|2,0,0]=4 26597 B18R2.32674 Cc1cnccc1CNCc2ccccc2I 270004a_100000708811_100000010305 [0,2,0,0,0,0|2,0,0]=4 26598 B18R2.32674 Cc1cnccc1CNCc2ccccc2O 34a_100000185550_100020672809 [0,2,0,0,0,0|2,0,0]=4 26599 B18R2.32674 Cc1cnccc1COCc2ccccc2Br 34a_100000756307_100020672809 [0,2,0,0,0,0|1,0,0]=3 26600 B18R2.32674 Cc1cnccc1COCc2ccccc2Br 34a_100011997032_100000184730 [0,2,0,0,0,0|1,0,0]=3 26601 B18R2.32674 Cc1cnccc1COCc2ccccc2Br 7a_100000756307_100020672808 [0,2,0,0,0,0|1,0,0]=3 26602 B18R2.32674 Cc1cnccc1COCc2ccccc2Cl 34a_100000210847_100020672809 [0,2,0,0,0,0|1,0,0]=3 26603 B18R2.32674 Cc1cnccc1COCc2ccccc2Cl 34a_100011997032_100000187162 [0,2,0,0,0,0|1,0,0]=3 26604 B18R2.32674 Cc1cnccc1COCc2ccccc2Cl 7a_100000210847_100020672808 [0,2,0,0,0,0|1,0,0]=3 26605 B18R2.32674 Cc1cnccc1COCc2ccccc2F 34a_100000211962_100020672809 [0,2,0,0,0,0|1,0,0]=3 26606 B18R2.32674 Cc1cnccc1COCc2ccccc2F 34a_100011997032_100000211605 [0,2,0,0,0,0|1,0,0]=3 26607 B18R2.32674 Cc1cnccc1COCc2ccccc2F 7a_100000211962_100020672808 [0,2,0,0,0,0|1,0,0]=3 26608 B18R2.32674 Cc1cnccc1COCc2ccccc2I 34a_100000187465_100020672809 [0,2,0,0,0,0|1,0,0]=3 26609 B18R2.32674 Cc1cnccc1COCc2ccccc2I 34a_100011997032_100011215278 [0,2,0,0,0,0|1,0,0]=3 26610 B18R2.32674 Cc1cnccc1COCc2ccccc2I 7a_100000187465_100020672808 [0,2,0,0,0,0|1,0,0]=3 26611 B18R2.32674 Cc1cnccc1COCc2ccccc2N 34a_100000212039_100020672809 [0,2,0,0,0,0|1,0,0]=3 26612 B18R2.32674 Cc1cnccc1COCc2cccnc2Br 34a_100000719692_100020672809 [0,2,0,0,0,0|2,0,0]=4 26613 B18R2.32674 Cc1cnccc1COCc2cccnc2Br 34a_100011997032_100010140945 [0,2,0,0,0,0|2,0,0]=4 26614 B18R2.32674 Cc1cnccc1COCc2cccnc2Br 7a_100000719692_100020672808 [0,2,0,0,0,0|2,0,0]=4 26615 B18R2.32674 Cc1cnccc1COCc2cccnc2C 34a_100000729262_100020672809 [0,2,0,0,0,0|2,0,0]=4 26616 B18R2.32674 Cc1cnccc1COCc2cccnc2C 34a_100011997032_100000732876 [0,2,0,0,0,0|2,0,0]=4 26617 B18R2.32674 Cc1cnccc1COCc2cccnc2C 7a_100000729262_100020672808 [0,2,0,0,0,0|2,0,0]=4 26618 B18R2.32674 Cc1cnccc1COCc2cccnc2Cl 34a_100000748726_100020672809 [0,2,0,0,0,0|2,0,0]=4 26619 B18R2.32674 Cc1cnccc1COCc2cccnc2Cl 34a_100011997032_100000045678 [0,2,0,0,0,0|2,0,0]=4 26620 B18R2.32674 Cc1cnccc1COCc2cccnc2Cl 7a_100000748726_100020672808 [0,2,0,0,0,0|2,0,0]=4 26621 B18R2.32674 Cc1cnccc1COCc2cccnc2F 34a_100000079888_100020672809 [0,2,0,0,0,0|2,0,0]=4 26622 B18R2.32674 Cc1cnccc1COCc2cccnc2F 34a_100011997032_100000099810 [0,2,0,0,0,0|2,0,0]=4 26623 B18R2.32674 Cc1cnccc1COCc2cccnc2F 7a_100000079888_100020672808 [0,2,0,0,0,0|2,0,0]=4 26624 B18R2.32674 Cc1cnccc1COCc2ccncc2C 34a_100011997032_100020672809 [0,2,0,0,0,0|2,0,0]=4 26625 B18R2.32674 Cc1cnccc1COCc2ccncc2F 34a_100012172863_100020672809 [0,2,0,0,0,0|2,0,0]=4 26626 B18R2.32674 Cc1cnccc1COCc2cnccc2C 34a_100011996381_100020672809 [0,2,0,0,0,0|2,0,0]=4 26627 B18R2.32674 Cc1cnccc1COCc2cnccc2C 34a_100011997032_100000690890 [0,2,0,0,0,0|2,0,0]=4 26628 B18R2.32674 Cc1cnccc1COCc2cnccc2Cl 34a_100000117392_100020672809 [0,2,0,0,0,0|2,0,0]=4 26629 B18R2.32674 Cc1cnccc1COCc2ncccc2Br 34a_100011996772_100020672809 [0,2,0,0,0,0|2,0,0]=4 26630 B18R2.32674 Cc1cnccc1COCc2ncccc2Br 34a_100011997032_100025702911 [0,2,0,0,0,0|2,0,0]=4 26631 B18R2.32674 Cc1cnccc1COCc2ncccc2C 34a_100000698912_100020672809 [0,2,0,0,0,0|2,0,0]=4 26632 B18R2.32674 Cc1cnccc1COCc2ncccc2C 34a_100011997032_100000696600 [0,2,0,0,0,0|2,0,0]=4 26633 B18R2.32674 Cc1cnccc1COCc2ncccc2Cl 34a_100012002383_100020672809 [0,2,0,0,0,0|2,0,0]=4 26634 B18R2.32674 Cc1cnccc1COCc2ncccc2F 34a_100011934865_100020672809 [0,2,0,0,0,0|2,0,0]=4 26635 B18R2.32674 Cc1cnccc1COCc2ncccc2F 34a_100011997032_100000104219 [0,2,0,0,0,0|2,0,0]=4 26636 B18R2.32674 Cc1cnccc1COCc2ncccc2N 34a_114873767017_100020672809 [0,2,0,0,0,0|2,0,0]=4 26637 B18R2.32674 Cc1cnccc1COCc2ncccc2O 34a_100011997032_200020655725 [0,2,0,0,0,0|2,0,0]=4 26638 B18R2.32674 Cc1cnccc1CSCc2ccccc2Br 62a_100000184730_100020672808 [0,2,0,0,0,0|1,1,0]=4 26639 B18R2.32674 Cc1cnccc1CSCc2ccccc2Br 62a_100020672808_100000184730 [0,2,0,0,0,0|1,1,0]=4 26640 B18R2.32674 Cc1cnccc1CSCc2ccccc2Cl 62a_100000187162_100020672808 [0,2,0,0,0,0|1,1,0]=4 26641 B18R2.32674 Cc1cnccc1CSCc2ccccc2Cl 62a_100020672808_100000187162 [0,2,0,0,0,0|1,1,0]=4 26642 B18R2.32674 Cc1cnccc1CSCc2ccccc2F 62a_100000211605_100020672808 [0,2,0,0,0,0|1,1,0]=4 26643 B18R2.32674 Cc1cnccc1CSCc2ccccc2F 62a_100020672808_100000211605 [0,2,0,0,0,0|1,1,0]=4 26644 B18R2.32674 Cc1cnccc1CSCc2ccccc2I 62a_100011216222_100020672808 [0,2,0,0,0,0|1,1,0]=4 26645 B18R2.32674 Cc1cnccc1CSCc2ccccc2I 62a_100020672808_100011216222 [0,2,0,0,0,0|1,1,0]=4 26646 B18R2.32674 Cc1ncccc1CNCc2ccccc2Br 207a_100000689332_100000751968 [0,2,0,0,0,0|2,0,0]=4 26647 B18R2.32674 Cc1ncccc1CNCc2ccccc2Br 2230a_100000689332_100000732876 [0,2,0,0,0,0|2,0,0]=4 26648 B18R2.32674 Cc1ncccc1CNCc2ccccc2Br 270004a_100000689332_100000751968 [0,2,0,0,0,0|2,0,0]=4 26649 B18R2.32674 Cc1ncccc1CNCc2ccccc2Br 34a_100000689332_100000732876 [0,2,0,0,0,0|2,0,0]=4 26650 B18R2.32674 Cc1ncccc1CNCc2ccccc2Cl 207a_100000174879_100000751968 [0,2,0,0,0,0|2,0,0]=4 26651 B18R2.32674 Cc1ncccc1CNCc2ccccc2Cl 2230a_100000174879_100000732876 [0,2,0,0,0,0|2,0,0]=4 26652 B18R2.32674 Cc1ncccc1CNCc2ccccc2Cl 270004a_100000174879_100000751968 [0,2,0,0,0,0|2,0,0]=4 26653 B18R2.32674 Cc1ncccc1CNCc2ccccc2Cl 34a_100000174879_100000732876 [0,2,0,0,0,0|2,0,0]=4 26654 B18R2.32674 Cc1ncccc1CNCc2ccccc2F 207a_100000174869_100000751968 [0,2,0,0,0,0|2,0,0]=4 26655 B18R2.32674 Cc1ncccc1CNCc2ccccc2F 270004a_100000174869_100000751968 [0,2,0,0,0,0|2,0,0]=4 26656 B18R2.32674 Cc1ncccc1CNCc2ccccc2F 34a_100000174869_100000732876 [0,2,0,0,0,0|2,0,0]=4 26657 B18R2.32674 Cc1ncccc1CNCc2ccccc2I 207a_100015347259_100000751968 [0,2,0,0,0,0|2,0,0]=4 26658 B18R2.32674 Cc1ncccc1CNCc2ccccc2I 270004a_100015347259_100000751968 [0,2,0,0,0,0|2,0,0]=4 26659 B18R2.32674 Cc1ncccc1CNCc2ccccc2O 207a_100000185550_100000751968 [0,2,0,0,0,0|2,0,0]=4 26660 B18R2.32674 Cc1ncccc1CNCc2ccccc2O 270004a_100000185550_100000751968 [0,2,0,0,0,0|2,0,0]=4 26661 B18R2.32674 Cc1ncccc1CNCc2ccccc2O 34a_100000185550_100000732876 [0,2,0,0,0,0|2,0,0]=4 26662 B18R2.32674 Cc1ncccc1COCc2ccccc2Br 34a_100000729262_100000184730 [0,2,0,0,0,0|1,0,0]=3 26663 B18R2.32674 Cc1ncccc1COCc2ccccc2Br 34a_100000756307_100000732876 [0,2,0,0,0,0|1,0,0]=3 26664 B18R2.32674 Cc1ncccc1COCc2ccccc2Br 7a_100000729262_100000184730 [0,2,0,0,0,0|1,0,0]=3 26665 B18R2.32674 Cc1ncccc1COCc2ccccc2Br 7a_100000756307_100000732876 [0,2,0,0,0,0|1,0,0]=3 26666 B18R2.32674 Cc1ncccc1COCc2ccccc2Cl 34a_100000210847_100000732876 [0,2,0,0,0,0|1,0,0]=3 26667 B18R2.32674 Cc1ncccc1COCc2ccccc2Cl 34a_100000729262_100000187162 [0,2,0,0,0,0|1,0,0]=3 26668 B18R2.32674 Cc1ncccc1COCc2ccccc2Cl 7a_100000210847_100000732876 [0,2,0,0,0,0|1,0,0]=3 26669 B18R2.32674 Cc1ncccc1COCc2ccccc2Cl 7a_100000729262_100000187162 [0,2,0,0,0,0|1,0,0]=3 26670 B18R2.32674 Cc1ncccc1COCc2ccccc2F 34a_100000211962_100000732876 [0,2,0,0,0,0|1,0,0]=3 26671 B18R2.32674 Cc1ncccc1COCc2ccccc2F 34a_100000729262_100000211605 [0,2,0,0,0,0|1,0,0]=3 26672 B18R2.32674 Cc1ncccc1COCc2ccccc2F 7a_100000211962_100000732876 [0,2,0,0,0,0|1,0,0]=3 26673 B18R2.32674 Cc1ncccc1COCc2ccccc2F 7a_100000729262_100000211605 [0,2,0,0,0,0|1,0,0]=3 26674 B18R2.32674 Cc1ncccc1COCc2ccccc2I 34a_100000187465_100000732876 [0,2,0,0,0,0|1,0,0]=3 26675 B18R2.32674 Cc1ncccc1COCc2ccccc2I 34a_100000729262_100011215278 [0,2,0,0,0,0|1,0,0]=3 26676 B18R2.32674 Cc1ncccc1COCc2ccccc2I 7a_100000187465_100000732876 [0,2,0,0,0,0|1,0,0]=3 26677 B18R2.32674 Cc1ncccc1COCc2ccccc2I 7a_100000729262_100011215278 [0,2,0,0,0,0|1,0,0]=3 26678 B18R2.32674 Cc1ncccc1COCc2ccccc2N 34a_100000212039_100000732876 [0,2,0,0,0,0|1,0,0]=3 26679 B18R2.32674 Cc1ncccc1COCc2cccnc2Br 34a_100000719692_100000732876 [0,2,0,0,0,0|2,0,0]=4 26680 B18R2.32674 Cc1ncccc1COCc2cccnc2Br 34a_100000729262_100010140945 [0,2,0,0,0,0|2,0,0]=4 26681 B18R2.32674 Cc1ncccc1COCc2cccnc2Br 7a_100000719692_100000732876 [0,2,0,0,0,0|2,0,0]=4 26682 B18R2.32674 Cc1ncccc1COCc2cccnc2Br 7a_100000729262_100010140945 [0,2,0,0,0,0|2,0,0]=4 26683 B18R2.32674 Cc1ncccc1COCc2cccnc2C 34a_100000729262_100000732876 [0,2,0,0,0,0|2,0,0]=4 26684 B18R2.32674 Cc1ncccc1COCc2cccnc2C 7a_100000729262_100000732876 [0,2,0,0,0,0|2,0,0]=4 26685 B18R2.32674 Cc1ncccc1COCc2cccnc2Cl 34a_100000729262_100000045678 [0,2,0,0,0,0|2,0,0]=4 26686 B18R2.32674 Cc1ncccc1COCc2cccnc2Cl 34a_100000748726_100000732876 [0,2,0,0,0,0|2,0,0]=4 26687 B18R2.32674 Cc1ncccc1COCc2cccnc2Cl 7a_100000729262_100000045678 [0,2,0,0,0,0|2,0,0]=4 26688 B18R2.32674 Cc1ncccc1COCc2cccnc2Cl 7a_100000748726_100000732876 [0,2,0,0,0,0|2,0,0]=4 26689 B18R2.32674 Cc1ncccc1COCc2cccnc2F 34a_100000079888_100000732876 [0,2,0,0,0,0|2,0,0]=4 26690 B18R2.32674 Cc1ncccc1COCc2cccnc2F 34a_100000729262_100000099810 [0,2,0,0,0,0|2,0,0]=4 26691 B18R2.32674 Cc1ncccc1COCc2cccnc2F 7a_100000079888_100000732876 [0,2,0,0,0,0|2,0,0]=4 26692 B18R2.32674 Cc1ncccc1COCc2cccnc2F 7a_100000729262_100000099810 [0,2,0,0,0,0|2,0,0]=4 26693 B18R2.32674 Cc1ncccc1COCc2ccncc2Cl 7a_100000729262_100000763264 [0,2,0,0,0,0|2,0,0]=4 26694 B18R2.32674 Cc1ncccc1COCc2ccncc2F 34a_100012172863_100000732876 [0,2,0,0,0,0|2,0,0]=4 26695 B18R2.32674 Cc1ncccc1COCc2cnccc2Cl 34a_100000117392_100000732876 [0,2,0,0,0,0|2,0,0]=4 26696 B18R2.32674 Cc1ncccc1COCc2ncccc2Br 34a_100000729262_100025702911 [0,2,0,0,0,0|2,0,0]=4 26697 B18R2.32674 Cc1ncccc1COCc2ncccc2Br 34a_100011996772_100000732876 [0,2,0,0,0,0|2,0,0]=4 26698 B18R2.32674 Cc1ncccc1COCc2ncccc2Br 7a_100000729262_100025702911 [0,2,0,0,0,0|2,0,0]=4 26699 B18R2.32674 Cc1ncccc1COCc2ncccc2Cl 34a_100012002383_100000732876 [0,2,0,0,0,0|2,0,0]=4 26700 B18R2.32674 Cc1ncccc1COCc2ncccc2Cl 7a_100000729262_100000099807 [0,2,0,0,0,0|2,0,0]=4 26701 B18R2.32674 Cc1ncccc1COCc2ncccc2F 34a_100000729262_100000104219 [0,2,0,0,0,0|2,0,0]=4 26702 B18R2.32674 Cc1ncccc1COCc2ncccc2F 34a_100011934865_100000732876 [0,2,0,0,0,0|2,0,0]=4 26703 B18R2.32674 Cc1ncccc1COCc2ncccc2F 7a_100000729262_100000104219 [0,2,0,0,0,0|2,0,0]=4 26704 B18R2.32674 Cc1ncccc1COCc2ncccc2N 34a_114873767017_100000732876 [0,2,0,0,0,0|2,0,0]=4 26705 B18R2.32674 Cc1ncccc1COCc2ncccc2O 34a_100000729262_200020655725 [0,2,0,0,0,0|2,0,0]=4 26706 B18R2.32674 Cc1ncccc1COCc2ncccc2O 7a_100000729262_200020655725 [0,2,0,0,0,0|2,0,0]=4 26707 B18R2.32674 Cc1ncccc1CSCc2ccccc2Br 62a_100000184730_100000732876 [0,2,0,0,0,0|1,1,0]=4 26708 B18R2.32674 Cc1ncccc1CSCc2ccccc2Br 62a_100000732876_100000184730 [0,2,0,0,0,0|1,1,0]=4 26709 B18R2.32674 Cc1ncccc1CSCc2ccccc2Cl 62a_100000187162_100000732876 [0,2,0,0,0,0|1,1,0]=4 26710 B18R2.32674 Cc1ncccc1CSCc2ccccc2Cl 62a_100000732876_100000187162 [0,2,0,0,0,0|1,1,0]=4 26711 B18R2.32674 Cc1ncccc1CSCc2ccccc2F 62a_100000211605_100000732876 [0,2,0,0,0,0|1,1,0]=4 26712 B18R2.32674 Cc1ncccc1CSCc2ccccc2F 62a_100000732876_100000211605 [0,2,0,0,0,0|1,1,0]=4 26713 B18R2.32674 Cc1ncccc1CSCc2ccccc2I 62a_100000732876_100011216222 [0,2,0,0,0,0|1,1,0]=4 26714 B18R2.32674 Cc1ncccc1CSCc2ccccc2I 62a_100011216222_100000732876 [0,2,0,0,0,0|1,1,0]=4 26715 B18R2.32674 Clc1ccccc1CCNc2ccccc2Br 34a_100000210017_100011713703 [0,2,0,0,0,0|2,0,0]=4 26716 B18R2.32674 Clc1ccccc1CCNc2ccccc2Cl 34a_100000185783_100011713703 [0,2,0,0,0,0|2,0,0]=4 26717 B18R2.32674 Clc1ccccc1CCNc2ccccc2I 34a_100000210053_100011713703 [0,2,0,0,0,0|2,0,0]=4 26718 B18R2.32674 Clc1ccccc1CCOc2ccccc2Br 34a_100000181306_100011713703 [0,2,0,0,0,0|2,0,0]=4 26719 B18R2.32674 Clc1ccccc1CCOc2ccccc2Br 7a_100000181306_100011713703 [0,2,0,0,0,0|2,0,0]=4 26720 B18R2.32674 Clc1ccccc1CCOc2ccccc2Cl 34a_100000210172_100011713703 [0,2,0,0,0,0|2,0,0]=4 26721 B18R2.32674 Clc1ccccc1CCOc2ccccc2Cl 7a_100000210172_100011713703 [0,2,0,0,0,0|2,0,0]=4 26722 B18R2.32674 Clc1ccccc1CCOc2ccccc2I 34a_100000739446_100011713703 [0,2,0,0,0,0|2,0,0]=4 26723 B18R2.32674 Clc1ccccc1CCOc2ccccc2I 7a_100000739446_100011713703 [0,2,0,0,0,0|2,0,0]=4 26724 B18R2.32674 Clc1ccccc1CCSc2ccccc2Br 62a_100000695589_100011713703 [0,2,0,0,0,0|2,0,0]=4 26725 B18R2.32674 Clc1ccccc1CCSc2ccccc2Br 62a_100011713703_100000695589 [0,2,0,0,0,0|2,0,0]=4 26726 B18R2.32674 Clc1ccccc1CCSc2ccccc2Cl 62a_100000764095_100011713703 [0,2,0,0,0,0|2,0,0]=4 26727 B18R2.32674 Clc1ccccc1CCSc2ccccc2Cl 62a_100011713703_100000764095 [0,2,0,0,0,0|2,0,0]=4 26728 B18R2.32674 Clc1ccccc1CNCc2ccccc2Br 207a_100000174879_100000211189 [0,2,0,0,0,0|1,0,0]=3 26729 B18R2.32674 Clc1ccccc1CNCc2ccccc2Br 207a_100000689332_100000210073 [0,2,0,0,0,0|1,0,0]=3 26730 B18R2.32674 Clc1ccccc1CNCc2ccccc2Br 2230a_100000174879_100000184730 [0,2,0,0,0,0|1,0,0]=3 26731 B18R2.32674 Clc1ccccc1CNCc2ccccc2Br 2230a_100000689332_100000187162 [0,2,0,0,0,0|1,0,0]=3 26732 B18R2.32674 Clc1ccccc1CNCc2ccccc2Br 26a_100000174879_100000181306 [0,2,0,0,0,0|1,0,0]=3 26733 B18R2.32674 Clc1ccccc1CNCc2ccccc2Br 26a_100000689332_100000210172 [0,2,0,0,0,0|1,0,0]=3 26734 B18R2.32674 Clc1ccccc1CNCc2ccccc2Br 270004a_100000174879_100000211189 [0,2,0,0,0,0|1,0,0]=3 26735 B18R2.32674 Clc1ccccc1CNCc2ccccc2Br 270004a_100000689332_100000210073 [0,2,0,0,0,0|1,0,0]=3 26736 B18R2.32674 Clc1ccccc1CNCc2ccccc2Br 34a_100000174879_100000184730 [0,2,0,0,0,0|1,0,0]=3 26737 B18R2.32674 Clc1ccccc1CNCc2ccccc2Br 34a_100000689332_100000187162 [0,2,0,0,0,0|1,0,0]=3 26738 B18R2.32674 Clc1ccccc1CNCc2ccccc2Cl 207a_100000174879_100000210073 [0,2,0,0,0,0|1,0,0]=3 26739 B18R2.32674 Clc1ccccc1CNCc2ccccc2Cl 2230a_100000174879_100000187162 [0,2,0,0,0,0|1,0,0]=3 26740 B18R2.32674 Clc1ccccc1CNCc2ccccc2Cl 26a_100000174879_100000210172 [0,2,0,0,0,0|1,0,0]=3 26741 B18R2.32674 Clc1ccccc1CNCc2ccccc2Cl 270004a_100000174879_100000210073 [0,2,0,0,0,0|1,0,0]=3 26742 B18R2.32674 Clc1ccccc1CNCc2ccccc2Cl 34a_100000174879_100000187162 [0,2,0,0,0,0|1,0,0]=3 26743 B18R2.32674 Clc1ccccc1CNCc2ccccc2I 207a_100000174879_100000010305 [0,2,0,0,0,0|1,0,0]=3 26744 B18R2.32674 Clc1ccccc1CNCc2ccccc2I 207a_100015347259_100000210073 [0,2,0,0,0,0|1,0,0]=3 26745 B18R2.32674 Clc1ccccc1CNCc2ccccc2I 2230a_100000174879_100011215278 [0,2,0,0,0,0|1,0,0]=3 26746 B18R2.32674 Clc1ccccc1CNCc2ccccc2I 270004a_100000174879_100000010305 [0,2,0,0,0,0|1,0,0]=3 26747 B18R2.32674 Clc1ccccc1CNCc2ccccc2I 270004a_100015347259_100000210073 [0,2,0,0,0,0|1,0,0]=3 26748 B18R2.32674 Clc1ccccc1CNCc2ccccc2I 34a_100000174879_100011215278 [0,2,0,0,0,0|1,0,0]=3 26749 B18R2.32674 Clc1ccccc1CNCc2cccnc2Br 2230a_100000174879_100010140945 [0,2,0,0,0,0|2,0,0]=4 26750 B18R2.32674 Clc1ccccc1CNCc2cccnc2Br 2230a_100009818023_100000187162 [0,2,0,0,0,0|2,0,0]=4 26751 B18R2.32674 Clc1ccccc1CNCc2cccnc2Br 270004a_100009818023_100000210073 [0,2,0,0,0,0|2,0,0]=4 26752 B18R2.32674 Clc1ccccc1CNCc2cccnc2Br 34a_100000174879_100010140945 [0,2,0,0,0,0|2,0,0]=4 26753 B18R2.32674 Clc1ccccc1CNCc2cccnc2Br 34a_100009818023_100000187162 [0,2,0,0,0,0|2,0,0]=4 26754 B18R2.32674 Clc1ccccc1CNCc2cccnc2Cl 207a_100015189234_100000210073 [0,2,0,0,0,0|2,0,0]=4 26755 B18R2.32674 Clc1ccccc1CNCc2cccnc2Cl 2230a_100000174879_100000045678 [0,2,0,0,0,0|2,0,0]=4 26756 B18R2.32674 Clc1ccccc1CNCc2cccnc2Cl 2230a_100015189234_100000187162 [0,2,0,0,0,0|2,0,0]=4 26757 B18R2.32674 Clc1ccccc1CNCc2cccnc2Cl 34a_100000174879_100000045678 [0,2,0,0,0,0|2,0,0]=4 26758 B18R2.32674 Clc1ccccc1CNCc2cccnc2Cl 34a_100015189234_100000187162 [0,2,0,0,0,0|2,0,0]=4 26759 B18R2.32674 Clc1ccccc1CNCc2ccncc2Br 207a_100020640021_100000210073 [0,2,0,0,0,0|2,0,0]=4 26760 B18R2.32674 Clc1ccccc1CNCc2ccncc2Br 270004a_100000174879_100000755692 [0,2,0,0,0,0|2,0,0]=4 26761 B18R2.32674 Clc1ccccc1CNCc2ccncc2Br 270004a_100020640021_100000210073 [0,2,0,0,0,0|2,0,0]=4 26762 B18R2.32674 Clc1ccccc1CNCc2ccncc2Cl 207a_100000174879_100011934409 [0,2,0,0,0,0|2,0,0]=4 26763 B18R2.32674 Clc1ccccc1CNCc2ccncc2Cl 2230a_100000174879_100000763264 [0,2,0,0,0,0|2,0,0]=4 26764 B18R2.32674 Clc1ccccc1CNCc2ccncc2Cl 270004a_100000174879_100011934409 [0,2,0,0,0,0|2,0,0]=4 26765 B18R2.32674 Clc1ccccc1CNCc2cnccc2Br 270004a_100000174879_100009816821 [0,2,0,0,0,0|2,0,0]=4 26766 B18R2.32674 Clc1ccccc1CNCc2cnccc2Cl 270004a_100000174879_100000050567 [0,2,0,0,0,0|2,0,0]=4 26767 B18R2.32674 Clc1ccccc1CNCc2ncccc2Br 207a_100000174879_100011934733 [0,2,0,0,0,0|2,0,0]=4 26768 B18R2.32674 Clc1ccccc1CNCc2ncccc2Br 2230a_100000174879_100025702911 [0,2,0,0,0,0|2,0,0]=4 26769 B18R2.32674 Clc1ccccc1CNCc2ncccc2Br 270004a_100000174879_100011934733 [0,2,0,0,0,0|2,0,0]=4 26770 B18R2.32674 Clc1ccccc1CNCc2ncccc2Br 270004a_100020591323_100000210073 [0,2,0,0,0,0|2,0,0]=4 26771 B18R2.32674 Clc1ccccc1CNCc2ncccc2Br 34a_100000174879_100025702911 [0,2,0,0,0,0|2,0,0]=4 26772 B18R2.32674 Clc1ccccc1CNCc2ncccc2Cl 207a_100000174879_100012001307 [0,2,0,0,0,0|2,0,0]=4 26773 B18R2.32674 Clc1ccccc1CNCc2ncccc2Cl 2230a_100000174879_100000099807 [0,2,0,0,0,0|2,0,0]=4 26774 B18R2.32674 Clc1ccccc1CNCc2ncccc2Cl 2230a_100015189233_100000187162 [0,2,0,0,0,0|2,0,0]=4 26775 B18R2.32674 Clc1ccccc1CNCc2ncccc2Cl 270004a_100000174879_100012001307 [0,2,0,0,0,0|2,0,0]=4 26776 B18R2.32674 Clc1ccccc1CNCc2ncccc2Cl 270004a_100015189233_100000210073 [0,2,0,0,0,0|2,0,0]=4 26777 B18R2.32674 Clc1ccccc1COCc2ccccc2Br 34a_100000210847_100000184730 [0,2,0,0,0,0|0,0,0]=2 26778 B18R2.32674 Clc1ccccc1COCc2ccccc2Br 34a_100000756307_100000187162 [0,2,0,0,0,0|0,0,0]=2 26779 B18R2.32674 Clc1ccccc1COCc2ccccc2Br 7a_100000210847_100000184730 [0,2,0,0,0,0|0,0,0]=2 26780 B18R2.32674 Clc1ccccc1COCc2ccccc2Br 7a_100000756307_100000187162 [0,2,0,0,0,0|0,0,0]=2 26781 B18R2.32674 Clc1ccccc1COCc2ccccc2Cl 34a_100000210847_100000187162 [0,2,0,0,0,0|0,0,0]=2 26782 B18R2.32674 Clc1ccccc1COCc2ccccc2Cl 7a_100000210847_100000187162 [0,2,0,0,0,0|0,0,0]=2 26783 B18R2.32674 Clc1ccccc1COCc2ccccc2I 34a_100000187465_100000187162 [0,2,0,0,0,0|0,0,0]=2 26784 B18R2.32674 Clc1ccccc1COCc2ccccc2I 34a_100000210847_100011215278 [0,2,0,0,0,0|0,0,0]=2 26785 B18R2.32674 Clc1ccccc1COCc2ccccc2I 7a_100000187465_100000187162 [0,2,0,0,0,0|0,0,0]=2 26786 B18R2.32674 Clc1ccccc1COCc2ccccc2I 7a_100000210847_100011215278 [0,2,0,0,0,0|0,0,0]=2 26787 B18R2.32674 Clc1ccccc1COCc2cccnc2Br 34a_100000210847_100010140945 [0,2,0,0,0,0|1,0,0]=3 26788 B18R2.32674 Clc1ccccc1COCc2cccnc2Br 34a_100000719692_100000187162 [0,2,0,0,0,0|1,0,0]=3 26789 B18R2.32674 Clc1ccccc1COCc2cccnc2Br 7a_100000210847_100010140945 [0,2,0,0,0,0|1,0,0]=3 26790 B18R2.32674 Clc1ccccc1COCc2cccnc2Br 7a_100000719692_100000187162 [0,2,0,0,0,0|1,0,0]=3 26791 B18R2.32674 Clc1ccccc1COCc2cccnc2Cl 34a_100000210847_100000045678 [0,2,0,0,0,0|1,0,0]=3 26792 B18R2.32674 Clc1ccccc1COCc2cccnc2Cl 34a_100000748726_100000187162 [0,2,0,0,0,0|1,0,0]=3 26793 B18R2.32674 Clc1ccccc1COCc2cccnc2Cl 7a_100000210847_100000045678 [0,2,0,0,0,0|1,0,0]=3 26794 B18R2.32674 Clc1ccccc1COCc2cccnc2Cl 7a_100000748726_100000187162 [0,2,0,0,0,0|1,0,0]=3 26795 B18R2.32674 Clc1ccccc1COCc2ccncc2Cl 7a_100000210847_100000763264 [0,2,0,0,0,0|1,0,0]=3 26796 B18R2.32674 Clc1ccccc1COCc2cnccc2Cl 34a_100000117392_100000187162 [0,2,0,0,0,0|1,0,0]=3 26797 B18R2.32674 Clc1ccccc1COCc2ncccc2Br 34a_100000210847_100025702911 [0,2,0,0,0,0|1,0,0]=3 26798 B18R2.32674 Clc1ccccc1COCc2ncccc2Br 34a_100011996772_100000187162 [0,2,0,0,0,0|1,0,0]=3 26799 B18R2.32674 Clc1ccccc1COCc2ncccc2Br 7a_100000210847_100025702911 [0,2,0,0,0,0|1,0,0]=3 26800 B18R2.32674 Clc1ccccc1COCc2ncccc2Cl 34a_100012002383_100000187162 [0,2,0,0,0,0|1,0,0]=3 26801 B18R2.32674 Clc1ccccc1COCc2ncccc2Cl 7a_100000210847_100000099807 [0,2,0,0,0,0|1,0,0]=3 26802 B18R2.32674 Clc1ccccc1COCc2nccnc2Cl 34a_100000057004_100000187162 [0,2,0,0,0,0|2,0,0]=4 26803 B18R2.32674 Clc1ccccc1CSCc2ccccc2Br 62a_100000184730_100000187162 [0,2,0,0,0,0|0,1,0]=3 26804 B18R2.32674 Clc1ccccc1CSCc2ccccc2Br 62a_100000187162_100000184730 [0,2,0,0,0,0|0,1,0]=3 26805 B18R2.32674 Clc1ccccc1CSCc2ccccc2Cl 62a_100000187162_100000187162 [0,2,0,0,0,0|0,1,0]=3 26806 B18R2.32674 Clc1ccccc1CSCc2ccccc2I 62a_100000187162_100011216222 [0,2,0,0,0,0|0,1,0]=3 26807 B18R2.32674 Clc1ccccc1CSCc2ccccc2I 62a_100011216222_100000187162 [0,2,0,0,0,0|0,1,0]=3 26808 B18R2.32674 Clc1ccccc1CSCc2cccnc2Br 62a_100000187162_100010140945 [0,2,0,0,0,0|1,1,0]=4 26809 B18R2.32674 Clc1ccccc1CSCc2cccnc2Br 62a_100010140945_100000187162 [0,2,0,0,0,0|1,1,0]=4 26810 B18R2.32674 Clc1ccccc1CSCc2cccnc2Cl 62a_100000045678_100000187162 [0,2,0,0,0,0|1,1,0]=4 26811 B18R2.32674 Clc1ccccc1CSCc2cccnc2Cl 62a_100000187162_100000045678 [0,2,0,0,0,0|1,1,0]=4 26812 B18R2.32674 Clc1ccccc1CSCc2ccncc2Cl 62a_100000187162_100000763264 [0,2,0,0,0,0|1,1,0]=4 26813 B18R2.32674 Clc1ccccc1CSCc2ccncc2Cl 62a_100000763264_100000187162 [0,2,0,0,0,0|1,1,0]=4 26814 B18R2.32674 Clc1ccccc1CSCc2ncccc2Br 62a_100000187162_100025702911 [0,2,0,0,0,0|1,1,0]=4 26815 B18R2.32674 Clc1ccccc1CSCc2ncccc2Br 62a_100025702911_100000187162 [0,2,0,0,0,0|1,1,0]=4 26816 B18R2.32674 Clc1ccccc1CSCc2ncccc2Cl 62a_100000099807_100000187162 [0,2,0,0,0,0|1,1,0]=4 26817 B18R2.32674 Clc1ccccc1CSCc2ncccc2Cl 62a_100000187162_100000099807 [0,2,0,0,0,0|1,1,0]=4 26818 B18R2.32674 Clc1ccccc1NCCc2ccccc2Br 34a_100000185783_100012161201 [0,2,0,0,0,0|2,0,0]=4 26819 B18R2.32674 Clc1ccccc1OCCc2ccccc2Br 34a_100000210172_100012161201 [0,2,0,0,0,0|2,0,0]=4 26820 B18R2.32674 Clc1ccccc1OCCc2ccccc2Br 7a_100000210172_100012161201 [0,2,0,0,0,0|2,0,0]=4 26821 B18R2.32674 Clc1ccccc1SCCc2ccccc2Br 62a_100000764095_100012161201 [0,2,0,0,0,0|2,0,0]=4 26822 B18R2.32674 Clc1ccccc1SCCc2ccccc2Br 62a_100012161201_100000764095 [0,2,0,0,0,0|2,0,0]=4 26823 B18R2.32674 Clc1cccnc1CNCc2ccccc2Br 207a_100000689332_100012001307 [0,2,0,0,0,0|2,0,0]=4 26824 B18R2.32674 Clc1cccnc1CNCc2ccccc2Br 2230a_100000689332_100000099807 [0,2,0,0,0,0|2,0,0]=4 26825 B18R2.32674 Clc1cccnc1CNCc2ccccc2Br 2230a_100015189233_100000184730 [0,2,0,0,0,0|2,0,0]=4 26826 B18R2.32674 Clc1cccnc1CNCc2ccccc2Br 270004a_100000689332_100012001307 [0,2,0,0,0,0|2,0,0]=4 26827 B18R2.32674 Clc1cccnc1CNCc2ccccc2Br 270004a_100015189233_100000211189 [0,2,0,0,0,0|2,0,0]=4 26828 B18R2.32674 Clc1cccnc1CNCc2ccccc2I 207a_100015347259_100012001307 [0,2,0,0,0,0|2,0,0]=4 26829 B18R2.32674 Clc1cccnc1CNCc2ccccc2I 2230a_100015189233_100011215278 [0,2,0,0,0,0|2,0,0]=4 26830 B18R2.32674 Clc1cccnc1CNCc2ccccc2I 270004a_100015189233_100000010305 [0,2,0,0,0,0|2,0,0]=4 26831 B18R2.32674 Clc1cccnc1CNCc2ccccc2I 270004a_100015347259_100012001307 [0,2,0,0,0,0|2,0,0]=4 26832 B18R2.32674 Clc1cccnc1COCc2ccccc2Br 34a_100012002383_100000184730 [0,2,0,0,0,0|1,0,0]=3 26833 B18R2.32674 Clc1cccnc1COCc2ccccc2Br 7a_100000756307_100000099807 [0,2,0,0,0,0|1,0,0]=3 26834 B18R2.32674 Clc1cccnc1COCc2ccccc2I 34a_100012002383_100011215278 [0,2,0,0,0,0|1,0,0]=3 26835 B18R2.32674 Clc1cccnc1COCc2ccccc2I 7a_100000187465_100000099807 [0,2,0,0,0,0|1,0,0]=3 26836 B18R2.32674 Clc1cccnc1COCc2cccnc2Br 34a_100012002383_100010140945 [0,2,0,0,0,0|2,0,0]=4 26837 B18R2.32674 Clc1cccnc1COCc2cccnc2Br 7a_100000719692_100000099807 [0,2,0,0,0,0|2,0,0]=4 26838 B18R2.32674 Clc1cccnc1COCc2cccnc2Cl 34a_100012002383_100000045678 [0,2,0,0,0,0|2,0,0]=4 26839 B18R2.32674 Clc1cccnc1COCc2cccnc2Cl 7a_100000748726_100000099807 [0,2,0,0,0,0|2,0,0]=4 26840 B18R2.32674 Clc1cccnc1COCc2ncccc2Br 34a_100012002383_100025702911 [0,2,0,0,0,0|2,0,0]=4 26841 B18R2.32674 Clc1cccnc1CSCc2ccccc2Br 62a_100000099807_100000184730 [0,2,0,0,0,0|1,1,0]=4 26842 B18R2.32674 Clc1cccnc1CSCc2ccccc2Br 62a_100000184730_100000099807 [0,2,0,0,0,0|1,1,0]=4 26843 B18R2.32674 Clc1cccnc1CSCc2ccccc2I 62a_100000099807_100011216222 [0,2,0,0,0,0|1,1,0]=4 26844 B18R2.32674 Clc1cccnc1CSCc2ccccc2I 62a_100011216222_100000099807 [0,2,0,0,0,0|1,1,0]=4 26845 B18R2.32674 Clc1ccncc1CNCc2ccccc2Br 270004a_100000689332_100000050567 [0,2,0,0,0,0|2,0,0]=4 26846 B18R2.32674 Clc1ccncc1CNCc2ccccc2I 270004a_100015347259_100000050567 [0,2,0,0,0,0|2,0,0]=4 26847 B18R2.32674 Clc1ccncc1COCc2ccccc2Br 34a_100000117392_100000184730 [0,2,0,0,0,0|1,0,0]=3 26848 B18R2.32674 Clc1ccncc1COCc2ccccc2I 34a_100000117392_100011215278 [0,2,0,0,0,0|1,0,0]=3 26849 B18R2.32674 Clc1ccncc1COCc2cccnc2Br 34a_100000117392_100010140945 [0,2,0,0,0,0|2,0,0]=4 26850 B18R2.32674 Clc1ccncc1COCc2cccnc2Cl 34a_100000117392_100000045678 [0,2,0,0,0,0|2,0,0]=4 26851 B18R2.32674 Clc1ccncc1COCc2ncccc2Br 34a_100000117392_100025702911 [0,2,0,0,0,0|2,0,0]=4 26852 B18R2.32674 Clc1cnccc1CNCc2ccccc2Br 207a_100000689332_100011934409 [0,2,0,0,0,0|2,0,0]=4 26853 B18R2.32674 Clc1cnccc1CNCc2ccccc2Br 2230a_100000689332_100000763264 [0,2,0,0,0,0|2,0,0]=4 26854 B18R2.32674 Clc1cnccc1CNCc2ccccc2Br 270004a_100000689332_100011934409 [0,2,0,0,0,0|2,0,0]=4 26855 B18R2.32674 Clc1cnccc1CNCc2ccccc2I 207a_100015347259_100011934409 [0,2,0,0,0,0|2,0,0]=4 26856 B18R2.32674 Clc1cnccc1CNCc2ccccc2I 270004a_100015347259_100011934409 [0,2,0,0,0,0|2,0,0]=4 26857 B18R2.32674 Clc1cnccc1COCc2ccccc2Br 7a_100000756307_100000763264 [0,2,0,0,0,0|1,0,0]=3 26858 B18R2.32674 Clc1cnccc1COCc2ccccc2I 7a_100000187465_100000763264 [0,2,0,0,0,0|1,0,0]=3 26859 B18R2.32674 Clc1cnccc1COCc2cccnc2Br 7a_100000719692_100000763264 [0,2,0,0,0,0|2,0,0]=4 26860 B18R2.32674 Clc1cnccc1COCc2cccnc2Cl 7a_100000748726_100000763264 [0,2,0,0,0,0|2,0,0]=4 26861 B18R2.32674 Clc1cnccc1CSCc2ccccc2Br 62a_100000184730_100000763264 [0,2,0,0,0,0|1,1,0]=4 26862 B18R2.32674 Clc1cnccc1CSCc2ccccc2Br 62a_100000763264_100000184730 [0,2,0,0,0,0|1,1,0]=4 26863 B18R2.32674 Clc1cnccc1CSCc2ccccc2I 62a_100000763264_100011216222 [0,2,0,0,0,0|1,1,0]=4 26864 B18R2.32674 Clc1cnccc1CSCc2ccccc2I 62a_100011216222_100000763264 [0,2,0,0,0,0|1,1,0]=4 26865 B18R2.32674 Clc1ncccc1CNCc2ccccc2Br 207a_100015189234_100000211189 [0,2,0,0,0,0|2,0,0]=4 26866 B18R2.32674 Clc1ncccc1CNCc2ccccc2Br 2230a_100000689332_100000045678 [0,2,0,0,0,0|2,0,0]=4 26867 B18R2.32674 Clc1ncccc1CNCc2ccccc2Br 2230a_100015189234_100000184730 [0,2,0,0,0,0|2,0,0]=4 26868 B18R2.32674 Clc1ncccc1CNCc2ccccc2Br 34a_100000689332_100000045678 [0,2,0,0,0,0|2,0,0]=4 26869 B18R2.32674 Clc1ncccc1CNCc2ccccc2Br 34a_100015189234_100000184730 [0,2,0,0,0,0|2,0,0]=4 26870 B18R2.32674 Clc1ncccc1CNCc2ccccc2I 207a_100015189234_100000010305 [0,2,0,0,0,0|2,0,0]=4 26871 B18R2.32674 Clc1ncccc1CNCc2ccccc2I 2230a_100015189234_100011215278 [0,2,0,0,0,0|2,0,0]=4 26872 B18R2.32674 Clc1ncccc1CNCc2ccccc2I 34a_100015189234_100011215278 [0,2,0,0,0,0|2,0,0]=4 26873 B18R2.32674 Clc1ncccc1COCc2ccccc2Br 34a_100000748726_100000184730 [0,2,0,0,0,0|1,0,0]=3 26874 B18R2.32674 Clc1ncccc1COCc2ccccc2Br 34a_100000756307_100000045678 [0,2,0,0,0,0|1,0,0]=3 26875 B18R2.32674 Clc1ncccc1COCc2ccccc2Br 7a_100000748726_100000184730 [0,2,0,0,0,0|1,0,0]=3 26876 B18R2.32674 Clc1ncccc1COCc2ccccc2Br 7a_100000756307_100000045678 [0,2,0,0,0,0|1,0,0]=3 26877 B18R2.32674 Clc1ncccc1COCc2ccccc2I 34a_100000187465_100000045678 [0,2,0,0,0,0|1,0,0]=3 26878 B18R2.32674 Clc1ncccc1COCc2ccccc2I 34a_100000748726_100011215278 [0,2,0,0,0,0|1,0,0]=3 26879 B18R2.32674 Clc1ncccc1COCc2ccccc2I 7a_100000187465_100000045678 [0,2,0,0,0,0|1,0,0]=3 26880 B18R2.32674 Clc1ncccc1COCc2ccccc2I 7a_100000748726_100011215278 [0,2,0,0,0,0|1,0,0]=3 26881 B18R2.32674 Clc1ncccc1COCc2cccnc2Br 34a_100000719692_100000045678 [0,2,0,0,0,0|2,0,0]=4 26882 B18R2.32674 Clc1ncccc1COCc2cccnc2Br 34a_100000748726_100010140945 [0,2,0,0,0,0|2,0,0]=4 26883 B18R2.32674 Clc1ncccc1COCc2cccnc2Br 7a_100000719692_100000045678 [0,2,0,0,0,0|2,0,0]=4 26884 B18R2.32674 Clc1ncccc1COCc2cccnc2Br 7a_100000748726_100010140945 [0,2,0,0,0,0|2,0,0]=4 26885 B18R2.32674 Clc1ncccc1COCc2cccnc2Cl 34a_100000748726_100000045678 [0,2,0,0,0,0|2,0,0]=4 26886 B18R2.32674 Clc1ncccc1COCc2cccnc2Cl 7a_100000748726_100000045678 [0,2,0,0,0,0|2,0,0]=4 26887 B18R2.32674 Clc1ncccc1COCc2ncccc2Br 34a_100000748726_100025702911 [0,2,0,0,0,0|2,0,0]=4 26888 B18R2.32674 Clc1ncccc1COCc2ncccc2Br 34a_100011996772_100000045678 [0,2,0,0,0,0|2,0,0]=4 26889 B18R2.32674 Clc1ncccc1COCc2ncccc2Br 7a_100000748726_100025702911 [0,2,0,0,0,0|2,0,0]=4 26890 B18R2.32674 Clc1ncccc1CSCc2ccccc2Br 62a_100000045678_100000184730 [0,2,0,0,0,0|1,1,0]=4 26891 B18R2.32674 Clc1ncccc1CSCc2ccccc2Br 62a_100000184730_100000045678 [0,2,0,0,0,0|1,1,0]=4 26892 B18R2.32674 Clc1ncccc1CSCc2ccccc2I 62a_100000045678_100011216222 [0,2,0,0,0,0|1,1,0]=4 26893 B18R2.32674 Clc1ncccc1CSCc2ccccc2I 62a_100011216222_100000045678 [0,2,0,0,0,0|1,1,0]=4 26894 B18R2.32674 Clc1nccnc1COCc2ccccc2Br 34a_100000057004_100000184730 [0,2,0,0,0,0|2,0,0]=4 26895 B18R2.32674 Clc1nccnc1COCc2ccccc2I 34a_100000057004_100011215278 [0,2,0,0,0,0|2,0,0]=4 26896 B18R2.32674 Fc1ccccc1CCNc2ccccc2Br 34a_100000210017_100000720011 [0,2,0,0,0,0|2,0,0]=4 26897 B18R2.32674 Fc1ccccc1CCNc2ccccc2Cl 34a_100000185783_100000720011 [0,2,0,0,0,0|2,0,0]=4 26898 B18R2.32674 Fc1ccccc1CCNc2ccccc2F 34a_100000210422_100000720011 [0,2,0,0,0,0|2,0,0]=4 26899 B18R2.32674 Fc1ccccc1CCNc2ccccc2I 34a_100000210053_100000720011 [0,2,0,0,0,0|2,0,0]=4 26900 B18R2.32674 Fc1ccccc1CCOc2ccccc2Br 34a_100000181306_100000720011 [0,2,0,0,0,0|2,0,0]=4 26901 B18R2.32674 Fc1ccccc1CCOc2ccccc2Br 7a_100000181306_100000720011 [0,2,0,0,0,0|2,0,0]=4 26902 B18R2.32674 Fc1ccccc1CCOc2ccccc2Cl 34a_100000210172_100000720011 [0,2,0,0,0,0|2,0,0]=4 26903 B18R2.32674 Fc1ccccc1CCOc2ccccc2Cl 7a_100000210172_100000720011 [0,2,0,0,0,0|2,0,0]=4 26904 B18R2.32674 Fc1ccccc1CCOc2ccccc2F 34a_100000210171_100000720011 [0,2,0,0,0,0|2,0,0]=4 26905 B18R2.32674 Fc1ccccc1CCOc2ccccc2F 7a_100000210171_100000720011 [0,2,0,0,0,0|2,0,0]=4 26906 B18R2.32674 Fc1ccccc1CCOc2ccccc2I 34a_100000739446_100000720011 [0,2,0,0,0,0|2,0,0]=4 26907 B18R2.32674 Fc1ccccc1CCOc2ccccc2I 7a_100000739446_100000720011 [0,2,0,0,0,0|2,0,0]=4 26908 B18R2.32674 Fc1ccccc1CCSc2ccccc2Br 62a_100000695589_100011713696 [0,2,0,0,0,0|2,0,0]=4 26909 B18R2.32674 Fc1ccccc1CCSc2ccccc2Br 62a_100011713696_100000695589 [0,2,0,0,0,0|2,0,0]=4 26910 B18R2.32674 Fc1ccccc1CCSc2ccccc2Cl 62a_100000764095_100011713696 [0,2,0,0,0,0|2,0,0]=4 26911 B18R2.32674 Fc1ccccc1CCSc2ccccc2Cl 62a_100011713696_100000764095 [0,2,0,0,0,0|2,0,0]=4 26912 B18R2.32674 Fc1ccccc1CCSc2ccccc2F 62a_100011215700_100011713696 [0,2,0,0,0,0|2,0,0]=4 26913 B18R2.32674 Fc1ccccc1CCSc2ccccc2F 62a_100011713696_100011215700 [0,2,0,0,0,0|2,0,0]=4 26914 B18R2.32674 Fc1ccccc1CNCc2ccccc2Br 207a_100000174869_100000211189 [0,2,0,0,0,0|1,0,0]=3 26915 B18R2.32674 Fc1ccccc1CNCc2ccccc2Br 207a_100000689332_100000210811 [0,2,0,0,0,0|1,0,0]=3 26916 B18R2.32674 Fc1ccccc1CNCc2ccccc2Br 2230a_100000689332_100000211605 [0,2,0,0,0,0|1,0,0]=3 26917 B18R2.32674 Fc1ccccc1CNCc2ccccc2Br 270004a_100000174869_100000211189 [0,2,0,0,0,0|1,0,0]=3 26918 B18R2.32674 Fc1ccccc1CNCc2ccccc2Br 270004a_100000689332_100000210811 [0,2,0,0,0,0|1,0,0]=3 26919 B18R2.32674 Fc1ccccc1CNCc2ccccc2Br 34a_100000174869_100000184730 [0,2,0,0,0,0|1,0,0]=3 26920 B18R2.32674 Fc1ccccc1CNCc2ccccc2Br 34a_100000689332_100000211605 [0,2,0,0,0,0|1,0,0]=3 26921 B18R2.32674 Fc1ccccc1CNCc2ccccc2Cl 207a_100000174869_100000210073 [0,2,0,0,0,0|1,0,0]=3 26922 B18R2.32674 Fc1ccccc1CNCc2ccccc2Cl 207a_100000174879_100000210811 [0,2,0,0,0,0|1,0,0]=3 26923 B18R2.32674 Fc1ccccc1CNCc2ccccc2Cl 2230a_100000174879_100000211605 [0,2,0,0,0,0|1,0,0]=3 26924 B18R2.32674 Fc1ccccc1CNCc2ccccc2Cl 270004a_100000174869_100000210073 [0,2,0,0,0,0|1,0,0]=3 26925 B18R2.32674 Fc1ccccc1CNCc2ccccc2Cl 270004a_100000174879_100000210811 [0,2,0,0,0,0|1,0,0]=3 26926 B18R2.32674 Fc1ccccc1CNCc2ccccc2Cl 34a_100000174869_100000187162 [0,2,0,0,0,0|1,0,0]=3 26927 B18R2.32674 Fc1ccccc1CNCc2ccccc2Cl 34a_100000174879_100000211605 [0,2,0,0,0,0|1,0,0]=3 26928 B18R2.32674 Fc1ccccc1CNCc2ccccc2F 207a_100000174869_100000210811 [0,2,0,0,0,0|1,0,0]=3 26929 B18R2.32674 Fc1ccccc1CNCc2ccccc2F 270004a_100000174869_100000210811 [0,2,0,0,0,0|1,0,0]=3 26930 B18R2.32674 Fc1ccccc1CNCc2ccccc2F 34a_100000174869_100000211605 [0,2,0,0,0,0|1,0,0]=3 26931 B18R2.32674 Fc1ccccc1CNCc2ccccc2I 207a_100000174869_100000010305 [0,2,0,0,0,0|1,0,0]=3 26932 B18R2.32674 Fc1ccccc1CNCc2ccccc2I 207a_100015347259_100000210811 [0,2,0,0,0,0|1,0,0]=3 26933 B18R2.32674 Fc1ccccc1CNCc2ccccc2I 270004a_100000174869_100000010305 [0,2,0,0,0,0|1,0,0]=3 26934 B18R2.32674 Fc1ccccc1CNCc2ccccc2I 270004a_100015347259_100000210811 [0,2,0,0,0,0|1,0,0]=3 26935 B18R2.32674 Fc1ccccc1CNCc2ccccc2I 34a_100000174869_100011215278 [0,2,0,0,0,0|1,0,0]=3 26936 B18R2.32674 Fc1ccccc1CNCc2cccnc2Br 2230a_100009818023_100000211605 [0,2,0,0,0,0|2,0,0]=4 26937 B18R2.32674 Fc1ccccc1CNCc2cccnc2Br 270004a_100009818023_100000210811 [0,2,0,0,0,0|2,0,0]=4 26938 B18R2.32674 Fc1ccccc1CNCc2cccnc2Br 34a_100000174869_100010140945 [0,2,0,0,0,0|2,0,0]=4 26939 B18R2.32674 Fc1ccccc1CNCc2cccnc2Br 34a_100009818023_100000211605 [0,2,0,0,0,0|2,0,0]=4 26940 B18R2.32674 Fc1ccccc1CNCc2cccnc2Cl 207a_100015189234_100000210811 [0,2,0,0,0,0|2,0,0]=4 26941 B18R2.32674 Fc1ccccc1CNCc2cccnc2Cl 2230a_100015189234_100000211605 [0,2,0,0,0,0|2,0,0]=4 26942 B18R2.32674 Fc1ccccc1CNCc2cccnc2Cl 34a_100000174869_100000045678 [0,2,0,0,0,0|2,0,0]=4 26943 B18R2.32674 Fc1ccccc1CNCc2cccnc2Cl 34a_100015189234_100000211605 [0,2,0,0,0,0|2,0,0]=4 26944 B18R2.32674 Fc1ccccc1CNCc2cccnc2F 270004a_100000724633_100000210811 [0,2,0,0,0,0|2,0,0]=4 26945 B18R2.32674 Fc1ccccc1CNCc2cccnc2F 34a_100000174869_100000099810 [0,2,0,0,0,0|2,0,0]=4 26946 B18R2.32674 Fc1ccccc1CNCc2cccnc2F 34a_100000724633_100000211605 [0,2,0,0,0,0|2,0,0]=4 26947 B18R2.32674 Fc1ccccc1CNCc2ccncc2Br 207a_100020640021_100000210811 [0,2,0,0,0,0|2,0,0]=4 26948 B18R2.32674 Fc1ccccc1CNCc2ccncc2Br 270004a_100000174869_100000755692 [0,2,0,0,0,0|2,0,0]=4 26949 B18R2.32674 Fc1ccccc1CNCc2ccncc2Br 270004a_100020640021_100000210811 [0,2,0,0,0,0|2,0,0]=4 26950 B18R2.32674 Fc1ccccc1CNCc2ccncc2Cl 207a_100000174869_100011934409 [0,2,0,0,0,0|2,0,0]=4 26951 B18R2.32674 Fc1ccccc1CNCc2ccncc2Cl 270004a_100000174869_100011934409 [0,2,0,0,0,0|2,0,0]=4 26952 B18R2.32674 Fc1ccccc1CNCc2ccncc2F 207a_100011935246_100000210811 [0,2,0,0,0,0|2,0,0]=4 26953 B18R2.32674 Fc1ccccc1CNCc2ccncc2F 270004a_100011935246_100000210811 [0,2,0,0,0,0|2,0,0]=4 26954 B18R2.32674 Fc1ccccc1CNCc2ccncc2F 34a_100011935246_100000211605 [0,2,0,0,0,0|2,0,0]=4 26955 B18R2.32674 Fc1ccccc1CNCc2cnccc2Br 270004a_100000174869_100009816821 [0,2,0,0,0,0|2,0,0]=4 26956 B18R2.32674 Fc1ccccc1CNCc2cnccc2Cl 270004a_100000174869_100000050567 [0,2,0,0,0,0|2,0,0]=4 26957 B18R2.32674 Fc1ccccc1CNCc2ncccc2Br 207a_100000174869_100011934733 [0,2,0,0,0,0|2,0,0]=4 26958 B18R2.32674 Fc1ccccc1CNCc2ncccc2Br 270004a_100000174869_100011934733 [0,2,0,0,0,0|2,0,0]=4 26959 B18R2.32674 Fc1ccccc1CNCc2ncccc2Br 270004a_100020591323_100000210811 [0,2,0,0,0,0|2,0,0]=4 26960 B18R2.32674 Fc1ccccc1CNCc2ncccc2Br 34a_100000174869_100025702911 [0,2,0,0,0,0|2,0,0]=4 26961 B18R2.32674 Fc1ccccc1CNCc2ncccc2Cl 207a_100000174869_100012001307 [0,2,0,0,0,0|2,0,0]=4 26962 B18R2.32674 Fc1ccccc1CNCc2ncccc2Cl 2230a_100015189233_100000211605 [0,2,0,0,0,0|2,0,0]=4 26963 B18R2.32674 Fc1ccccc1CNCc2ncccc2Cl 270004a_100000174869_100012001307 [0,2,0,0,0,0|2,0,0]=4 26964 B18R2.32674 Fc1ccccc1CNCc2ncccc2Cl 270004a_100015189233_100000210811 [0,2,0,0,0,0|2,0,0]=4 26965 B18R2.32674 Fc1ccccc1CNCc2ncccc2F 207a_100000174869_100011934734 [0,2,0,0,0,0|2,0,0]=4 26966 B18R2.32674 Fc1ccccc1CNCc2ncccc2F 270004a_100000174869_100011934734 [0,2,0,0,0,0|2,0,0]=4 26967 B18R2.32674 Fc1ccccc1CNCc2ncccc2F 270004a_100000690088_100000210811 [0,2,0,0,0,0|2,0,0]=4 26968 B18R2.32674 Fc1ccccc1CNCc2ncccc2F 34a_100000174869_100000104219 [0,2,0,0,0,0|2,0,0]=4 26969 B18R2.32674 Fc1ccccc1CNCc2ncccc2F 34a_100000690088_100000211605 [0,2,0,0,0,0|2,0,0]=4 26970 B18R2.32674 Fc1ccccc1COCc2ccccc2Br 34a_100000211962_100000184730 [0,2,0,0,0,0|0,0,0]=2 26971 B18R2.32674 Fc1ccccc1COCc2ccccc2Br 34a_100000756307_100000211605 [0,2,0,0,0,0|0,0,0]=2 26972 B18R2.32674 Fc1ccccc1COCc2ccccc2Br 7a_100000211962_100000184730 [0,2,0,0,0,0|0,0,0]=2 26973 B18R2.32674 Fc1ccccc1COCc2ccccc2Br 7a_100000756307_100000211605 [0,2,0,0,0,0|0,0,0]=2 26974 B18R2.32674 Fc1ccccc1COCc2ccccc2Cl 34a_100000210847_100000211605 [0,2,0,0,0,0|0,0,0]=2 26975 B18R2.32674 Fc1ccccc1COCc2ccccc2Cl 34a_100000211962_100000187162 [0,2,0,0,0,0|0,0,0]=2 26976 B18R2.32674 Fc1ccccc1COCc2ccccc2Cl 7a_100000210847_100000211605 [0,2,0,0,0,0|0,0,0]=2 26977 B18R2.32674 Fc1ccccc1COCc2ccccc2Cl 7a_100000211962_100000187162 [0,2,0,0,0,0|0,0,0]=2 26978 B18R2.32674 Fc1ccccc1COCc2ccccc2F 34a_100000211962_100000211605 [0,2,0,0,0,0|0,0,0]=2 26979 B18R2.32674 Fc1ccccc1COCc2ccccc2F 7a_100000211962_100000211605 [0,2,0,0,0,0|0,0,0]=2 26980 B18R2.32674 Fc1ccccc1COCc2ccccc2I 34a_100000187465_100000211605 [0,2,0,0,0,0|0,0,0]=2 26981 B18R2.32674 Fc1ccccc1COCc2ccccc2I 34a_100000211962_100011215278 [0,2,0,0,0,0|0,0,0]=2 26982 B18R2.32674 Fc1ccccc1COCc2ccccc2I 7a_100000187465_100000211605 [0,2,0,0,0,0|0,0,0]=2 26983 B18R2.32674 Fc1ccccc1COCc2ccccc2I 7a_100000211962_100011215278 [0,2,0,0,0,0|0,0,0]=2 26984 B18R2.32674 Fc1ccccc1COCc2cccnc2Br 34a_100000211962_100010140945 [0,2,0,0,0,0|1,0,0]=3 26985 B18R2.32674 Fc1ccccc1COCc2cccnc2Br 34a_100000719692_100000211605 [0,2,0,0,0,0|1,0,0]=3 26986 B18R2.32674 Fc1ccccc1COCc2cccnc2Br 7a_100000211962_100010140945 [0,2,0,0,0,0|1,0,0]=3 26987 B18R2.32674 Fc1ccccc1COCc2cccnc2Br 7a_100000719692_100000211605 [0,2,0,0,0,0|1,0,0]=3 26988 B18R2.32674 Fc1ccccc1COCc2cccnc2Cl 34a_100000211962_100000045678 [0,2,0,0,0,0|1,0,0]=3 26989 B18R2.32674 Fc1ccccc1COCc2cccnc2Cl 34a_100000748726_100000211605 [0,2,0,0,0,0|1,0,0]=3 26990 B18R2.32674 Fc1ccccc1COCc2cccnc2Cl 7a_100000211962_100000045678 [0,2,0,0,0,0|1,0,0]=3 26991 B18R2.32674 Fc1ccccc1COCc2cccnc2Cl 7a_100000748726_100000211605 [0,2,0,0,0,0|1,0,0]=3 26992 B18R2.32674 Fc1ccccc1COCc2cccnc2F 34a_100000079888_100000211605 [0,2,0,0,0,0|1,0,0]=3 26993 B18R2.32674 Fc1ccccc1COCc2cccnc2F 34a_100000211962_100000099810 [0,2,0,0,0,0|1,0,0]=3 26994 B18R2.32674 Fc1ccccc1COCc2cccnc2F 7a_100000079888_100000211605 [0,2,0,0,0,0|1,0,0]=3 26995 B18R2.32674 Fc1ccccc1COCc2cccnc2F 7a_100000211962_100000099810 [0,2,0,0,0,0|1,0,0]=3 26996 B18R2.32674 Fc1ccccc1COCc2ccncc2Cl 7a_100000211962_100000763264 [0,2,0,0,0,0|1,0,0]=3 26997 B18R2.32674 Fc1ccccc1COCc2ccncc2F 34a_100012172863_100000211605 [0,2,0,0,0,0|1,0,0]=3 26998 B18R2.32674 Fc1ccccc1COCc2cnccc2Cl 34a_100000117392_100000211605 [0,2,0,0,0,0|1,0,0]=3 26999 B18R2.32674 Fc1ccccc1COCc2ncccc2Br 34a_100000211962_100025702911 [0,2,0,0,0,0|1,0,0]=3 27000 B18R2.32674 Fc1ccccc1COCc2ncccc2Br 34a_100011996772_100000211605 [0,2,0,0,0,0|1,0,0]=3 27001 B18R2.32674 Fc1ccccc1COCc2ncccc2Br 7a_100000211962_100025702911 [0,2,0,0,0,0|1,0,0]=3 27002 B18R2.32674 Fc1ccccc1COCc2ncccc2Cl 34a_100012002383_100000211605 [0,2,0,0,0,0|1,0,0]=3 27003 B18R2.32674 Fc1ccccc1COCc2ncccc2Cl 7a_100000211962_100000099807 [0,2,0,0,0,0|1,0,0]=3 27004 B18R2.32674 Fc1ccccc1COCc2ncccc2F 34a_100000211962_100000104219 [0,2,0,0,0,0|1,0,0]=3 27005 B18R2.32674 Fc1ccccc1COCc2ncccc2F 34a_100011934865_100000211605 [0,2,0,0,0,0|1,0,0]=3 27006 B18R2.32674 Fc1ccccc1COCc2ncccc2F 7a_100000211962_100000104219 [0,2,0,0,0,0|1,0,0]=3 27007 B18R2.32674 Fc1ccccc1COCc2nccnc2Cl 34a_100000057004_100000211605 [0,2,0,0,0,0|2,0,0]=4 27008 B18R2.32674 Fc1ccccc1CSCc2ccccc2Br 62a_100000184730_100000211605 [0,2,0,0,0,0|0,1,0]=3 27009 B18R2.32674 Fc1ccccc1CSCc2ccccc2Br 62a_100000211605_100000184730 [0,2,0,0,0,0|0,1,0]=3 27010 B18R2.32674 Fc1ccccc1CSCc2ccccc2Cl 62a_100000187162_100000211605 [0,2,0,0,0,0|0,1,0]=3 27011 B18R2.32674 Fc1ccccc1CSCc2ccccc2Cl 62a_100000211605_100000187162 [0,2,0,0,0,0|0,1,0]=3 27012 B18R2.32674 Fc1ccccc1CSCc2ccccc2F 62a_100000211605_100000211605 [0,2,0,0,0,0|0,1,0]=3 27013 B18R2.32674 Fc1ccccc1CSCc2ccccc2I 62a_100000211605_100011216222 [0,2,0,0,0,0|0,1,0]=3 27014 B18R2.32674 Fc1ccccc1CSCc2ccccc2I 62a_100011216222_100000211605 [0,2,0,0,0,0|0,1,0]=3 27015 B18R2.32674 Fc1ccccc1CSCc2cccnc2Br 62a_100000211605_100010140945 [0,2,0,0,0,0|1,1,0]=4 27016 B18R2.32674 Fc1ccccc1CSCc2cccnc2Br 62a_100010140945_100000211605 [0,2,0,0,0,0|1,1,0]=4 27017 B18R2.32674 Fc1ccccc1CSCc2cccnc2Cl 62a_100000045678_100000211605 [0,2,0,0,0,0|1,1,0]=4 27018 B18R2.32674 Fc1ccccc1CSCc2cccnc2Cl 62a_100000211605_100000045678 [0,2,0,0,0,0|1,1,0]=4 27019 B18R2.32674 Fc1ccccc1CSCc2cccnc2F 62a_100000099810_100000211605 [0,2,0,0,0,0|1,1,0]=4 27020 B18R2.32674 Fc1ccccc1CSCc2cccnc2F 62a_100000211605_100000099810 [0,2,0,0,0,0|1,1,0]=4 27021 B18R2.32674 Fc1ccccc1CSCc2ccncc2Cl 62a_100000211605_100000763264 [0,2,0,0,0,0|1,1,0]=4 27022 B18R2.32674 Fc1ccccc1CSCc2ccncc2Cl 62a_100000763264_100000211605 [0,2,0,0,0,0|1,1,0]=4 27023 B18R2.32674 Fc1ccccc1CSCc2ncccc2Br 62a_100000211605_100025702911 [0,2,0,0,0,0|1,1,0]=4 27024 B18R2.32674 Fc1ccccc1CSCc2ncccc2Br 62a_100025702911_100000211605 [0,2,0,0,0,0|1,1,0]=4 27025 B18R2.32674 Fc1ccccc1CSCc2ncccc2Cl 62a_100000099807_100000211605 [0,2,0,0,0,0|1,1,0]=4 27026 B18R2.32674 Fc1ccccc1CSCc2ncccc2Cl 62a_100000211605_100000099807 [0,2,0,0,0,0|1,1,0]=4 27027 B18R2.32674 Fc1ccccc1CSCc2ncccc2F 62a_100000104219_100000211605 [0,2,0,0,0,0|1,1,0]=4 27028 B18R2.32674 Fc1ccccc1CSCc2ncccc2F 62a_100000211605_100000104219 [0,2,0,0,0,0|1,1,0]=4 27029 B18R2.32674 Fc1ccccc1NCCc2ccccc2Br 34a_100000210422_100012161201 [0,2,0,0,0,0|2,0,0]=4 27030 B18R2.32674 Fc1ccccc1NCCc2ccccc2Cl 34a_100000210422_100011713703 [0,2,0,0,0,0|2,0,0]=4 27031 B18R2.32674 Fc1ccccc1OCCc2ccccc2Br 34a_100000210171_100012161201 [0,2,0,0,0,0|2,0,0]=4 27032 B18R2.32674 Fc1ccccc1OCCc2ccccc2Br 7a_100000210171_100012161201 [0,2,0,0,0,0|2,0,0]=4 27033 B18R2.32674 Fc1ccccc1OCCc2ccccc2Cl 34a_100000210171_100011713703 [0,2,0,0,0,0|2,0,0]=4 27034 B18R2.32674 Fc1ccccc1OCCc2ccccc2Cl 7a_100000210171_100011713703 [0,2,0,0,0,0|2,0,0]=4 27035 B18R2.32674 Fc1ccccc1SCCc2ccccc2Br 62a_100011215700_100012161201 [0,2,0,0,0,0|2,0,0]=4 27036 B18R2.32674 Fc1ccccc1SCCc2ccccc2Br 62a_100012161201_100011215700 [0,2,0,0,0,0|2,0,0]=4 27037 B18R2.32674 Fc1ccccc1SCCc2ccccc2Cl 62a_100011215700_100011713703 [0,2,0,0,0,0|2,0,0]=4 27038 B18R2.32674 Fc1ccccc1SCCc2ccccc2Cl 62a_100011713703_100011215700 [0,2,0,0,0,0|2,0,0]=4 27039 B18R2.32674 Fc1cccnc1CNCc2ccccc2Br 207a_100000689332_100011934734 [0,2,0,0,0,0|2,0,0]=4 27040 B18R2.32674 Fc1cccnc1CNCc2ccccc2Br 2230a_100000689332_100000104219 [0,2,0,0,0,0|2,0,0]=4 27041 B18R2.32674 Fc1cccnc1CNCc2ccccc2Br 270004a_100000689332_100011934734 [0,2,0,0,0,0|2,0,0]=4 27042 B18R2.32674 Fc1cccnc1CNCc2ccccc2Br 270004a_100000690088_100000211189 [0,2,0,0,0,0|2,0,0]=4 27043 B18R2.32674 Fc1cccnc1CNCc2ccccc2Br 34a_100000689332_100000104219 [0,2,0,0,0,0|2,0,0]=4 27044 B18R2.32674 Fc1cccnc1CNCc2ccccc2Br 34a_100000690088_100000184730 [0,2,0,0,0,0|2,0,0]=4 27045 B18R2.32674 Fc1cccnc1CNCc2ccccc2Cl 207a_100000174879_100011934734 [0,2,0,0,0,0|2,0,0]=4 27046 B18R2.32674 Fc1cccnc1CNCc2ccccc2Cl 2230a_100000174879_100000104219 [0,2,0,0,0,0|2,0,0]=4 27047 B18R2.32674 Fc1cccnc1CNCc2ccccc2Cl 270004a_100000174879_100011934734 [0,2,0,0,0,0|2,0,0]=4 27048 B18R2.32674 Fc1cccnc1CNCc2ccccc2Cl 270004a_100000690088_100000210073 [0,2,0,0,0,0|2,0,0]=4 27049 B18R2.32674 Fc1cccnc1CNCc2ccccc2Cl 34a_100000174879_100000104219 [0,2,0,0,0,0|2,0,0]=4 27050 B18R2.32674 Fc1cccnc1CNCc2ccccc2Cl 34a_100000690088_100000187162 [0,2,0,0,0,0|2,0,0]=4 27051 B18R2.32674 Fc1cccnc1CNCc2ccccc2I 207a_100015347259_100011934734 [0,2,0,0,0,0|2,0,0]=4 27052 B18R2.32674 Fc1cccnc1CNCc2ccccc2I 270004a_100000690088_100000010305 [0,2,0,0,0,0|2,0,0]=4 27053 B18R2.32674 Fc1cccnc1CNCc2ccccc2I 270004a_100015347259_100011934734 [0,2,0,0,0,0|2,0,0]=4 27054 B18R2.32674 Fc1cccnc1CNCc2ccccc2I 34a_100000690088_100011215278 [0,2,0,0,0,0|2,0,0]=4 27055 B18R2.32674 Fc1cccnc1COCc2ccccc2Br 34a_100000756307_100000104219 [0,2,0,0,0,0|1,0,0]=3 27056 B18R2.32674 Fc1cccnc1COCc2ccccc2Br 34a_100011934865_100000184730 [0,2,0,0,0,0|1,0,0]=3 27057 B18R2.32674 Fc1cccnc1COCc2ccccc2Br 7a_100000756307_100000104219 [0,2,0,0,0,0|1,0,0]=3 27058 B18R2.32674 Fc1cccnc1COCc2ccccc2Cl 34a_100000210847_100000104219 [0,2,0,0,0,0|1,0,0]=3 27059 B18R2.32674 Fc1cccnc1COCc2ccccc2Cl 34a_100011934865_100000187162 [0,2,0,0,0,0|1,0,0]=3 27060 B18R2.32674 Fc1cccnc1COCc2ccccc2Cl 7a_100000210847_100000104219 [0,2,0,0,0,0|1,0,0]=3 27061 B18R2.32674 Fc1cccnc1COCc2ccccc2I 34a_100000187465_100000104219 [0,2,0,0,0,0|1,0,0]=3 27062 B18R2.32674 Fc1cccnc1COCc2ccccc2I 34a_100011934865_100011215278 [0,2,0,0,0,0|1,0,0]=3 27063 B18R2.32674 Fc1cccnc1COCc2ccccc2I 7a_100000187465_100000104219 [0,2,0,0,0,0|1,0,0]=3 27064 B18R2.32674 Fc1cccnc1COCc2cccnc2Br 34a_100000719692_100000104219 [0,2,0,0,0,0|2,0,0]=4 27065 B18R2.32674 Fc1cccnc1COCc2cccnc2Br 34a_100011934865_100010140945 [0,2,0,0,0,0|2,0,0]=4 27066 B18R2.32674 Fc1cccnc1COCc2cccnc2Br 7a_100000719692_100000104219 [0,2,0,0,0,0|2,0,0]=4 27067 B18R2.32674 Fc1cccnc1COCc2cccnc2Cl 34a_100000748726_100000104219 [0,2,0,0,0,0|2,0,0]=4 27068 B18R2.32674 Fc1cccnc1COCc2cccnc2Cl 34a_100011934865_100000045678 [0,2,0,0,0,0|2,0,0]=4 27069 B18R2.32674 Fc1cccnc1COCc2cccnc2Cl 7a_100000748726_100000104219 [0,2,0,0,0,0|2,0,0]=4 27070 B18R2.32674 Fc1cccnc1COCc2cccnc2F 34a_100000079888_100000104219 [0,2,0,0,0,0|2,0,0]=4 27071 B18R2.32674 Fc1cccnc1COCc2cccnc2F 34a_100011934865_100000099810 [0,2,0,0,0,0|2,0,0]=4 27072 B18R2.32674 Fc1cccnc1COCc2cccnc2F 7a_100000079888_100000104219 [0,2,0,0,0,0|2,0,0]=4 27073 B18R2.32674 Fc1cccnc1COCc2cnccc2Cl 34a_100000117392_100000104219 [0,2,0,0,0,0|2,0,0]=4 27074 B18R2.32674 Fc1cccnc1COCc2ncccc2Br 34a_100011934865_100025702911 [0,2,0,0,0,0|2,0,0]=4 27075 B18R2.32674 Fc1cccnc1COCc2ncccc2Br 34a_100011996772_100000104219 [0,2,0,0,0,0|2,0,0]=4 27076 B18R2.32674 Fc1cccnc1COCc2ncccc2Cl 34a_100012002383_100000104219 [0,2,0,0,0,0|2,0,0]=4 27077 B18R2.32674 Fc1cccnc1COCc2ncccc2F 34a_100011934865_100000104219 [0,2,0,0,0,0|2,0,0]=4 27078 B18R2.32674 Fc1cccnc1CSCc2ccccc2Br 62a_100000104219_100000184730 [0,2,0,0,0,0|1,1,0]=4 27079 B18R2.32674 Fc1cccnc1CSCc2ccccc2Br 62a_100000184730_100000104219 [0,2,0,0,0,0|1,1,0]=4 27080 B18R2.32674 Fc1cccnc1CSCc2ccccc2Cl 62a_100000104219_100000187162 [0,2,0,0,0,0|1,1,0]=4 27081 B18R2.32674 Fc1cccnc1CSCc2ccccc2Cl 62a_100000187162_100000104219 [0,2,0,0,0,0|1,1,0]=4 27082 B18R2.32674 Fc1cccnc1CSCc2ccccc2I 62a_100000104219_100011216222 [0,2,0,0,0,0|1,1,0]=4 27083 B18R2.32674 Fc1cccnc1CSCc2ccccc2I 62a_100011216222_100000104219 [0,2,0,0,0,0|1,1,0]=4 27084 B18R2.32674 Fc1cnccc1CNCc2ccccc2Br 207a_100011935246_100000211189 [0,2,0,0,0,0|2,0,0]=4 27085 B18R2.32674 Fc1cnccc1CNCc2ccccc2Br 270004a_100011935246_100000211189 [0,2,0,0,0,0|2,0,0]=4 27086 B18R2.32674 Fc1cnccc1CNCc2ccccc2Br 34a_100011935246_100000184730 [0,2,0,0,0,0|2,0,0]=4 27087 B18R2.32674 Fc1cnccc1CNCc2ccccc2Cl 207a_100011935246_100000210073 [0,2,0,0,0,0|2,0,0]=4 27088 B18R2.32674 Fc1cnccc1CNCc2ccccc2Cl 270004a_100011935246_100000210073 [0,2,0,0,0,0|2,0,0]=4 27089 B18R2.32674 Fc1cnccc1CNCc2ccccc2Cl 34a_100011935246_100000187162 [0,2,0,0,0,0|2,0,0]=4 27090 B18R2.32674 Fc1cnccc1CNCc2ccccc2I 207a_100011935246_100000010305 [0,2,0,0,0,0|2,0,0]=4 27091 B18R2.32674 Fc1cnccc1CNCc2ccccc2I 270004a_100011935246_100000010305 [0,2,0,0,0,0|2,0,0]=4 27092 B18R2.32674 Fc1cnccc1CNCc2ccccc2I 34a_100011935246_100011215278 [0,2,0,0,0,0|2,0,0]=4 27093 B18R2.32674 Fc1cnccc1COCc2ccccc2Br 34a_100012172863_100000184730 [0,2,0,0,0,0|1,0,0]=3 27094 B18R2.32674 Fc1cnccc1COCc2ccccc2Cl 34a_100012172863_100000187162 [0,2,0,0,0,0|1,0,0]=3 27095 B18R2.32674 Fc1cnccc1COCc2ccccc2I 34a_100012172863_100011215278 [0,2,0,0,0,0|1,0,0]=3 27096 B18R2.32674 Fc1cnccc1COCc2cccnc2Br 34a_100012172863_100010140945 [0,2,0,0,0,0|2,0,0]=4 27097 B18R2.32674 Fc1cnccc1COCc2cccnc2Cl 34a_100012172863_100000045678 [0,2,0,0,0,0|2,0,0]=4 27098 B18R2.32674 Fc1cnccc1COCc2cccnc2F 34a_100012172863_100000099810 [0,2,0,0,0,0|2,0,0]=4 27099 B18R2.32674 Fc1cnccc1COCc2ncccc2Br 34a_100012172863_100025702911 [0,2,0,0,0,0|2,0,0]=4 27100 B18R2.32674 Fc1cnccc1COCc2ncccc2F 34a_100012172863_100000104219 [0,2,0,0,0,0|2,0,0]=4 27101 B18R2.32674 Fc1ncccc1CNCc2ccccc2Br 2230a_100000689332_100000099810 [0,2,0,0,0,0|2,0,0]=4 27102 B18R2.32674 Fc1ncccc1CNCc2ccccc2Br 270004a_100000724633_100000211189 [0,2,0,0,0,0|2,0,0]=4 27103 B18R2.32674 Fc1ncccc1CNCc2ccccc2Br 34a_100000689332_100000099810 [0,2,0,0,0,0|2,0,0]=4 27104 B18R2.32674 Fc1ncccc1CNCc2ccccc2Br 34a_100000724633_100000184730 [0,2,0,0,0,0|2,0,0]=4 27105 B18R2.32674 Fc1ncccc1CNCc2ccccc2Cl 2230a_100000174879_100000099810 [0,2,0,0,0,0|2,0,0]=4 27106 B18R2.32674 Fc1ncccc1CNCc2ccccc2Cl 270004a_100000724633_100000210073 [0,2,0,0,0,0|2,0,0]=4 27107 B18R2.32674 Fc1ncccc1CNCc2ccccc2Cl 34a_100000174879_100000099810 [0,2,0,0,0,0|2,0,0]=4 27108 B18R2.32674 Fc1ncccc1CNCc2ccccc2Cl 34a_100000724633_100000187162 [0,2,0,0,0,0|2,0,0]=4 27109 B18R2.32674 Fc1ncccc1CNCc2ccccc2I 270004a_100000724633_100000010305 [0,2,0,0,0,0|2,0,0]=4 27110 B18R2.32674 Fc1ncccc1CNCc2ccccc2I 34a_100000724633_100011215278 [0,2,0,0,0,0|2,0,0]=4 27111 B18R2.32674 Fc1ncccc1COCc2ccccc2Br 34a_100000079888_100000184730 [0,2,0,0,0,0|1,0,0]=3 27112 B18R2.32674 Fc1ncccc1COCc2ccccc2Br 34a_100000756307_100000099810 [0,2,0,0,0,0|1,0,0]=3 27113 B18R2.32674 Fc1ncccc1COCc2ccccc2Br 7a_100000079888_100000184730 [0,2,0,0,0,0|1,0,0]=3 27114 B18R2.32674 Fc1ncccc1COCc2ccccc2Br 7a_100000756307_100000099810 [0,2,0,0,0,0|1,0,0]=3 27115 B18R2.32674 Fc1ncccc1COCc2ccccc2Cl 34a_100000079888_100000187162 [0,2,0,0,0,0|1,0,0]=3 27116 B18R2.32674 Fc1ncccc1COCc2ccccc2Cl 34a_100000210847_100000099810 [0,2,0,0,0,0|1,0,0]=3 27117 B18R2.32674 Fc1ncccc1COCc2ccccc2Cl 7a_100000079888_100000187162 [0,2,0,0,0,0|1,0,0]=3 27118 B18R2.32674 Fc1ncccc1COCc2ccccc2Cl 7a_100000210847_100000099810 [0,2,0,0,0,0|1,0,0]=3 27119 B18R2.32674 Fc1ncccc1COCc2ccccc2I 34a_100000079888_100011215278 [0,2,0,0,0,0|1,0,0]=3 27120 B18R2.32674 Fc1ncccc1COCc2ccccc2I 34a_100000187465_100000099810 [0,2,0,0,0,0|1,0,0]=3 27121 B18R2.32674 Fc1ncccc1COCc2ccccc2I 7a_100000079888_100011215278 [0,2,0,0,0,0|1,0,0]=3 27122 B18R2.32674 Fc1ncccc1COCc2ccccc2I 7a_100000187465_100000099810 [0,2,0,0,0,0|1,0,0]=3 27123 B18R2.32674 Fc1ncccc1COCc2cccnc2Br 34a_100000079888_100010140945 [0,2,0,0,0,0|2,0,0]=4 27124 B18R2.32674 Fc1ncccc1COCc2cccnc2Br 34a_100000719692_100000099810 [0,2,0,0,0,0|2,0,0]=4 27125 B18R2.32674 Fc1ncccc1COCc2cccnc2Br 7a_100000079888_100010140945 [0,2,0,0,0,0|2,0,0]=4 27126 B18R2.32674 Fc1ncccc1COCc2cccnc2Br 7a_100000719692_100000099810 [0,2,0,0,0,0|2,0,0]=4 27127 B18R2.32674 Fc1ncccc1COCc2cccnc2Cl 34a_100000079888_100000045678 [0,2,0,0,0,0|2,0,0]=4 27128 B18R2.32674 Fc1ncccc1COCc2cccnc2Cl 34a_100000748726_100000099810 [0,2,0,0,0,0|2,0,0]=4 27129 B18R2.32674 Fc1ncccc1COCc2cccnc2Cl 7a_100000079888_100000045678 [0,2,0,0,0,0|2,0,0]=4 27130 B18R2.32674 Fc1ncccc1COCc2cccnc2Cl 7a_100000748726_100000099810 [0,2,0,0,0,0|2,0,0]=4 27131 B18R2.32674 Fc1ncccc1COCc2cccnc2F 34a_100000079888_100000099810 [0,2,0,0,0,0|2,0,0]=4 27132 B18R2.32674 Fc1ncccc1COCc2cccnc2F 7a_100000079888_100000099810 [0,2,0,0,0,0|2,0,0]=4 27133 B18R2.32674 Fc1ncccc1COCc2ccncc2Cl 7a_100000079888_100000763264 [0,2,0,0,0,0|2,0,0]=4 27134 B18R2.32674 Fc1ncccc1COCc2cnccc2Cl 34a_100000117392_100000099810 [0,2,0,0,0,0|2,0,0]=4 27135 B18R2.32674 Fc1ncccc1COCc2ncccc2Br 34a_100000079888_100025702911 [0,2,0,0,0,0|2,0,0]=4 27136 B18R2.32674 Fc1ncccc1COCc2ncccc2Br 34a_100011996772_100000099810 [0,2,0,0,0,0|2,0,0]=4 27137 B18R2.32674 Fc1ncccc1COCc2ncccc2Br 7a_100000079888_100025702911 [0,2,0,0,0,0|2,0,0]=4 27138 B18R2.32674 Fc1ncccc1COCc2ncccc2Cl 34a_100012002383_100000099810 [0,2,0,0,0,0|2,0,0]=4 27139 B18R2.32674 Fc1ncccc1COCc2ncccc2Cl 7a_100000079888_100000099807 [0,2,0,0,0,0|2,0,0]=4 27140 B18R2.32674 Fc1ncccc1CSCc2ccccc2Br 62a_100000099810_100000184730 [0,2,0,0,0,0|1,1,0]=4 27141 B18R2.32674 Fc1ncccc1CSCc2ccccc2Br 62a_100000184730_100000099810 [0,2,0,0,0,0|1,1,0]=4 27142 B18R2.32674 Fc1ncccc1CSCc2ccccc2Cl 62a_100000099810_100000187162 [0,2,0,0,0,0|1,1,0]=4 27143 B18R2.32674 Fc1ncccc1CSCc2ccccc2Cl 62a_100000187162_100000099810 [0,2,0,0,0,0|1,1,0]=4 27144 B18R2.32674 Fc1ncccc1CSCc2ccccc2I 62a_100000099810_100011216222 [0,2,0,0,0,0|1,1,0]=4 27145 B18R2.32674 Fc1ncccc1CSCc2ccccc2I 62a_100011216222_100000099810 [0,2,0,0,0,0|1,1,0]=4 27146 B18R2.32674 Ic1ccccc1CNCc2ccccc2I 207a_100015347259_100000010305 [0,2,0,0,0,0|1,0,0]=3 27147 B18R2.32674 Ic1ccccc1CNCc2ccccc2I 270004a_100015347259_100000010305 [0,2,0,0,0,0|1,0,0]=3 27148 B18R2.32674 Ic1ccccc1COCc2ccccc2I 34a_100000187465_100011215278 [0,2,0,0,0,0|0,0,0]=2 27149 B18R2.32674 Ic1ccccc1COCc2ccccc2I 7a_100000187465_100011215278 [0,2,0,0,0,0|0,0,0]=2 27150 B18R2.32674 Ic1ccccc1CSCc2ccccc2I 62a_100011216222_100011216222 [0,2,0,0,0,0|0,1,0]=3 27151 B18R2.32674 Nc1ccccc1COCc2ccccc2Br 34a_100000212039_100000184730 [0,2,0,0,0,0|0,0,0]=2 27152 B18R2.32674 Nc1ccccc1COCc2ccccc2Cl 34a_100000212039_100000187162 [0,2,0,0,0,0|0,0,0]=2 27153 B18R2.32674 Nc1ccccc1COCc2ccccc2F 34a_100000212039_100000211605 [0,2,0,0,0,0|0,0,0]=2 27154 B18R2.32674 Nc1ccccc1COCc2ccccc2I 34a_100000212039_100011215278 [0,2,0,0,0,0|0,0,0]=2 27155 B18R2.32674 Nc1ccccc1COCc2cccnc2Br 34a_100000212039_100010140945 [0,2,0,0,0,0|1,0,0]=3 27156 B18R2.32674 Nc1ccccc1COCc2cccnc2Cl 34a_100000212039_100000045678 [0,2,0,0,0,0|1,0,0]=3 27157 B18R2.32674 Nc1ccccc1COCc2cccnc2F 34a_100000212039_100000099810 [0,2,0,0,0,0|1,0,0]=3 27158 B18R2.32674 Nc1ccccc1COCc2ncccc2Br 34a_100000212039_100025702911 [0,2,0,0,0,0|1,0,0]=3 27159 B18R2.32674 Nc1ccccc1COCc2ncccc2F 34a_100000212039_100000104219 [0,2,0,0,0,0|1,0,0]=3 27160 B18R2.32674 Nc1ccccc1COCc2ncccc2O 34a_100000212039_200020655725 [0,2,0,0,0,0|1,0,0]=3 27161 B18R2.32674 Nc1ccccc1OCCc2ccccc2Br 34a_100000185747_100012161201 [0,2,0,0,0,0|2,0,0]=4 27162 B18R2.32674 Nc1ccccc1OCCc2ccccc2Br 7a_100000185747_100012161201 [0,2,0,0,0,0|2,0,0]=4 27163 B18R2.32674 Nc1ccccc1OCCc2ccccc2Cl 34a_100000185747_100011713703 [0,2,0,0,0,0|2,0,0]=4 27164 B18R2.32674 Nc1ccccc1OCCc2ccccc2Cl 7a_100000185747_100011713703 [0,2,0,0,0,0|2,0,0]=4 27165 B18R2.32674 Nc1ccccc1OCCc2ccccc2F 34a_100000185747_100000720011 [0,2,0,0,0,0|2,0,0]=4 27166 B18R2.32674 Nc1ccccc1OCCc2ccccc2F 7a_100000185747_100000720011 [0,2,0,0,0,0|2,0,0]=4 27167 B18R2.32674 Nc1ccccc1OCCc2ccccc2O 34a_100000185747_100000722297 [0,2,0,0,0,0|2,0,0]=4 27168 B18R2.32674 Nc1ccccc1OCCc2ccccc2O 7a_100000185747_100000722297 [0,2,0,0,0,0|2,0,0]=4 27169 B18R2.32674 Nc1ccccc1SCCc2ccccc2Br 62a_100000210017_100012161201 [0,2,0,0,0,0|2,0,0]=4 27170 B18R2.32674 Nc1ccccc1SCCc2ccccc2Br 62a_100012161201_100000210017 [0,2,0,0,0,0|2,0,0]=4 27171 B18R2.32674 Nc1ccccc1SCCc2ccccc2Cl 62a_100000210017_100011713703 [0,2,0,0,0,0|2,0,0]=4 27172 B18R2.32674 Nc1ccccc1SCCc2ccccc2Cl 62a_100011713703_100000210017 [0,2,0,0,0,0|2,0,0]=4 27173 B18R2.32674 Nc1ccccc1SCCc2ccccc2F 62a_100000210017_100011713696 [0,2,0,0,0,0|2,0,0]=4 27174 B18R2.32674 Nc1ccccc1SCCc2ccccc2F 62a_100011713696_100000210017 [0,2,0,0,0,0|2,0,0]=4 27175 B18R2.32674 Nc1ccccc1SCCc2ccccc2O 62a_100000210017_100000722297 [0,2,0,0,0,0|2,0,0]=4 27176 B18R2.32674 Nc1ccccc1SCCc2ccccc2O 62a_100000722297_100000210017 [0,2,0,0,0,0|2,0,0]=4 27177 B18R2.32674 Nc1cccnc1COCc2ccccc2Br 34a_114873767017_100000184730 [0,2,0,0,0,0|1,0,0]=3 27178 B18R2.32674 Nc1cccnc1COCc2ccccc2Cl 34a_114873767017_100000187162 [0,2,0,0,0,0|1,0,0]=3 27179 B18R2.32674 Nc1cccnc1COCc2ccccc2F 34a_114873767017_100000211605 [0,2,0,0,0,0|1,0,0]=3 27180 B18R2.32674 Nc1cccnc1COCc2ccccc2I 34a_114873767017_100011215278 [0,2,0,0,0,0|1,0,0]=3 27181 B18R2.32674 Nc1cccnc1COCc2cccnc2Br 34a_114873767017_100010140945 [0,2,0,0,0,0|2,0,0]=4 27182 B18R2.32674 Nc1cccnc1COCc2cccnc2Cl 34a_114873767017_100000045678 [0,2,0,0,0,0|2,0,0]=4 27183 B18R2.32674 Nc1cccnc1COCc2cccnc2F 34a_114873767017_100000099810 [0,2,0,0,0,0|2,0,0]=4 27184 B18R2.32674 Nc1cccnc1COCc2ncccc2Br 34a_114873767017_100025702911 [0,2,0,0,0,0|2,0,0]=4 27185 B18R2.32674 Nc1cccnc1COCc2ncccc2F 34a_114873767017_100000104219 [0,2,0,0,0,0|2,0,0]=4 27186 B18R2.32674 Nc1cccnc1COCc2ncccc2O 34a_114873767017_200020655725 [0,2,0,0,0,0|2,0,0]=4 27187 B18R2.32674 Oc1ccccc1CCNc2ccccc2Br 34a_100000210017_100000722297 [0,2,0,0,0,0|2,0,0]=4 27188 B18R2.32674 Oc1ccccc1CCNc2ccccc2Cl 34a_100000185783_100000722297 [0,2,0,0,0,0|2,0,0]=4 27189 B18R2.32674 Oc1ccccc1CCNc2ccccc2F 34a_100000210422_100000722297 [0,2,0,0,0,0|2,0,0]=4 27190 B18R2.32674 Oc1ccccc1CCNc2ccccc2I 34a_100000210053_100000722297 [0,2,0,0,0,0|2,0,0]=4 27191 B18R2.32674 Oc1ccccc1CCNc2ccccc2O 34a_100000185747_100000722297 [0,2,0,0,0,0|2,0,0]=4 27192 B18R2.32674 Oc1ccccc1CCOc2ccccc2Br 34a_100000181306_100000722297 [0,2,0,0,0,0|2,0,0]=4 27193 B18R2.32674 Oc1ccccc1CCOc2ccccc2Br 7a_100000181306_100000722297 [0,2,0,0,0,0|2,0,0]=4 27194 B18R2.32674 Oc1ccccc1CCOc2ccccc2Cl 34a_100000210172_100000722297 [0,2,0,0,0,0|2,0,0]=4 27195 B18R2.32674 Oc1ccccc1CCOc2ccccc2Cl 7a_100000210172_100000722297 [0,2,0,0,0,0|2,0,0]=4 27196 B18R2.32674 Oc1ccccc1CCOc2ccccc2F 34a_100000210171_100000722297 [0,2,0,0,0,0|2,0,0]=4 27197 B18R2.32674 Oc1ccccc1CCOc2ccccc2F 7a_100000210171_100000722297 [0,2,0,0,0,0|2,0,0]=4 27198 B18R2.32674 Oc1ccccc1CCOc2ccccc2I 34a_100000739446_100000722297 [0,2,0,0,0,0|2,0,0]=4 27199 B18R2.32674 Oc1ccccc1CCOc2ccccc2I 7a_100000739446_100000722297 [0,2,0,0,0,0|2,0,0]=4 27200 B18R2.32674 Oc1ccccc1CCSc2ccccc2Br 62a_100000695589_100000722297 [0,2,0,0,0,0|2,0,0]=4 27201 B18R2.32674 Oc1ccccc1CCSc2ccccc2Br 62a_100000722297_100000695589 [0,2,0,0,0,0|2,0,0]=4 27202 B18R2.32674 Oc1ccccc1CCSc2ccccc2Cl 62a_100000722297_100000764095 [0,2,0,0,0,0|2,0,0]=4 27203 B18R2.32674 Oc1ccccc1CCSc2ccccc2Cl 62a_100000764095_100000722297 [0,2,0,0,0,0|2,0,0]=4 27204 B18R2.32674 Oc1ccccc1CCSc2ccccc2F 62a_100000722297_100011215700 [0,2,0,0,0,0|2,0,0]=4 27205 B18R2.32674 Oc1ccccc1CCSc2ccccc2F 62a_100011215700_100000722297 [0,2,0,0,0,0|2,0,0]=4 27206 B18R2.32674 Oc1ccccc1CCSc2ccccc2O 62a_100000722297_100000739446 [0,2,0,0,0,0|2,0,0]=4 27207 B18R2.32674 Oc1ccccc1CCSc2ccccc2O 62a_100000739446_100000722297 [0,2,0,0,0,0|2,0,0]=4 27208 B18R2.32674 Oc1ccccc1CNCc2ccccc2Br 207a_100000185550_100000211189 [0,2,0,0,0,0|1,0,0]=3 27209 B18R2.32674 Oc1ccccc1CNCc2ccccc2Br 270004a_100000185550_100000211189 [0,2,0,0,0,0|1,0,0]=3 27210 B18R2.32674 Oc1ccccc1CNCc2ccccc2Br 34a_100000185550_100000184730 [0,2,0,0,0,0|1,0,0]=3 27211 B18R2.32674 Oc1ccccc1CNCc2ccccc2Cl 207a_100000185550_100000210073 [0,2,0,0,0,0|1,0,0]=3 27212 B18R2.32674 Oc1ccccc1CNCc2ccccc2Cl 270004a_100000185550_100000210073 [0,2,0,0,0,0|1,0,0]=3 27213 B18R2.32674 Oc1ccccc1CNCc2ccccc2Cl 34a_100000185550_100000187162 [0,2,0,0,0,0|1,0,0]=3 27214 B18R2.32674 Oc1ccccc1CNCc2ccccc2F 207a_100000185550_100000210811 [0,2,0,0,0,0|1,0,0]=3 27215 B18R2.32674 Oc1ccccc1CNCc2ccccc2F 270004a_100000185550_100000210811 [0,2,0,0,0,0|1,0,0]=3 27216 B18R2.32674 Oc1ccccc1CNCc2ccccc2F 34a_100000185550_100000211605 [0,2,0,0,0,0|1,0,0]=3 27217 B18R2.32674 Oc1ccccc1CNCc2ccccc2I 207a_100000185550_100000010305 [0,2,0,0,0,0|1,0,0]=3 27218 B18R2.32674 Oc1ccccc1CNCc2ccccc2I 270004a_100000185550_100000010305 [0,2,0,0,0,0|1,0,0]=3 27219 B18R2.32674 Oc1ccccc1CNCc2ccccc2I 34a_100000185550_100011215278 [0,2,0,0,0,0|1,0,0]=3 27220 B18R2.32674 Oc1ccccc1CNCc2cccnc2Br 34a_100000185550_100010140945 [0,2,0,0,0,0|2,0,0]=4 27221 B18R2.32674 Oc1ccccc1CNCc2cccnc2Cl 34a_100000185550_100000045678 [0,2,0,0,0,0|2,0,0]=4 27222 B18R2.32674 Oc1ccccc1CNCc2cccnc2F 34a_100000185550_100000099810 [0,2,0,0,0,0|2,0,0]=4 27223 B18R2.32674 Oc1ccccc1CNCc2cccnc2O 207a_100000185550_100011998315 [0,2,0,0,0,0|2,0,0]=4 27224 B18R2.32674 Oc1ccccc1CNCc2cccnc2O 270004a_100000185550_100011998315 [0,2,0,0,0,0|2,0,0]=4 27225 B18R2.32674 Oc1ccccc1CNCc2ccncc2Br 270004a_100000185550_100000755692 [0,2,0,0,0,0|2,0,0]=4 27226 B18R2.32674 Oc1ccccc1CNCc2ccncc2Cl 207a_100000185550_100011934409 [0,2,0,0,0,0|2,0,0]=4 27227 B18R2.32674 Oc1ccccc1CNCc2ccncc2Cl 270004a_100000185550_100011934409 [0,2,0,0,0,0|2,0,0]=4 27228 B18R2.32674 Oc1ccccc1CNCc2cnccc2Br 270004a_100000185550_100009816821 [0,2,0,0,0,0|2,0,0]=4 27229 B18R2.32674 Oc1ccccc1CNCc2cnccc2Cl 270004a_100000185550_100000050567 [0,2,0,0,0,0|2,0,0]=4 27230 B18R2.32674 Oc1ccccc1CNCc2ncccc2Br 207a_100000185550_100011934733 [0,2,0,0,0,0|2,0,0]=4 27231 B18R2.32674 Oc1ccccc1CNCc2ncccc2Br 270004a_100000185550_100011934733 [0,2,0,0,0,0|2,0,0]=4 27232 B18R2.32674 Oc1ccccc1CNCc2ncccc2Br 34a_100000185550_100025702911 [0,2,0,0,0,0|2,0,0]=4 27233 B18R2.32674 Oc1ccccc1CNCc2ncccc2Cl 207a_100000185550_100012001307 [0,2,0,0,0,0|2,0,0]=4 27234 B18R2.32674 Oc1ccccc1CNCc2ncccc2Cl 270004a_100000185550_100012001307 [0,2,0,0,0,0|2,0,0]=4 27235 B18R2.32674 Oc1ccccc1CNCc2ncccc2F 207a_100000185550_100011934734 [0,2,0,0,0,0|2,0,0]=4 27236 B18R2.32674 Oc1ccccc1CNCc2ncccc2F 270004a_100000185550_100011934734 [0,2,0,0,0,0|2,0,0]=4 27237 B18R2.32674 Oc1ccccc1CNCc2ncccc2F 34a_100000185550_100000104219 [0,2,0,0,0,0|2,0,0]=4 27238 B18R2.32674 Oc1ccccc1CNCc2ncccc2O 34a_100000185550_200020655725 [0,2,0,0,0,0|2,0,0]=4 27239 B18R2.32674 Oc1ccccc1NCCc2ccccc2Br 34a_100000185747_100012161201 [0,2,0,0,0,0|2,0,0]=4 27240 B18R2.32674 Oc1ccccc1NCCc2ccccc2Cl 34a_100000185747_100011713703 [0,2,0,0,0,0|2,0,0]=4 27241 B18R2.32674 Oc1ccccc1NCCc2ccccc2F 34a_100000185747_100000720011 [0,2,0,0,0,0|2,0,0]=4 27242 B18R2.32674 Oc1ccccc1SCCc2ccccc2Br 62a_100000739446_100012161201 [0,2,0,0,0,0|2,0,0]=4 27243 B18R2.32674 Oc1ccccc1SCCc2ccccc2Br 62a_100012161201_100000739446 [0,2,0,0,0,0|2,0,0]=4 27244 B18R2.32674 Oc1ccccc1SCCc2ccccc2Cl 62a_100000739446_100011713703 [0,2,0,0,0,0|2,0,0]=4 27245 B18R2.32674 Oc1ccccc1SCCc2ccccc2Cl 62a_100011713703_100000739446 [0,2,0,0,0,0|2,0,0]=4 27246 B18R2.32674 Oc1ccccc1SCCc2ccccc2F 62a_100000739446_100011713696 [0,2,0,0,0,0|2,0,0]=4 27247 B18R2.32674 Oc1ccccc1SCCc2ccccc2F 62a_100011713696_100000739446 [0,2,0,0,0,0|2,0,0]=4 27248 B18R2.32674 Oc1cccnc1CNCc2ccccc2Br 34a_100000689332_200020655725 [0,2,0,0,0,0|2,0,0]=4 27249 B18R2.32674 Oc1cccnc1CNCc2ccccc2Cl 34a_100000174879_200020655725 [0,2,0,0,0,0|2,0,0]=4 27250 B18R2.32674 Oc1cccnc1CNCc2ccccc2F 34a_100000174869_200020655725 [0,2,0,0,0,0|2,0,0]=4 27251 B18R2.32674 Oc1cccnc1COCc2ccccc2Br 34a_100000756307_200020655725 [0,2,0,0,0,0|1,0,0]=3 27252 B18R2.32674 Oc1cccnc1COCc2ccccc2Br 7a_100000756307_200020655725 [0,2,0,0,0,0|1,0,0]=3 27253 B18R2.32674 Oc1cccnc1COCc2ccccc2Cl 34a_100000210847_200020655725 [0,2,0,0,0,0|1,0,0]=3 27254 B18R2.32674 Oc1cccnc1COCc2ccccc2Cl 7a_100000210847_200020655725 [0,2,0,0,0,0|1,0,0]=3 27255 B18R2.32674 Oc1cccnc1COCc2ccccc2F 34a_100000211962_200020655725 [0,2,0,0,0,0|1,0,0]=3 27256 B18R2.32674 Oc1cccnc1COCc2ccccc2F 7a_100000211962_200020655725 [0,2,0,0,0,0|1,0,0]=3 27257 B18R2.32674 Oc1cccnc1COCc2ccccc2I 34a_100000187465_200020655725 [0,2,0,0,0,0|1,0,0]=3 27258 B18R2.32674 Oc1cccnc1COCc2ccccc2I 7a_100000187465_200020655725 [0,2,0,0,0,0|1,0,0]=3 27259 B18R2.32674 Oc1cccnc1COCc2cccnc2Br 34a_100000719692_200020655725 [0,2,0,0,0,0|2,0,0]=4 27260 B18R2.32674 Oc1cccnc1COCc2cccnc2Br 7a_100000719692_200020655725 [0,2,0,0,0,0|2,0,0]=4 27261 B18R2.32674 Oc1cccnc1COCc2cccnc2Cl 34a_100000748726_200020655725 [0,2,0,0,0,0|2,0,0]=4 27262 B18R2.32674 Oc1cccnc1COCc2cccnc2Cl 7a_100000748726_200020655725 [0,2,0,0,0,0|2,0,0]=4 27263 B18R2.32674 Oc1cccnc1COCc2cccnc2F 34a_100000079888_200020655725 [0,2,0,0,0,0|2,0,0]=4 27264 B18R2.32674 Oc1cccnc1COCc2cccnc2F 7a_100000079888_200020655725 [0,2,0,0,0,0|2,0,0]=4 27265 B18R2.32674 Oc1cccnc1COCc2ccncc2F 34a_100012172863_200020655725 [0,2,0,0,0,0|2,0,0]=4 27266 B18R2.32674 Oc1cccnc1COCc2cnccc2Cl 34a_100000117392_200020655725 [0,2,0,0,0,0|2,0,0]=4 27267 B18R2.32674 Oc1cccnc1COCc2ncccc2Br 34a_100011996772_200020655725 [0,2,0,0,0,0|2,0,0]=4 27268 B18R2.32674 Oc1cccnc1COCc2ncccc2Cl 34a_100012002383_200020655725 [0,2,0,0,0,0|2,0,0]=4 27269 B18R2.32674 Oc1cccnc1COCc2ncccc2F 34a_100011934865_200020655725 [0,2,0,0,0,0|2,0,0]=4 27270 B18R2.32674 Oc1cccnc1CSCc2ccccc2Br 62a_100000184730_200020655725 [0,2,0,0,0,0|1,1,0]=4 27271 B18R2.32674 Oc1cccnc1CSCc2ccccc2Br 62a_200020655725_100000184730 [0,2,0,0,0,0|1,1,0]=4 27272 B18R2.32674 Oc1cccnc1CSCc2ccccc2Cl 62a_100000187162_200020655725 [0,2,0,0,0,0|1,1,0]=4 27273 B18R2.32674 Oc1cccnc1CSCc2ccccc2Cl 62a_200020655725_100000187162 [0,2,0,0,0,0|1,1,0]=4 27274 B18R2.32674 Oc1cccnc1CSCc2ccccc2F 62a_100000211605_200020655725 [0,2,0,0,0,0|1,1,0]=4 27275 B18R2.32674 Oc1cccnc1CSCc2ccccc2F 62a_200020655725_100000211605 [0,2,0,0,0,0|1,1,0]=4 27276 B18R2.32674 Oc1cccnc1CSCc2ccccc2I 62a_100011216222_200020655725 [0,2,0,0,0,0|1,1,0]=4 27277 B18R2.32674 Oc1cccnc1CSCc2ccccc2I 62a_200020655725_100011216222 [0,2,0,0,0,0|1,1,0]=4 27278 B18R2.32674 Oc1ncccc1CNCc2ccccc2Br 207a_100000689332_100011998315 [0,2,0,0,0,0|2,0,0]=4 27279 B18R2.32674 Oc1ncccc1CNCc2ccccc2Br 270004a_100000689332_100011998315 [0,2,0,0,0,0|2,0,0]=4 27280 B18R2.32674 Oc1ncccc1CNCc2ccccc2Cl 207a_100000174879_100011998315 [0,2,0,0,0,0|2,0,0]=4 27281 B18R2.32674 Oc1ncccc1CNCc2ccccc2Cl 270004a_100000174879_100011998315 [0,2,0,0,0,0|2,0,0]=4 27282 B18R2.32674 Oc1ncccc1CNCc2ccccc2F 207a_100000174869_100011998315 [0,2,0,0,0,0|2,0,0]=4 27283 B18R2.32674 Oc1ncccc1CNCc2ccccc2F 270004a_100000174869_100011998315 [0,2,0,0,0,0|2,0,0]=4 27284 B18R2.32674 Oc1ncccc1CNCc2ccccc2I 207a_100015347259_100011998315 [0,2,0,0,0,0|2,0,0]=4 27285 B18R2.32674 Oc1ncccc1CNCc2ccccc2I 270004a_100015347259_100011998315 [0,2,0,0,0,0|2,0,0]=4 27286 B18R2.65882 Brc1cc(ccn1)CNCc2ccccc2Br 2230a_100000689332_100010243470 [0,2,0,0,0,0|2,0,0]=4 27287 B18R2.65882 Brc1cc(ccn1)CNCc2ccccc2Br 2230a_100025757509_100000184730 [0,2,0,0,0,0|2,0,0]=4 27288 B18R2.65882 Brc1cc(ccn1)CNCc2ccccc2Br 26a_100025757509_100000181306 [0,2,0,0,0,0|2,0,0]=4 27289 B18R2.65882 Brc1cc(ccn1)CNCc2ccccc2Br 270004a_100000689332_100009814634 [0,2,0,0,0,0|2,0,0]=4 27290 B18R2.65882 Brc1cc(ccn1)CNCc2ccccc2Br 270004a_100025757509_100000211189 [0,2,0,0,0,0|2,0,0]=4 27291 B18R2.65882 Brc1cc(ccn1)CNCc2ccccc2Br 34a_100000689332_100010243470 [0,2,0,0,0,0|2,0,0]=4 27292 B18R2.65882 Brc1cc(ccn1)CNCc2ccccc2Br 34a_100025757509_100000184730 [0,2,0,0,0,0|2,0,0]=4 27293 B18R2.65882 Brc1cc(ccn1)CNCc2ccccc2I 2230a_100025757509_100011215278 [0,2,0,0,0,0|2,0,0]=4 27294 B18R2.65882 Brc1cc(ccn1)CNCc2ccccc2I 270004a_100015347259_100009814634 [0,2,0,0,0,0|2,0,0]=4 27295 B18R2.65882 Brc1cc(ccn1)CNCc2ccccc2I 270004a_100025757509_100000010305 [0,2,0,0,0,0|2,0,0]=4 27296 B18R2.65882 Brc1cc(ccn1)CNCc2ccccc2I 34a_100025757509_100011215278 [0,2,0,0,0,0|2,0,0]=4 27297 B18R2.65882 Brc1cc(ccn1)COCc2ccccc2Br 34a_100000756307_100010243470 [0,2,0,0,0,0|1,0,0]=3 27298 B18R2.65882 Brc1cc(ccn1)COCc2ccccc2Br 34a_100009814636_100000184730 [0,2,0,0,0,0|1,0,0]=3 27299 B18R2.65882 Brc1cc(ccn1)COCc2ccccc2Br 7a_100000756307_100010254460 [0,2,0,0,0,0|1,0,0]=3 27300 B18R2.65882 Brc1cc(ccn1)COCc2ccccc2Br 7a_100009814636_100000184730 [0,2,0,0,0,0|1,0,0]=3 27301 B18R2.65882 Brc1cc(ccn1)COCc2ccccc2I 34a_100000187465_100010243470 [0,2,0,0,0,0|1,0,0]=3 27302 B18R2.65882 Brc1cc(ccn1)COCc2ccccc2I 34a_100009814636_100011215278 [0,2,0,0,0,0|1,0,0]=3 27303 B18R2.65882 Brc1cc(ccn1)COCc2ccccc2I 7a_100000187465_100010254460 [0,2,0,0,0,0|1,0,0]=3 27304 B18R2.65882 Brc1cc(ccn1)COCc2ccccc2I 7a_100009814636_100011215278 [0,2,0,0,0,0|1,0,0]=3 27305 B18R2.65882 Brc1cc(ccn1)COCc2cccnc2Br 34a_100000719692_100010243470 [0,2,0,0,0,0|2,0,0]=4 27306 B18R2.65882 Brc1cc(ccn1)COCc2cccnc2Br 34a_100009814636_100010140945 [0,2,0,0,0,0|2,0,0]=4 27307 B18R2.65882 Brc1cc(ccn1)COCc2cccnc2Br 7a_100000719692_100010254460 [0,2,0,0,0,0|2,0,0]=4 27308 B18R2.65882 Brc1cc(ccn1)COCc2cccnc2Br 7a_100009814636_100010140945 [0,2,0,0,0,0|2,0,0]=4 27309 B18R2.65882 Brc1cc(ccn1)COCc2ncccc2Br 34a_100009814636_100025702911 [0,2,0,0,0,0|2,0,0]=4 27310 B18R2.65882 Brc1cc(ccn1)COCc2ncccc2Br 34a_100011996772_100010243470 [0,2,0,0,0,0|2,0,0]=4 27311 B18R2.65882 Brc1cc(ccn1)COCc2ncccc2Br 7a_100009814636_100025702911 [0,2,0,0,0,0|2,0,0]=4 27312 B18R2.65882 Brc1cc(ccn1)CSCc2ccccc2Br 62a_100000184730_100010243470 [0,2,0,0,0,0|1,1,0]=4 27313 B18R2.65882 Brc1cc(ccn1)CSCc2ccccc2Br 62a_100010254460_100000184730 [0,2,0,0,0,0|1,1,0]=4 27314 B18R2.65882 Brc1cc(ccn1)CSCc2ccccc2I 62a_100010254460_100011216222 [0,2,0,0,0,0|1,1,0]=4 27315 B18R2.65882 Brc1cc(ccn1)CSCc2ccccc2I 62a_100011216222_100010243470 [0,2,0,0,0,0|1,1,0]=4 27316 B18R2.65882 Brc1cccc(c1)CCNc2ccccc2Br 34a_100000210017_100011740638 [0,2,0,0,0,0|2,0,0]=4 27317 B18R2.65882 Brc1cccc(c1)CCNc2ccccc2I 34a_100000210053_100011740638 [0,2,0,0,0,0|2,0,0]=4 27318 B18R2.65882 Brc1cccc(c1)CCOc2ccccc2Br 34a_100000181306_100011740638 [0,2,0,0,0,0|2,0,0]=4 27319 B18R2.65882 Brc1cccc(c1)CCOc2ccccc2Br 7a_100000181306_100011740638 [0,2,0,0,0,0|2,0,0]=4 27320 B18R2.65882 Brc1cccc(c1)CCOc2ccccc2I 34a_100000739446_100011740638 [0,2,0,0,0,0|2,0,0]=4 27321 B18R2.65882 Brc1cccc(c1)CCOc2ccccc2I 7a_100000739446_100011740638 [0,2,0,0,0,0|2,0,0]=4 27322 B18R2.65882 Brc1cccc(c1)CCSc2ccccc2Br 62a_100000695589_100011740638 [0,2,0,0,0,0|2,0,0]=4 27323 B18R2.65882 Brc1cccc(c1)CCSc2ccccc2Br 62a_100011740638_100000695589 [0,2,0,0,0,0|2,0,0]=4 27324 B18R2.65882 Brc1cccc(c1)CNCc2ccccc2Br 207a_100000174977_100000211189 [0,2,0,0,0,0|1,0,0]=3 27325 B18R2.65882 Brc1cccc(c1)CNCc2ccccc2Br 207a_100000689332_100000210085 [0,2,0,0,0,0|1,0,0]=3 27326 B18R2.65882 Brc1cccc(c1)CNCc2ccccc2Br 2230a_100000174977_100000184730 [0,2,0,0,0,0|1,0,0]=3 27327 B18R2.65882 Brc1cccc(c1)CNCc2ccccc2Br 2230a_100000689332_100000698116 [0,2,0,0,0,0|1,0,0]=3 27328 B18R2.65882 Brc1cccc(c1)CNCc2ccccc2Br 26a_100000174977_100000181306 [0,2,0,0,0,0|1,0,0]=3 27329 B18R2.65882 Brc1cccc(c1)CNCc2ccccc2Br 26a_100000689332_100000210342 [0,2,0,0,0,0|1,0,0]=3 27330 B18R2.65882 Brc1cccc(c1)CNCc2ccccc2Br 270004a_100000174977_100000211189 [0,2,0,0,0,0|1,0,0]=3 27331 B18R2.65882 Brc1cccc(c1)CNCc2ccccc2Br 270004a_100000689332_100000210085 [0,2,0,0,0,0|1,0,0]=3 27332 B18R2.65882 Brc1cccc(c1)CNCc2ccccc2Br 34a_100000174977_100000184730 [0,2,0,0,0,0|1,0,0]=3 27333 B18R2.65882 Brc1cccc(c1)CNCc2ccccc2Br 34a_100000689332_100000698116 [0,2,0,0,0,0|1,0,0]=3 27334 B18R2.65882 Brc1cccc(c1)CNCc2ccccc2I 207a_100000174977_100000010305 [0,2,0,0,0,0|1,0,0]=3 27335 B18R2.65882 Brc1cccc(c1)CNCc2ccccc2I 207a_100015347259_100000210085 [0,2,0,0,0,0|1,0,0]=3 27336 B18R2.65882 Brc1cccc(c1)CNCc2ccccc2I 2230a_100000174977_100011215278 [0,2,0,0,0,0|1,0,0]=3 27337 B18R2.65882 Brc1cccc(c1)CNCc2ccccc2I 270004a_100000174977_100000010305 [0,2,0,0,0,0|1,0,0]=3 27338 B18R2.65882 Brc1cccc(c1)CNCc2ccccc2I 270004a_100015347259_100000210085 [0,2,0,0,0,0|1,0,0]=3 27339 B18R2.65882 Brc1cccc(c1)CNCc2ccccc2I 34a_100000174977_100011215278 [0,2,0,0,0,0|1,0,0]=3 27340 B18R2.65882 Brc1cccc(c1)CNCc2cccnc2Br 2230a_100000174977_100010140945 [0,2,0,0,0,0|2,0,0]=4 27341 B18R2.65882 Brc1cccc(c1)CNCc2cccnc2Br 2230a_100009818023_100000698116 [0,2,0,0,0,0|2,0,0]=4 27342 B18R2.65882 Brc1cccc(c1)CNCc2cccnc2Br 270004a_100009818023_100000210085 [0,2,0,0,0,0|2,0,0]=4 27343 B18R2.65882 Brc1cccc(c1)CNCc2cccnc2Br 34a_100000174977_100010140945 [0,2,0,0,0,0|2,0,0]=4 27344 B18R2.65882 Brc1cccc(c1)CNCc2cccnc2Br 34a_100009818023_100000698116 [0,2,0,0,0,0|2,0,0]=4 27345 B18R2.65882 Brc1cccc(c1)CNCc2ccncc2Br 207a_100020640021_100000210085 [0,2,0,0,0,0|2,0,0]=4 27346 B18R2.65882 Brc1cccc(c1)CNCc2ccncc2Br 270004a_100000174977_100000755692 [0,2,0,0,0,0|2,0,0]=4 27347 B18R2.65882 Brc1cccc(c1)CNCc2ccncc2Br 270004a_100020640021_100000210085 [0,2,0,0,0,0|2,0,0]=4 27348 B18R2.65882 Brc1cccc(c1)CNCc2cnccc2Br 270004a_100000174977_100009816821 [0,2,0,0,0,0|2,0,0]=4 27349 B18R2.65882 Brc1cccc(c1)CNCc2ncccc2Br 207a_100000174977_100011934733 [0,2,0,0,0,0|2,0,0]=4 27350 B18R2.65882 Brc1cccc(c1)CNCc2ncccc2Br 2230a_100000174977_100025702911 [0,2,0,0,0,0|2,0,0]=4 27351 B18R2.65882 Brc1cccc(c1)CNCc2ncccc2Br 270004a_100000174977_100011934733 [0,2,0,0,0,0|2,0,0]=4 27352 B18R2.65882 Brc1cccc(c1)CNCc2ncccc2Br 270004a_100020591323_100000210085 [0,2,0,0,0,0|2,0,0]=4 27353 B18R2.65882 Brc1cccc(c1)CNCc2ncccc2Br 34a_100000174977_100025702911 [0,2,0,0,0,0|2,0,0]=4 27354 B18R2.65882 Brc1cccc(c1)COCc2ccccc2Br 34a_100000687537_100000184730 [0,2,0,0,0,0|0,0,0]=2 27355 B18R2.65882 Brc1cccc(c1)COCc2ccccc2Br 34a_100000756307_100000698116 [0,2,0,0,0,0|0,0,0]=2 27356 B18R2.65882 Brc1cccc(c1)COCc2ccccc2Br 7a_100000687537_100000184730 [0,2,0,0,0,0|0,0,0]=2 27357 B18R2.65882 Brc1cccc(c1)COCc2ccccc2Br 7a_100000756307_100000211773 [0,2,0,0,0,0|0,0,0]=2 27358 B18R2.65882 Brc1cccc(c1)COCc2ccccc2I 34a_100000187465_100000698116 [0,2,0,0,0,0|0,0,0]=2 27359 B18R2.65882 Brc1cccc(c1)COCc2ccccc2I 34a_100000687537_100011215278 [0,2,0,0,0,0|0,0,0]=2 27360 B18R2.65882 Brc1cccc(c1)COCc2ccccc2I 7a_100000187465_100000211773 [0,2,0,0,0,0|0,0,0]=2 27361 B18R2.65882 Brc1cccc(c1)COCc2ccccc2I 7a_100000687537_100011215278 [0,2,0,0,0,0|0,0,0]=2 27362 B18R2.65882 Brc1cccc(c1)COCc2cccnc2Br 34a_100000687537_100010140945 [0,2,0,0,0,0|1,0,0]=3 27363 B18R2.65882 Brc1cccc(c1)COCc2cccnc2Br 34a_100000719692_100000698116 [0,2,0,0,0,0|1,0,0]=3 27364 B18R2.65882 Brc1cccc(c1)COCc2cccnc2Br 7a_100000687537_100010140945 [0,2,0,0,0,0|1,0,0]=3 27365 B18R2.65882 Brc1cccc(c1)COCc2cccnc2Br 7a_100000719692_100000211773 [0,2,0,0,0,0|1,0,0]=3 27366 B18R2.65882 Brc1cccc(c1)COCc2ncccc2Br 34a_100000687537_100025702911 [0,2,0,0,0,0|1,0,0]=3 27367 B18R2.65882 Brc1cccc(c1)COCc2ncccc2Br 34a_100011996772_100000698116 [0,2,0,0,0,0|1,0,0]=3 27368 B18R2.65882 Brc1cccc(c1)COCc2ncccc2Br 7a_100000687537_100025702911 [0,2,0,0,0,0|1,0,0]=3 27369 B18R2.65882 Brc1cccc(c1)CSCc2ccccc2Br 62a_100000184730_100000211773 [0,2,0,0,0,0|0,1,0]=3 27370 B18R2.65882 Brc1cccc(c1)CSCc2ccccc2Br 62a_100000211773_100000184730 [0,2,0,0,0,0|0,1,0]=3 27371 B18R2.65882 Brc1cccc(c1)CSCc2ccccc2I 62a_100000211773_100011216222 [0,2,0,0,0,0|0,1,0]=3 27372 B18R2.65882 Brc1cccc(c1)CSCc2ccccc2I 62a_100011216222_100000211773 [0,2,0,0,0,0|0,1,0]=3 27373 B18R2.65882 Brc1cccc(c1)CSCc2cccnc2Br 62a_100000211773_100010140945 [0,2,0,0,0,0|1,1,0]=4 27374 B18R2.65882 Brc1cccc(c1)CSCc2cccnc2Br 62a_100010140945_100000211773 [0,2,0,0,0,0|1,1,0]=4 27375 B18R2.65882 Brc1cccc(c1)CSCc2ncccc2Br 62a_100000211773_100025702911 [0,2,0,0,0,0|1,1,0]=4 27376 B18R2.65882 Brc1cccc(c1)CSCc2ncccc2Br 62a_100025702911_100000211773 [0,2,0,0,0,0|1,1,0]=4 27377 B18R2.65882 Brc1cccc(c1)NCCc2ccccc2Br 34a_100000210019_100012161201 [0,2,0,0,0,0|2,0,0]=4 27378 B18R2.65882 Brc1cccc(c1)OCCc2ccccc2Br 34a_100000210342_100012161201 [0,2,0,0,0,0|2,0,0]=4 27379 B18R2.65882 Brc1cccc(c1)OCCc2ccccc2Br 7a_100000210342_100012161201 [0,2,0,0,0,0|2,0,0]=4 27380 B18R2.65882 Brc1cccc(c1)SCCc2ccccc2Br 62a_100000691529_100012161201 [0,2,0,0,0,0|2,0,0]=4 27381 B18R2.65882 Brc1cccc(c1)SCCc2ccccc2Br 62a_100012161201_100000691529 [0,2,0,0,0,0|2,0,0]=4 27382 B18R2.65882 Brc1cccc(n1)CNCc2ccccc2Br 2230a_100000689332_100009889011 [0,2,0,0,0,0|2,0,0]=4 27383 B18R2.65882 Brc1cccc(n1)CNCc2ccccc2Br 2230a_100016987751_100000184730 [0,2,0,0,0,0|2,0,0]=4 27384 B18R2.65882 Brc1cccc(n1)CNCc2ccccc2Br 270004a_100000689332_100000688028 [0,2,0,0,0,0|2,0,0]=4 27385 B18R2.65882 Brc1cccc(n1)CNCc2ccccc2Br 34a_100000689332_100009889011 [0,2,0,0,0,0|2,0,0]=4 27386 B18R2.65882 Brc1cccc(n1)CNCc2ccccc2I 2230a_100016987751_100011215278 [0,2,0,0,0,0|2,0,0]=4 27387 B18R2.65882 Brc1cccc(n1)CNCc2ccccc2I 270004a_100015347259_100000688028 [0,2,0,0,0,0|2,0,0]=4 27388 B18R2.65882 Brc1cccc(n1)COCc2ccccc2Br 34a_100000694195_100000184730 [0,2,0,0,0,0|1,0,0]=3 27389 B18R2.65882 Brc1cccc(n1)COCc2ccccc2Br 34a_100000756307_100009889011 [0,2,0,0,0,0|1,0,0]=3 27390 B18R2.65882 Brc1cccc(n1)COCc2ccccc2Br 7a_100000756307_100009889011 [0,2,0,0,0,0|1,0,0]=3 27391 B18R2.65882 Brc1cccc(n1)COCc2ccccc2I 34a_100000187465_100009889011 [0,2,0,0,0,0|1,0,0]=3 27392 B18R2.65882 Brc1cccc(n1)COCc2ccccc2I 34a_100000694195_100011215278 [0,2,0,0,0,0|1,0,0]=3 27393 B18R2.65882 Brc1cccc(n1)COCc2ccccc2I 7a_100000187465_100009889011 [0,2,0,0,0,0|1,0,0]=3 27394 B18R2.65882 Brc1cccc(n1)COCc2cccnc2Br 34a_100000694195_100010140945 [0,2,0,0,0,0|2,0,0]=4 27395 B18R2.65882 Brc1cccc(n1)COCc2cccnc2Br 34a_100000719692_100009889011 [0,2,0,0,0,0|2,0,0]=4 27396 B18R2.65882 Brc1cccc(n1)COCc2cccnc2Br 7a_100000719692_100009889011 [0,2,0,0,0,0|2,0,0]=4 27397 B18R2.65882 Brc1cccc(n1)COCc2ncccc2Br 34a_100000694195_100025702911 [0,2,0,0,0,0|2,0,0]=4 27398 B18R2.65882 Brc1cccc(n1)COCc2ncccc2Br 34a_100011996772_100009889011 [0,2,0,0,0,0|2,0,0]=4 27399 B18R2.65882 Brc1cccc(n1)CSCc2ccccc2Br 62a_100000184730_100009889011 [0,2,0,0,0,0|1,1,0]=4 27400 B18R2.65882 Brc1cccc(n1)CSCc2ccccc2Br 62a_100009889011_100000184730 [0,2,0,0,0,0|1,1,0]=4 27401 B18R2.65882 Brc1cccc(n1)CSCc2ccccc2I 62a_100009889011_100011216222 [0,2,0,0,0,0|1,1,0]=4 27402 B18R2.65882 Brc1cccc(n1)CSCc2ccccc2I 62a_100011216222_100009889011 [0,2,0,0,0,0|1,1,0]=4 27403 B18R2.65882 Brc1ccccc1CCNc2cccc(c2)I 34a_100000211102_100012161201 [0,2,0,0,0,0|2,0,0]=4 27404 B18R2.65882 Brc1ccccc1CCOc2cccc(c2)I 34a_100000211634_100012161201 [0,2,0,0,0,0|2,0,0]=4 27405 B18R2.65882 Brc1ccccc1CCOc2cccc(c2)I 7a_100000211634_100012161201 [0,2,0,0,0,0|2,0,0]=4 27406 B18R2.65882 Brc1ccccc1CNCc2cccc(c2)I 207a_100000106179_100000211189 [0,2,0,0,0,0|1,0,0]=3 27407 B18R2.65882 Brc1ccccc1CNCc2cccc(c2)I 207a_100000689332_100000014684 [0,2,0,0,0,0|1,0,0]=3 27408 B18R2.65882 Brc1ccccc1CNCc2cccc(c2)I 2230a_100000106179_100000184730 [0,2,0,0,0,0|1,0,0]=3 27409 B18R2.65882 Brc1ccccc1CNCc2cccc(c2)I 2230a_100000689332_100011218688 [0,2,0,0,0,0|1,0,0]=3 27410 B18R2.65882 Brc1ccccc1CNCc2cccc(c2)I 270004a_100000106179_100000211189 [0,2,0,0,0,0|1,0,0]=3 27411 B18R2.65882 Brc1ccccc1CNCc2cccc(c2)I 270004a_100000689332_100000014684 [0,2,0,0,0,0|1,0,0]=3 27412 B18R2.65882 Brc1ccccc1CNCc2cccc(c2)I 34a_100000106179_100000184730 [0,2,0,0,0,0|1,0,0]=3 27413 B18R2.65882 Brc1ccccc1CNCc2cccc(c2)I 34a_100000689332_100011218688 [0,2,0,0,0,0|1,0,0]=3 27414 B18R2.65882 Brc1ccccc1COCc2cccc(c2)I 34a_100000756307_100011218688 [0,2,0,0,0,0|0,0,0]=2 27415 B18R2.65882 Brc1ccccc1COCc2cccc(c2)I 34a_100011215336_100000184730 [0,2,0,0,0,0|0,0,0]=2 27416 B18R2.65882 Brc1ccccc1COCc2cccc(c2)I 7a_100000756307_100011218688 [0,2,0,0,0,0|0,0,0]=2 27417 B18R2.65882 Brc1ccccc1COCc2cccc(c2)I 7a_100011215336_100000184730 [0,2,0,0,0,0|0,0,0]=2 27418 B18R2.65882 Brc1ccccc1CSCc2cccc(c2)I 62a_100000184730_100011218688 [0,2,0,0,0,0|0,1,0]=3 27419 B18R2.65882 Brc1ccccc1CSCc2cccc(c2)I 62a_100011218688_100000184730 [0,2,0,0,0,0|0,1,0]=3 27420 B18R2.65882 Brc1cccnc1CNCc2cccc(c2)I 207a_100000106179_100011934733 [0,2,0,0,0,0|2,0,0]=4 27421 B18R2.65882 Brc1cccnc1CNCc2cccc(c2)I 2230a_100000106179_100025702911 [0,2,0,0,0,0|2,0,0]=4 27422 B18R2.65882 Brc1cccnc1CNCc2cccc(c2)I 270004a_100000106179_100011934733 [0,2,0,0,0,0|2,0,0]=4 27423 B18R2.65882 Brc1cccnc1CNCc2cccc(c2)I 270004a_100020591323_100000014684 [0,2,0,0,0,0|2,0,0]=4 27424 B18R2.65882 Brc1cccnc1CNCc2cccc(c2)I 34a_100000106179_100025702911 [0,2,0,0,0,0|2,0,0]=4 27425 B18R2.65882 Brc1cccnc1COCc2cccc(c2)I 34a_100011215336_100025702911 [0,2,0,0,0,0|1,0,0]=3 27426 B18R2.65882 Brc1cccnc1COCc2cccc(c2)I 34a_100011996772_100011218688 [0,2,0,0,0,0|1,0,0]=3 27427 B18R2.65882 Brc1cccnc1COCc2cccc(c2)I 7a_100011215336_100025702911 [0,2,0,0,0,0|1,0,0]=3 27428 B18R2.65882 Brc1cccnc1CSCc2cccc(c2)I 62a_100011218688_100025702911 [0,2,0,0,0,0|1,1,0]=4 27429 B18R2.65882 Brc1cccnc1CSCc2cccc(c2)I 62a_100025702911_100011218688 [0,2,0,0,0,0|1,1,0]=4 27430 B18R2.65882 Brc1ccnc(c1)CNCc2ccccc2Br 2230a_100000689332_100010173614 [0,2,0,0,0,0|2,0,0]=4 27431 B18R2.65882 Brc1ccnc(c1)CNCc2ccccc2Br 270004a_100000689332_100009818557 [0,2,0,0,0,0|2,0,0]=4 27432 B18R2.65882 Brc1ccnc(c1)CNCc2ccccc2Br 34a_100000689332_100010173614 [0,2,0,0,0,0|2,0,0]=4 27433 B18R2.65882 Brc1ccnc(c1)CNCc2ccccc2I 270004a_100015347259_100009818557 [0,2,0,0,0,0|2,0,0]=4 27434 B18R2.65882 Brc1ccnc(c1)COCc2ccccc2Br 34a_100000756307_100010173614 [0,2,0,0,0,0|1,0,0]=3 27435 B18R2.65882 Brc1ccnc(c1)COCc2ccccc2Br 7a_100000756307_100010173614 [0,2,0,0,0,0|1,0,0]=3 27436 B18R2.65882 Brc1ccnc(c1)COCc2ccccc2I 34a_100000187465_100010173614 [0,2,0,0,0,0|1,0,0]=3 27437 B18R2.65882 Brc1ccnc(c1)COCc2ccccc2I 7a_100000187465_100010173614 [0,2,0,0,0,0|1,0,0]=3 27438 B18R2.65882 Brc1ccnc(c1)COCc2cccnc2Br 34a_100000719692_100010173614 [0,2,0,0,0,0|2,0,0]=4 27439 B18R2.65882 Brc1ccnc(c1)COCc2cccnc2Br 7a_100000719692_100010173614 [0,2,0,0,0,0|2,0,0]=4 27440 B18R2.65882 Brc1ccnc(c1)COCc2ncccc2Br 34a_100011996772_100010173614 [0,2,0,0,0,0|2,0,0]=4 27441 B18R2.65882 Brc1ccnc(c1)CSCc2ccccc2Br 62a_100000184730_100010173614 [0,2,0,0,0,0|1,1,0]=4 27442 B18R2.65882 Brc1ccnc(c1)CSCc2ccccc2Br 62a_100010173614_100000184730 [0,2,0,0,0,0|1,1,0]=4 27443 B18R2.65882 Brc1ccnc(c1)CSCc2ccccc2I 62a_100010173614_100011216222 [0,2,0,0,0,0|1,1,0]=4 27444 B18R2.65882 Brc1ccnc(c1)CSCc2ccccc2I 62a_100011216222_100010173614 [0,2,0,0,0,0|1,1,0]=4 27445 B18R2.65882 Brc1ccncc1CNCc2cccc(c2)I 270004a_100000106179_100009816821 [0,2,0,0,0,0|2,0,0]=4 27446 B18R2.65882 Brc1cncc(c1)CNCc2ccccc2Br 207a_100000689332_100000687066 [0,2,0,0,0,0|2,0,0]=4 27447 B18R2.65882 Brc1cncc(c1)CNCc2ccccc2Br 207a_100011249555_100000211189 [0,2,0,0,0,0|2,0,0]=4 27448 B18R2.65882 Brc1cncc(c1)CNCc2ccccc2Br 2230a_100000689332_100000738771 [0,2,0,0,0,0|2,0,0]=4 27449 B18R2.65882 Brc1cncc(c1)CNCc2ccccc2Br 270004a_100000689332_100000687066 [0,2,0,0,0,0|2,0,0]=4 27450 B18R2.65882 Brc1cncc(c1)CNCc2ccccc2Br 270004a_100011249555_100000211189 [0,2,0,0,0,0|2,0,0]=4 27451 B18R2.65882 Brc1cncc(c1)CNCc2ccccc2Br 34a_100000689332_100000738771 [0,2,0,0,0,0|2,0,0]=4 27452 B18R2.65882 Brc1cncc(c1)CNCc2ccccc2I 207a_100011249555_100000010305 [0,2,0,0,0,0|2,0,0]=4 27453 B18R2.65882 Brc1cncc(c1)CNCc2ccccc2I 207a_100015347259_100000687066 [0,2,0,0,0,0|2,0,0]=4 27454 B18R2.65882 Brc1cncc(c1)CNCc2ccccc2I 270004a_100011249555_100000010305 [0,2,0,0,0,0|2,0,0]=4 27455 B18R2.65882 Brc1cncc(c1)CNCc2ccccc2I 270004a_100015347259_100000687066 [0,2,0,0,0,0|2,0,0]=4 27456 B18R2.65882 Brc1cncc(c1)COCc2ccccc2Br 34a_100000756307_100000738771 [0,2,0,0,0,0|1,0,0]=3 27457 B18R2.65882 Brc1cncc(c1)COCc2ccccc2Br 34a_100011259137_100000184730 [0,2,0,0,0,0|1,0,0]=3 27458 B18R2.65882 Brc1cncc(c1)COCc2ccccc2Br 7a_100000756307_100000738771 [0,2,0,0,0,0|1,0,0]=3 27459 B18R2.65882 Brc1cncc(c1)COCc2ccccc2Br 7a_100011259137_100000184730 [0,2,0,0,0,0|1,0,0]=3 27460 B18R2.65882 Brc1cncc(c1)COCc2ccccc2I 34a_100000187465_100000738771 [0,2,0,0,0,0|1,0,0]=3 27461 B18R2.65882 Brc1cncc(c1)COCc2ccccc2I 34a_100011259137_100011215278 [0,2,0,0,0,0|1,0,0]=3 27462 B18R2.65882 Brc1cncc(c1)COCc2ccccc2I 7a_100000187465_100000738771 [0,2,0,0,0,0|1,0,0]=3 27463 B18R2.65882 Brc1cncc(c1)COCc2ccccc2I 7a_100011259137_100011215278 [0,2,0,0,0,0|1,0,0]=3 27464 B18R2.65882 Brc1cncc(c1)COCc2cccnc2Br 34a_100000719692_100000738771 [0,2,0,0,0,0|2,0,0]=4 27465 B18R2.65882 Brc1cncc(c1)COCc2cccnc2Br 34a_100011259137_100010140945 [0,2,0,0,0,0|2,0,0]=4 27466 B18R2.65882 Brc1cncc(c1)COCc2cccnc2Br 7a_100000719692_100000738771 [0,2,0,0,0,0|2,0,0]=4 27467 B18R2.65882 Brc1cncc(c1)COCc2cccnc2Br 7a_100011259137_100010140945 [0,2,0,0,0,0|2,0,0]=4 27468 B18R2.65882 Brc1cncc(c1)COCc2ncccc2Br 34a_100011259137_100025702911 [0,2,0,0,0,0|2,0,0]=4 27469 B18R2.65882 Brc1cncc(c1)COCc2ncccc2Br 34a_100011996772_100000738771 [0,2,0,0,0,0|2,0,0]=4 27470 B18R2.65882 Brc1cncc(c1)COCc2ncccc2Br 7a_100011259137_100025702911 [0,2,0,0,0,0|2,0,0]=4 27471 B18R2.65882 Brc1cncc(c1)CSCc2ccccc2Br 62a_100000184730_100000738771 [0,2,0,0,0,0|1,1,0]=4 27472 B18R2.65882 Brc1cncc(c1)CSCc2ccccc2Br 62a_100000738771_100000184730 [0,2,0,0,0,0|1,1,0]=4 27473 B18R2.65882 Brc1cncc(c1)CSCc2ccccc2I 62a_100000738771_100011216222 [0,2,0,0,0,0|1,1,0]=4 27474 B18R2.65882 Brc1cncc(c1)CSCc2ccccc2I 62a_100011216222_100000738771 [0,2,0,0,0,0|1,1,0]=4 27475 B18R2.65882 Brc1cnccc1CNCc2cccc(c2)I 207a_100020640021_100000014684 [0,2,0,0,0,0|2,0,0]=4 27476 B18R2.65882 Brc1cnccc1CNCc2cccc(c2)I 270004a_100000106179_100000755692 [0,2,0,0,0,0|2,0,0]=4 27477 B18R2.65882 Brc1cnccc1CNCc2cccc(c2)I 270004a_100020640021_100000014684 [0,2,0,0,0,0|2,0,0]=4 27478 B18R2.65882 Brc1ncccc1CNCc2cccc(c2)I 2230a_100000106179_100010140945 [0,2,0,0,0,0|2,0,0]=4 27479 B18R2.65882 Brc1ncccc1CNCc2cccc(c2)I 2230a_100009818023_100011218688 [0,2,0,0,0,0|2,0,0]=4 27480 B18R2.65882 Brc1ncccc1CNCc2cccc(c2)I 270004a_100009818023_100000014684 [0,2,0,0,0,0|2,0,0]=4 27481 B18R2.65882 Brc1ncccc1CNCc2cccc(c2)I 34a_100000106179_100010140945 [0,2,0,0,0,0|2,0,0]=4 27482 B18R2.65882 Brc1ncccc1CNCc2cccc(c2)I 34a_100009818023_100011218688 [0,2,0,0,0,0|2,0,0]=4 27483 B18R2.65882 Brc1ncccc1COCc2cccc(c2)I 34a_100000719692_100011218688 [0,2,0,0,0,0|1,0,0]=3 27484 B18R2.65882 Brc1ncccc1COCc2cccc(c2)I 34a_100011215336_100010140945 [0,2,0,0,0,0|1,0,0]=3 27485 B18R2.65882 Brc1ncccc1COCc2cccc(c2)I 7a_100000719692_100011218688 [0,2,0,0,0,0|1,0,0]=3 27486 B18R2.65882 Brc1ncccc1COCc2cccc(c2)I 7a_100011215336_100010140945 [0,2,0,0,0,0|1,0,0]=3 27487 B18R2.65882 Brc1ncccc1CSCc2cccc(c2)I 62a_100010140945_100011218688 [0,2,0,0,0,0|1,1,0]=4 27488 B18R2.65882 Brc1ncccc1CSCc2cccc(c2)I 62a_100011218688_100010140945 [0,2,0,0,0,0|1,1,0]=4 27489 B18R2.65882 Cc1cc(ccn1)CNCc2ccccc2Br 207a_100000689332_100011361630 [0,2,0,0,0,0|2,0,0]=4 27490 B18R2.65882 Cc1cc(ccn1)CNCc2ccccc2Br 207a_100011934566_100000211189 [0,2,0,0,0,0|2,0,0]=4 27491 B18R2.65882 Cc1cc(ccn1)CNCc2ccccc2Br 2230a_100000689332_200020672517 [0,2,0,0,0,0|2,0,0]=4 27492 B18R2.65882 Cc1cc(ccn1)CNCc2ccccc2Br 270004a_100000689332_100011361630 [0,2,0,0,0,0|2,0,0]=4 27493 B18R2.65882 Cc1cc(ccn1)CNCc2ccccc2Br 270004a_100011934566_100000211189 [0,2,0,0,0,0|2,0,0]=4 27494 B18R2.65882 Cc1cc(ccn1)CNCc2ccccc2Br 34a_100000689332_200020672517 [0,2,0,0,0,0|2,0,0]=4 27495 B18R2.65882 Cc1cc(ccn1)CNCc2ccccc2Br 34a_100011934566_100000184730 [0,2,0,0,0,0|2,0,0]=4 27496 B18R2.65882 Cc1cc(ccn1)CNCc2ccccc2C 207a_100000174972_100011361630 [0,2,0,0,0,0|2,0,0]=4 27497 B18R2.65882 Cc1cc(ccn1)CNCc2ccccc2C 207a_100011934566_100000211143 [0,2,0,0,0,0|2,0,0]=4 27498 B18R2.65882 Cc1cc(ccn1)CNCc2ccccc2C 270004a_100000174972_100011361630 [0,2,0,0,0,0|2,0,0]=4 27499 B18R2.65882 Cc1cc(ccn1)CNCc2ccccc2C 270004a_100011934566_100000211143 [0,2,0,0,0,0|2,0,0]=4 27500 B18R2.65882 Cc1cc(ccn1)CNCc2ccccc2C 34a_100000174972_200020672517 [0,2,0,0,0,0|2,0,0]=4 27501 B18R2.65882 Cc1cc(ccn1)CNCc2ccccc2C 34a_100011934566_100000211839 [0,2,0,0,0,0|2,0,0]=4 27502 B18R2.65882 Cc1cc(ccn1)CNCc2ccccc2Cl 207a_100000174879_100011361630 [0,2,0,0,0,0|2,0,0]=4 27503 B18R2.65882 Cc1cc(ccn1)CNCc2ccccc2Cl 207a_100011934566_100000210073 [0,2,0,0,0,0|2,0,0]=4 27504 B18R2.65882 Cc1cc(ccn1)CNCc2ccccc2Cl 2230a_100000174879_200020672517 [0,2,0,0,0,0|2,0,0]=4 27505 B18R2.65882 Cc1cc(ccn1)CNCc2ccccc2Cl 270004a_100000174879_100011361630 [0,2,0,0,0,0|2,0,0]=4 27506 B18R2.65882 Cc1cc(ccn1)CNCc2ccccc2Cl 270004a_100011934566_100000210073 [0,2,0,0,0,0|2,0,0]=4 27507 B18R2.65882 Cc1cc(ccn1)CNCc2ccccc2Cl 34a_100000174879_200020672517 [0,2,0,0,0,0|2,0,0]=4 27508 B18R2.65882 Cc1cc(ccn1)CNCc2ccccc2Cl 34a_100011934566_100000187162 [0,2,0,0,0,0|2,0,0]=4 27509 B18R2.65882 Cc1cc(ccn1)CNCc2ccccc2F 207a_100000174869_100011361630 [0,2,0,0,0,0|2,0,0]=4 27510 B18R2.65882 Cc1cc(ccn1)CNCc2ccccc2F 207a_100011934566_100000210811 [0,2,0,0,0,0|2,0,0]=4 27511 B18R2.65882 Cc1cc(ccn1)CNCc2ccccc2F 270004a_100000174869_100011361630 [0,2,0,0,0,0|2,0,0]=4 27512 B18R2.65882 Cc1cc(ccn1)CNCc2ccccc2F 270004a_100011934566_100000210811 [0,2,0,0,0,0|2,0,0]=4 27513 B18R2.65882 Cc1cc(ccn1)CNCc2ccccc2F 34a_100000174869_200020672517 [0,2,0,0,0,0|2,0,0]=4 27514 B18R2.65882 Cc1cc(ccn1)CNCc2ccccc2F 34a_100011934566_100000211605 [0,2,0,0,0,0|2,0,0]=4 27515 B18R2.65882 Cc1cc(ccn1)CNCc2ccccc2I 207a_100011934566_100000010305 [0,2,0,0,0,0|2,0,0]=4 27516 B18R2.65882 Cc1cc(ccn1)CNCc2ccccc2I 207a_100015347259_100011361630 [0,2,0,0,0,0|2,0,0]=4 27517 B18R2.65882 Cc1cc(ccn1)CNCc2ccccc2I 270004a_100011934566_100000010305 [0,2,0,0,0,0|2,0,0]=4 27518 B18R2.65882 Cc1cc(ccn1)CNCc2ccccc2I 270004a_100015347259_100011361630 [0,2,0,0,0,0|2,0,0]=4 27519 B18R2.65882 Cc1cc(ccn1)CNCc2ccccc2I 34a_100011934566_100011215278 [0,2,0,0,0,0|2,0,0]=4 27520 B18R2.65882 Cc1cc(ccn1)CNCc2ccccc2O 207a_100000185550_100011361630 [0,2,0,0,0,0|2,0,0]=4 27521 B18R2.65882 Cc1cc(ccn1)CNCc2ccccc2O 270004a_100000185550_100011361630 [0,2,0,0,0,0|2,0,0]=4 27522 B18R2.65882 Cc1cc(ccn1)CNCc2ccccc2O 34a_100000185550_200020672517 [0,2,0,0,0,0|2,0,0]=4 27523 B18R2.65882 Cc1cc(ccn1)COCc2ccccc2Br 34a_100000756307_200020672517 [0,2,0,0,0,0|1,0,0]=3 27524 B18R2.65882 Cc1cc(ccn1)COCc2ccccc2Br 34a_100011998630_100000184730 [0,2,0,0,0,0|1,0,0]=3 27525 B18R2.65882 Cc1cc(ccn1)COCc2ccccc2Br 7a_100000756307_200020672517 [0,2,0,0,0,0|1,0,0]=3 27526 B18R2.65882 Cc1cc(ccn1)COCc2ccccc2C 34a_100000698903_200020672517 [0,2,0,0,0,0|1,0,0]=3 27527 B18R2.65882 Cc1cc(ccn1)COCc2ccccc2C 34a_100011998630_100000211839 [0,2,0,0,0,0|1,0,0]=3 27528 B18R2.65882 Cc1cc(ccn1)COCc2ccccc2C 7a_100000698903_200020672517 [0,2,0,0,0,0|1,0,0]=3 27529 B18R2.65882 Cc1cc(ccn1)COCc2ccccc2Cl 34a_100000210847_200020672517 [0,2,0,0,0,0|1,0,0]=3 27530 B18R2.65882 Cc1cc(ccn1)COCc2ccccc2Cl 34a_100011998630_100000187162 [0,2,0,0,0,0|1,0,0]=3 27531 B18R2.65882 Cc1cc(ccn1)COCc2ccccc2Cl 7a_100000210847_200020672517 [0,2,0,0,0,0|1,0,0]=3 27532 B18R2.65882 Cc1cc(ccn1)COCc2ccccc2F 34a_100000211962_200020672517 [0,2,0,0,0,0|1,0,0]=3 27533 B18R2.65882 Cc1cc(ccn1)COCc2ccccc2F 34a_100011998630_100000211605 [0,2,0,0,0,0|1,0,0]=3 27534 B18R2.65882 Cc1cc(ccn1)COCc2ccccc2F 7a_100000211962_200020672517 [0,2,0,0,0,0|1,0,0]=3 27535 B18R2.65882 Cc1cc(ccn1)COCc2ccccc2I 34a_100000187465_200020672517 [0,2,0,0,0,0|1,0,0]=3 27536 B18R2.65882 Cc1cc(ccn1)COCc2ccccc2I 34a_100011998630_100011215278 [0,2,0,0,0,0|1,0,0]=3 27537 B18R2.65882 Cc1cc(ccn1)COCc2ccccc2I 7a_100000187465_200020672517 [0,2,0,0,0,0|1,0,0]=3 27538 B18R2.65882 Cc1cc(ccn1)COCc2ccccc2N 34a_100000212039_200020672517 [0,2,0,0,0,0|1,0,0]=3 27539 B18R2.65882 Cc1cc(ccn1)COCc2cccnc2Br 34a_100000719692_200020672517 [0,2,0,0,0,0|2,0,0]=4 27540 B18R2.65882 Cc1cc(ccn1)COCc2cccnc2Br 34a_100011998630_100010140945 [0,2,0,0,0,0|2,0,0]=4 27541 B18R2.65882 Cc1cc(ccn1)COCc2cccnc2Br 7a_100000719692_200020672517 [0,2,0,0,0,0|2,0,0]=4 27542 B18R2.65882 Cc1cc(ccn1)COCc2cccnc2C 34a_100000729262_200020672517 [0,2,0,0,0,0|2,0,0]=4 27543 B18R2.65882 Cc1cc(ccn1)COCc2cccnc2C 34a_100011998630_100000732876 [0,2,0,0,0,0|2,0,0]=4 27544 B18R2.65882 Cc1cc(ccn1)COCc2cccnc2C 7a_100000729262_200020672517 [0,2,0,0,0,0|2,0,0]=4 27545 B18R2.65882 Cc1cc(ccn1)COCc2cccnc2Cl 34a_100000748726_200020672517 [0,2,0,0,0,0|2,0,0]=4 27546 B18R2.65882 Cc1cc(ccn1)COCc2cccnc2Cl 34a_100011998630_100000045678 [0,2,0,0,0,0|2,0,0]=4 27547 B18R2.65882 Cc1cc(ccn1)COCc2cccnc2Cl 7a_100000748726_200020672517 [0,2,0,0,0,0|2,0,0]=4 27548 B18R2.65882 Cc1cc(ccn1)COCc2cccnc2F 34a_100000079888_200020672517 [0,2,0,0,0,0|2,0,0]=4 27549 B18R2.65882 Cc1cc(ccn1)COCc2cccnc2F 34a_100011998630_100000099810 [0,2,0,0,0,0|2,0,0]=4 27550 B18R2.65882 Cc1cc(ccn1)COCc2cccnc2F 7a_100000079888_200020672517 [0,2,0,0,0,0|2,0,0]=4 27551 B18R2.65882 Cc1cc(ccn1)COCc2ccncc2C 34a_100011997032_200020672517 [0,2,0,0,0,0|2,0,0]=4 27552 B18R2.65882 Cc1cc(ccn1)COCc2ccncc2C 34a_100011998630_100020672809 [0,2,0,0,0,0|2,0,0]=4 27553 B18R2.65882 Cc1cc(ccn1)COCc2ccncc2F 34a_100012172863_200020672517 [0,2,0,0,0,0|2,0,0]=4 27554 B18R2.65882 Cc1cc(ccn1)COCc2cnccc2C 34a_100011996381_200020672517 [0,2,0,0,0,0|2,0,0]=4 27555 B18R2.65882 Cc1cc(ccn1)COCc2cnccc2C 34a_100011998630_100000690890 [0,2,0,0,0,0|2,0,0]=4 27556 B18R2.65882 Cc1cc(ccn1)COCc2cnccc2Cl 34a_100000117392_200020672517 [0,2,0,0,0,0|2,0,0]=4 27557 B18R2.65882 Cc1cc(ccn1)COCc2ncccc2Br 34a_100011996772_200020672517 [0,2,0,0,0,0|2,0,0]=4 27558 B18R2.65882 Cc1cc(ccn1)COCc2ncccc2Br 34a_100011998630_100025702911 [0,2,0,0,0,0|2,0,0]=4 27559 B18R2.65882 Cc1cc(ccn1)COCc2ncccc2C 34a_100000698912_200020672517 [0,2,0,0,0,0|2,0,0]=4 27560 B18R2.65882 Cc1cc(ccn1)COCc2ncccc2C 34a_100011998630_100000696600 [0,2,0,0,0,0|2,0,0]=4 27561 B18R2.65882 Cc1cc(ccn1)COCc2ncccc2Cl 34a_100012002383_200020672517 [0,2,0,0,0,0|2,0,0]=4 27562 B18R2.65882 Cc1cc(ccn1)COCc2ncccc2F 34a_100011934865_200020672517 [0,2,0,0,0,0|2,0,0]=4 27563 B18R2.65882 Cc1cc(ccn1)COCc2ncccc2F 34a_100011998630_100000104219 [0,2,0,0,0,0|2,0,0]=4 27564 B18R2.65882 Cc1cc(ccn1)COCc2ncccc2N 34a_114873767017_200020672517 [0,2,0,0,0,0|2,0,0]=4 27565 B18R2.65882 Cc1cc(ccn1)COCc2ncccc2O 34a_100011998630_200020655725 [0,2,0,0,0,0|2,0,0]=4 27566 B18R2.65882 Cc1cc(ccn1)CSCc2ccccc2Br 62a_100000184730_200020672517 [0,2,0,0,0,0|1,1,0]=4 27567 B18R2.65882 Cc1cc(ccn1)CSCc2ccccc2Br 62a_200020672517_100000184730 [0,2,0,0,0,0|1,1,0]=4 27568 B18R2.65882 Cc1cc(ccn1)CSCc2ccccc2C 62a_100000211839_200020672517 [0,2,0,0,0,0|1,1,0]=4 27569 B18R2.65882 Cc1cc(ccn1)CSCc2ccccc2C 62a_200020672517_100000211839 [0,2,0,0,0,0|1,1,0]=4 27570 B18R2.65882 Cc1cc(ccn1)CSCc2ccccc2Cl 62a_100000187162_200020672517 [0,2,0,0,0,0|1,1,0]=4 27571 B18R2.65882 Cc1cc(ccn1)CSCc2ccccc2Cl 62a_200020672517_100000187162 [0,2,0,0,0,0|1,1,0]=4 27572 B18R2.65882 Cc1cc(ccn1)CSCc2ccccc2F 62a_100000211605_200020672517 [0,2,0,0,0,0|1,1,0]=4 27573 B18R2.65882 Cc1cc(ccn1)CSCc2ccccc2F 62a_200020672517_100000211605 [0,2,0,0,0,0|1,1,0]=4 27574 B18R2.65882 Cc1cc(ccn1)CSCc2ccccc2I 62a_100011216222_200020672517 [0,2,0,0,0,0|1,1,0]=4 27575 B18R2.65882 Cc1cc(ccn1)CSCc2ccccc2I 62a_200020672517_100011216222 [0,2,0,0,0,0|1,1,0]=4 27576 B18R2.65882 Cc1cccc(c1)CCNc2ccccc2Br 34a_100000210017_100011713685 [0,2,0,0,0,0|2,0,0]=4 27577 B18R2.65882 Cc1cccc(c1)CCNc2ccccc2C 34a_100015192222_100011713685 [0,2,0,0,0,0|2,0,0]=4 27578 B18R2.65882 Cc1cccc(c1)CCNc2ccccc2Cl 34a_100000185783_100011713685 [0,2,0,0,0,0|2,0,0]=4 27579 B18R2.65882 Cc1cccc(c1)CCNc2ccccc2F 34a_100000210422_100011713685 [0,2,0,0,0,0|2,0,0]=4 27580 B18R2.65882 Cc1cccc(c1)CCNc2ccccc2I 34a_100000210053_100011713685 [0,2,0,0,0,0|2,0,0]=4 27581 B18R2.65882 Cc1cccc(c1)CCNc2ccccc2O 34a_100000185747_100011713685 [0,2,0,0,0,0|2,0,0]=4 27582 B18R2.65882 Cc1cccc(c1)CCOc2ccccc2Br 34a_100000181306_100011713685 [0,2,0,0,0,0|2,0,0]=4 27583 B18R2.65882 Cc1cccc(c1)CCOc2ccccc2Br 7a_100000181306_100011713685 [0,2,0,0,0,0|2,0,0]=4 27584 B18R2.65882 Cc1cccc(c1)CCOc2ccccc2C 34a_100000210338_100011713685 [0,2,0,0,0,0|2,0,0]=4 27585 B18R2.65882 Cc1cccc(c1)CCOc2ccccc2C 7a_100000210338_100011713685 [0,2,0,0,0,0|2,0,0]=4 27586 B18R2.65882 Cc1cccc(c1)CCOc2ccccc2Cl 34a_100000210172_100011713685 [0,2,0,0,0,0|2,0,0]=4 27587 B18R2.65882 Cc1cccc(c1)CCOc2ccccc2Cl 7a_100000210172_100011713685 [0,2,0,0,0,0|2,0,0]=4 27588 B18R2.65882 Cc1cccc(c1)CCOc2ccccc2F 34a_100000210171_100011713685 [0,2,0,0,0,0|2,0,0]=4 27589 B18R2.65882 Cc1cccc(c1)CCOc2ccccc2F 7a_100000210171_100011713685 [0,2,0,0,0,0|2,0,0]=4 27590 B18R2.65882 Cc1cccc(c1)CCOc2ccccc2I 34a_100000739446_100011713685 [0,2,0,0,0,0|2,0,0]=4 27591 B18R2.65882 Cc1cccc(c1)CCOc2ccccc2I 7a_100000739446_100011713685 [0,2,0,0,0,0|2,0,0]=4 27592 B18R2.65882 Cc1cccc(c1)CCOc2ccccc2N 34a_100000185747_100011713685 [0,2,0,0,0,0|2,0,0]=4 27593 B18R2.65882 Cc1cccc(c1)CCOc2ccccc2N 7a_100000185747_100011713685 [0,2,0,0,0,0|2,0,0]=4 27594 B18R2.65882 Cc1cccc(c1)CCSc2ccccc2Br 62a_100000695589_100011713685 [0,2,0,0,0,0|2,0,0]=4 27595 B18R2.65882 Cc1cccc(c1)CCSc2ccccc2Br 62a_100011713685_100000695589 [0,2,0,0,0,0|2,0,0]=4 27596 B18R2.65882 Cc1cccc(c1)CCSc2ccccc2C 62a_100000210755_100011713685 [0,2,0,0,0,0|2,0,0]=4 27597 B18R2.65882 Cc1cccc(c1)CCSc2ccccc2C 62a_100011713685_100000210755 [0,2,0,0,0,0|2,0,0]=4 27598 B18R2.65882 Cc1cccc(c1)CCSc2ccccc2Cl 62a_100000764095_100011713685 [0,2,0,0,0,0|2,0,0]=4 27599 B18R2.65882 Cc1cccc(c1)CCSc2ccccc2Cl 62a_100011713685_100000764095 [0,2,0,0,0,0|2,0,0]=4 27600 B18R2.65882 Cc1cccc(c1)CCSc2ccccc2F 62a_100011215700_100011713685 [0,2,0,0,0,0|2,0,0]=4 27601 B18R2.65882 Cc1cccc(c1)CCSc2ccccc2F 62a_100011713685_100011215700 [0,2,0,0,0,0|2,0,0]=4 27602 B18R2.65882 Cc1cccc(c1)CCSc2ccccc2N 62a_100000210017_100011713685 [0,2,0,0,0,0|2,0,0]=4 27603 B18R2.65882 Cc1cccc(c1)CCSc2ccccc2N 62a_100011713685_100000210017 [0,2,0,0,0,0|2,0,0]=4 27604 B18R2.65882 Cc1cccc(c1)CCSc2ccccc2O 62a_100000739446_100011713685 [0,2,0,0,0,0|2,0,0]=4 27605 B18R2.65882 Cc1cccc(c1)CCSc2ccccc2O 62a_100011713685_100000739446 [0,2,0,0,0,0|2,0,0]=4 27606 B18R2.65882 Cc1cccc(c1)CNCc2ccccc2Br 207a_100000185548_100000211189 [0,2,0,0,0,0|1,0,0]=3 27607 B18R2.65882 Cc1cccc(c1)CNCc2ccccc2Br 207a_100000689332_100000211157 [0,2,0,0,0,0|1,0,0]=3 27608 B18R2.65882 Cc1cccc(c1)CNCc2ccccc2Br 2230a_100000185548_100000184730 [0,2,0,0,0,0|1,0,0]=3 27609 B18R2.65882 Cc1cccc(c1)CNCc2ccccc2Br 2230a_100000689332_100000211840 [0,2,0,0,0,0|1,0,0]=3 27610 B18R2.65882 Cc1cccc(c1)CNCc2ccccc2Br 270004a_100000185548_100000211189 [0,2,0,0,0,0|1,0,0]=3 27611 B18R2.65882 Cc1cccc(c1)CNCc2ccccc2Br 270004a_100000689332_100000211157 [0,2,0,0,0,0|1,0,0]=3 27612 B18R2.65882 Cc1cccc(c1)CNCc2ccccc2Br 34a_100000185548_100000184730 [0,2,0,0,0,0|1,0,0]=3 27613 B18R2.65882 Cc1cccc(c1)CNCc2ccccc2Br 34a_100000689332_100000211840 [0,2,0,0,0,0|1,0,0]=3 27614 B18R2.65882 Cc1cccc(c1)CNCc2ccccc2C 207a_100000174972_100000211157 [0,2,0,0,0,0|1,0,0]=3 27615 B18R2.65882 Cc1cccc(c1)CNCc2ccccc2C 207a_100000185548_100000211143 [0,2,0,0,0,0|1,0,0]=3 27616 B18R2.65882 Cc1cccc(c1)CNCc2ccccc2C 2230a_100000185548_100000211839 [0,2,0,0,0,0|1,0,0]=3 27617 B18R2.65882 Cc1cccc(c1)CNCc2ccccc2C 270004a_100000174972_100000211157 [0,2,0,0,0,0|1,0,0]=3 27618 B18R2.65882 Cc1cccc(c1)CNCc2ccccc2C 270004a_100000185548_100000211143 [0,2,0,0,0,0|1,0,0]=3 27619 B18R2.65882 Cc1cccc(c1)CNCc2ccccc2C 34a_100000174972_100000211840 [0,2,0,0,0,0|1,0,0]=3 27620 B18R2.65882 Cc1cccc(c1)CNCc2ccccc2C 34a_100000185548_100000211839 [0,2,0,0,0,0|1,0,0]=3 27621 B18R2.65882 Cc1cccc(c1)CNCc2ccccc2Cl 207a_100000174879_100000211157 [0,2,0,0,0,0|1,0,0]=3 27622 B18R2.65882 Cc1cccc(c1)CNCc2ccccc2Cl 207a_100000185548_100000210073 [0,2,0,0,0,0|1,0,0]=3 27623 B18R2.65882 Cc1cccc(c1)CNCc2ccccc2Cl 2230a_100000174879_100000211840 [0,2,0,0,0,0|1,0,0]=3 27624 B18R2.65882 Cc1cccc(c1)CNCc2ccccc2Cl 2230a_100000185548_100000187162 [0,2,0,0,0,0|1,0,0]=3 27625 B18R2.65882 Cc1cccc(c1)CNCc2ccccc2Cl 270004a_100000174879_100000211157 [0,2,0,0,0,0|1,0,0]=3 27626 B18R2.65882 Cc1cccc(c1)CNCc2ccccc2Cl 270004a_100000185548_100000210073 [0,2,0,0,0,0|1,0,0]=3 27627 B18R2.65882 Cc1cccc(c1)CNCc2ccccc2Cl 34a_100000174879_100000211840 [0,2,0,0,0,0|1,0,0]=3 27628 B18R2.65882 Cc1cccc(c1)CNCc2ccccc2Cl 34a_100000185548_100000187162 [0,2,0,0,0,0|1,0,0]=3 27629 B18R2.65882 Cc1cccc(c1)CNCc2ccccc2F 207a_100000174869_100000211157 [0,2,0,0,0,0|1,0,0]=3 27630 B18R2.65882 Cc1cccc(c1)CNCc2ccccc2F 207a_100000185548_100000210811 [0,2,0,0,0,0|1,0,0]=3 27631 B18R2.65882 Cc1cccc(c1)CNCc2ccccc2F 2230a_100000185548_100000211605 [0,2,0,0,0,0|1,0,0]=3 27632 B18R2.65882 Cc1cccc(c1)CNCc2ccccc2F 270004a_100000174869_100000211157 [0,2,0,0,0,0|1,0,0]=3 27633 B18R2.65882 Cc1cccc(c1)CNCc2ccccc2F 270004a_100000185548_100000210811 [0,2,0,0,0,0|1,0,0]=3 27634 B18R2.65882 Cc1cccc(c1)CNCc2ccccc2F 34a_100000174869_100000211840 [0,2,0,0,0,0|1,0,0]=3 27635 B18R2.65882 Cc1cccc(c1)CNCc2ccccc2F 34a_100000185548_100000211605 [0,2,0,0,0,0|1,0,0]=3 27636 B18R2.65882 Cc1cccc(c1)CNCc2ccccc2I 207a_100000185548_100000010305 [0,2,0,0,0,0|1,0,0]=3 27637 B18R2.65882 Cc1cccc(c1)CNCc2ccccc2I 207a_100015347259_100000211157 [0,2,0,0,0,0|1,0,0]=3 27638 B18R2.65882 Cc1cccc(c1)CNCc2ccccc2I 2230a_100000185548_100011215278 [0,2,0,0,0,0|1,0,0]=3 27639 B18R2.65882 Cc1cccc(c1)CNCc2ccccc2I 270004a_100000185548_100000010305 [0,2,0,0,0,0|1,0,0]=3 27640 B18R2.65882 Cc1cccc(c1)CNCc2ccccc2I 270004a_100015347259_100000211157 [0,2,0,0,0,0|1,0,0]=3 27641 B18R2.65882 Cc1cccc(c1)CNCc2ccccc2I 34a_100000185548_100011215278 [0,2,0,0,0,0|1,0,0]=3 27642 B18R2.65882 Cc1cccc(c1)CNCc2ccccc2O 207a_100000185550_100000211157 [0,2,0,0,0,0|1,0,0]=3 27643 B18R2.65882 Cc1cccc(c1)CNCc2ccccc2O 270004a_100000185550_100000211157 [0,2,0,0,0,0|1,0,0]=3 27644 B18R2.65882 Cc1cccc(c1)CNCc2ccccc2O 34a_100000185550_100000211840 [0,2,0,0,0,0|1,0,0]=3 27645 B18R2.65882 Cc1cccc(c1)CNCc2cccnc2Br 2230a_100000185548_100010140945 [0,2,0,0,0,0|2,0,0]=4 27646 B18R2.65882 Cc1cccc(c1)CNCc2cccnc2Br 2230a_100009818023_100000211840 [0,2,0,0,0,0|2,0,0]=4 27647 B18R2.65882 Cc1cccc(c1)CNCc2cccnc2Br 270004a_100009818023_100000211157 [0,2,0,0,0,0|2,0,0]=4 27648 B18R2.65882 Cc1cccc(c1)CNCc2cccnc2Br 34a_100000185548_100010140945 [0,2,0,0,0,0|2,0,0]=4 27649 B18R2.65882 Cc1cccc(c1)CNCc2cccnc2Br 34a_100009818023_100000211840 [0,2,0,0,0,0|2,0,0]=4 27650 B18R2.65882 Cc1cccc(c1)CNCc2cccnc2C 207a_100000185548_100000751968 [0,2,0,0,0,0|2,0,0]=4 27651 B18R2.65882 Cc1cccc(c1)CNCc2cccnc2C 2230a_100000185548_100000732876 [0,2,0,0,0,0|2,0,0]=4 27652 B18R2.65882 Cc1cccc(c1)CNCc2cccnc2C 270004a_100000185548_100000751968 [0,2,0,0,0,0|2,0,0]=4 27653 B18R2.65882 Cc1cccc(c1)CNCc2cccnc2C 34a_100000185548_100000732876 [0,2,0,0,0,0|2,0,0]=4 27654 B18R2.65882 Cc1cccc(c1)CNCc2cccnc2Cl 207a_100015189234_100000211157 [0,2,0,0,0,0|2,0,0]=4 27655 B18R2.65882 Cc1cccc(c1)CNCc2cccnc2Cl 2230a_100000185548_100000045678 [0,2,0,0,0,0|2,0,0]=4 27656 B18R2.65882 Cc1cccc(c1)CNCc2cccnc2Cl 2230a_100015189234_100000211840 [0,2,0,0,0,0|2,0,0]=4 27657 B18R2.65882 Cc1cccc(c1)CNCc2cccnc2Cl 34a_100000185548_100000045678 [0,2,0,0,0,0|2,0,0]=4 27658 B18R2.65882 Cc1cccc(c1)CNCc2cccnc2Cl 34a_100015189234_100000211840 [0,2,0,0,0,0|2,0,0]=4 27659 B18R2.65882 Cc1cccc(c1)CNCc2cccnc2F 2230a_100000185548_100000099810 [0,2,0,0,0,0|2,0,0]=4 27660 B18R2.65882 Cc1cccc(c1)CNCc2cccnc2F 270004a_100000724633_100000211157 [0,2,0,0,0,0|2,0,0]=4 27661 B18R2.65882 Cc1cccc(c1)CNCc2cccnc2F 34a_100000185548_100000099810 [0,2,0,0,0,0|2,0,0]=4 27662 B18R2.65882 Cc1cccc(c1)CNCc2cccnc2F 34a_100000724633_100000211840 [0,2,0,0,0,0|2,0,0]=4 27663 B18R2.65882 Cc1cccc(c1)CNCc2cccnc2O 207a_100000185548_100011998315 [0,2,0,0,0,0|2,0,0]=4 27664 B18R2.65882 Cc1cccc(c1)CNCc2cccnc2O 270004a_100000185548_100011998315 [0,2,0,0,0,0|2,0,0]=4 27665 B18R2.65882 Cc1cccc(c1)CNCc2ccncc2Br 207a_100020640021_100000211157 [0,2,0,0,0,0|2,0,0]=4 27666 B18R2.65882 Cc1cccc(c1)CNCc2ccncc2Br 270004a_100000185548_100000755692 [0,2,0,0,0,0|2,0,0]=4 27667 B18R2.65882 Cc1cccc(c1)CNCc2ccncc2Br 270004a_100020640021_100000211157 [0,2,0,0,0,0|2,0,0]=4 27668 B18R2.65882 Cc1cccc(c1)CNCc2ccncc2C 207a_100000708811_100000211157 [0,2,0,0,0,0|2,0,0]=4 27669 B18R2.65882 Cc1cccc(c1)CNCc2ccncc2C 2230a_100000185548_100020672808 [0,2,0,0,0,0|2,0,0]=4 27670 B18R2.65882 Cc1cccc(c1)CNCc2ccncc2C 270004a_100000708811_100000211157 [0,2,0,0,0,0|2,0,0]=4 27671 B18R2.65882 Cc1cccc(c1)CNCc2ccncc2C 34a_100000185548_100020672809 [0,2,0,0,0,0|2,0,0]=4 27672 B18R2.65882 Cc1cccc(c1)CNCc2ccncc2Cl 207a_100000185548_100011934409 [0,2,0,0,0,0|2,0,0]=4 27673 B18R2.65882 Cc1cccc(c1)CNCc2ccncc2Cl 2230a_100000185548_100000763264 [0,2,0,0,0,0|2,0,0]=4 27674 B18R2.65882 Cc1cccc(c1)CNCc2ccncc2Cl 270004a_100000185548_100011934409 [0,2,0,0,0,0|2,0,0]=4 27675 B18R2.65882 Cc1cccc(c1)CNCc2ccncc2F 207a_100011935246_100000211157 [0,2,0,0,0,0|2,0,0]=4 27676 B18R2.65882 Cc1cccc(c1)CNCc2ccncc2F 270004a_100011935246_100000211157 [0,2,0,0,0,0|2,0,0]=4 27677 B18R2.65882 Cc1cccc(c1)CNCc2ccncc2F 34a_100011935246_100000211840 [0,2,0,0,0,0|2,0,0]=4 27678 B18R2.65882 Cc1cccc(c1)CNCc2cnccc2Br 270004a_100000185548_100009816821 [0,2,0,0,0,0|2,0,0]=4 27679 B18R2.65882 Cc1cccc(c1)CNCc2cnccc2C 207a_100000185548_100000685662 [0,2,0,0,0,0|2,0,0]=4 27680 B18R2.65882 Cc1cccc(c1)CNCc2cnccc2C 207a_100011997553_100000211157 [0,2,0,0,0,0|2,0,0]=4 27681 B18R2.65882 Cc1cccc(c1)CNCc2cnccc2C 2230a_100000185548_100000690890 [0,2,0,0,0,0|2,0,0]=4 27682 B18R2.65882 Cc1cccc(c1)CNCc2cnccc2C 270004a_100000185548_100000685662 [0,2,0,0,0,0|2,0,0]=4 27683 B18R2.65882 Cc1cccc(c1)CNCc2cnccc2C 270004a_100011997553_100000211157 [0,2,0,0,0,0|2,0,0]=4 27684 B18R2.65882 Cc1cccc(c1)CNCc2cnccc2C 34a_100000185548_100000690890 [0,2,0,0,0,0|2,0,0]=4 27685 B18R2.65882 Cc1cccc(c1)CNCc2cnccc2Cl 270004a_100000185548_100000050567 [0,2,0,0,0,0|2,0,0]=4 27686 B18R2.65882 Cc1cccc(c1)CNCc2ncccc2Br 207a_100000185548_100011934733 [0,2,0,0,0,0|2,0,0]=4 27687 B18R2.65882 Cc1cccc(c1)CNCc2ncccc2Br 2230a_100000185548_100025702911 [0,2,0,0,0,0|2,0,0]=4 27688 B18R2.65882 Cc1cccc(c1)CNCc2ncccc2Br 270004a_100000185548_100011934733 [0,2,0,0,0,0|2,0,0]=4 27689 B18R2.65882 Cc1cccc(c1)CNCc2ncccc2Br 270004a_100020591323_100000211157 [0,2,0,0,0,0|2,0,0]=4 27690 B18R2.65882 Cc1cccc(c1)CNCc2ncccc2Br 34a_100000185548_100025702911 [0,2,0,0,0,0|2,0,0]=4 27691 B18R2.65882 Cc1cccc(c1)CNCc2ncccc2C 207a_100000185548_100000698913 [0,2,0,0,0,0|2,0,0]=4 27692 B18R2.65882 Cc1cccc(c1)CNCc2ncccc2C 2230a_100000185548_100000696600 [0,2,0,0,0,0|2,0,0]=4 27693 B18R2.65882 Cc1cccc(c1)CNCc2ncccc2C 270004a_100000185548_100000698913 [0,2,0,0,0,0|2,0,0]=4 27694 B18R2.65882 Cc1cccc(c1)CNCc2ncccc2C 34a_100000185548_100000696600 [0,2,0,0,0,0|2,0,0]=4 27695 B18R2.65882 Cc1cccc(c1)CNCc2ncccc2C 34a_100011223789_100000211840 [0,2,0,0,0,0|2,0,0]=4 27696 B18R2.65882 Cc1cccc(c1)CNCc2ncccc2Cl 207a_100000185548_100012001307 [0,2,0,0,0,0|2,0,0]=4 27697 B18R2.65882 Cc1cccc(c1)CNCc2ncccc2Cl 2230a_100000185548_100000099807 [0,2,0,0,0,0|2,0,0]=4 27698 B18R2.65882 Cc1cccc(c1)CNCc2ncccc2Cl 2230a_100015189233_100000211840 [0,2,0,0,0,0|2,0,0]=4 27699 B18R2.65882 Cc1cccc(c1)CNCc2ncccc2Cl 270004a_100000185548_100012001307 [0,2,0,0,0,0|2,0,0]=4 27700 B18R2.65882 Cc1cccc(c1)CNCc2ncccc2Cl 270004a_100015189233_100000211157 [0,2,0,0,0,0|2,0,0]=4 27701 B18R2.65882 Cc1cccc(c1)CNCc2ncccc2F 207a_100000185548_100011934734 [0,2,0,0,0,0|2,0,0]=4 27702 B18R2.65882 Cc1cccc(c1)CNCc2ncccc2F 2230a_100000185548_100000104219 [0,2,0,0,0,0|2,0,0]=4 27703 B18R2.65882 Cc1cccc(c1)CNCc2ncccc2F 270004a_100000185548_100011934734 [0,2,0,0,0,0|2,0,0]=4 27704 B18R2.65882 Cc1cccc(c1)CNCc2ncccc2F 270004a_100000690088_100000211157 [0,2,0,0,0,0|2,0,0]=4 27705 B18R2.65882 Cc1cccc(c1)CNCc2ncccc2F 34a_100000185548_100000104219 [0,2,0,0,0,0|2,0,0]=4 27706 B18R2.65882 Cc1cccc(c1)CNCc2ncccc2F 34a_100000690088_100000211840 [0,2,0,0,0,0|2,0,0]=4 27707 B18R2.65882 Cc1cccc(c1)CNCc2ncccc2O 34a_100000185548_200020655725 [0,2,0,0,0,0|2,0,0]=4 27708 B18R2.65882 Cc1cccc(c1)COCc2ccccc2Br 34a_100000756307_100000211840 [0,2,0,0,0,0|0,0,0]=2 27709 B18R2.65882 Cc1cccc(c1)COCc2ccccc2Br 34a_100011217746_100000184730 [0,2,0,0,0,0|0,0,0]=2 27710 B18R2.65882 Cc1cccc(c1)COCc2ccccc2Br 7a_100000756307_100000211840 [0,2,0,0,0,0|0,0,0]=2 27711 B18R2.65882 Cc1cccc(c1)COCc2ccccc2Br 7a_100011217746_100000184730 [0,2,0,0,0,0|0,0,0]=2 27712 B18R2.65882 Cc1cccc(c1)COCc2ccccc2C 34a_100000698903_100000211840 [0,2,0,0,0,0|0,0,0]=2 27713 B18R2.65882 Cc1cccc(c1)COCc2ccccc2C 34a_100011217746_100000211839 [0,2,0,0,0,0|0,0,0]=2 27714 B18R2.65882 Cc1cccc(c1)COCc2ccccc2C 7a_100000698903_100000211840 [0,2,0,0,0,0|0,0,0]=2 27715 B18R2.65882 Cc1cccc(c1)COCc2ccccc2C 7a_100011217746_100000211839 [0,2,0,0,0,0|0,0,0]=2 27716 B18R2.65882 Cc1cccc(c1)COCc2ccccc2Cl 34a_100000210847_100000211840 [0,2,0,0,0,0|0,0,0]=2 27717 B18R2.65882 Cc1cccc(c1)COCc2ccccc2Cl 34a_100011217746_100000187162 [0,2,0,0,0,0|0,0,0]=2 27718 B18R2.65882 Cc1cccc(c1)COCc2ccccc2Cl 7a_100000210847_100000211840 [0,2,0,0,0,0|0,0,0]=2 27719 B18R2.65882 Cc1cccc(c1)COCc2ccccc2Cl 7a_100011217746_100000187162 [0,2,0,0,0,0|0,0,0]=2 27720 B18R2.65882 Cc1cccc(c1)COCc2ccccc2F 34a_100000211962_100000211840 [0,2,0,0,0,0|0,0,0]=2 27721 B18R2.65882 Cc1cccc(c1)COCc2ccccc2F 34a_100011217746_100000211605 [0,2,0,0,0,0|0,0,0]=2 27722 B18R2.65882 Cc1cccc(c1)COCc2ccccc2F 7a_100000211962_100000211840 [0,2,0,0,0,0|0,0,0]=2 27723 B18R2.65882 Cc1cccc(c1)COCc2ccccc2F 7a_100011217746_100000211605 [0,2,0,0,0,0|0,0,0]=2 27724 B18R2.65882 Cc1cccc(c1)COCc2ccccc2I 34a_100000187465_100000211840 [0,2,0,0,0,0|0,0,0]=2 27725 B18R2.65882 Cc1cccc(c1)COCc2ccccc2I 34a_100011217746_100011215278 [0,2,0,0,0,0|0,0,0]=2 27726 B18R2.65882 Cc1cccc(c1)COCc2ccccc2I 7a_100000187465_100000211840 [0,2,0,0,0,0|0,0,0]=2 27727 B18R2.65882 Cc1cccc(c1)COCc2ccccc2I 7a_100011217746_100011215278 [0,2,0,0,0,0|0,0,0]=2 27728 B18R2.65882 Cc1cccc(c1)COCc2ccccc2N 34a_100000212039_100000211840 [0,2,0,0,0,0|0,0,0]=2 27729 B18R2.65882 Cc1cccc(c1)COCc2cccnc2Br 34a_100000719692_100000211840 [0,2,0,0,0,0|1,0,0]=3 27730 B18R2.65882 Cc1cccc(c1)COCc2cccnc2Br 34a_100011217746_100010140945 [0,2,0,0,0,0|1,0,0]=3 27731 B18R2.65882 Cc1cccc(c1)COCc2cccnc2Br 7a_100000719692_100000211840 [0,2,0,0,0,0|1,0,0]=3 27732 B18R2.65882 Cc1cccc(c1)COCc2cccnc2Br 7a_100011217746_100010140945 [0,2,0,0,0,0|1,0,0]=3 27733 B18R2.65882 Cc1cccc(c1)COCc2cccnc2C 34a_100000729262_100000211840 [0,2,0,0,0,0|1,0,0]=3 27734 B18R2.65882 Cc1cccc(c1)COCc2cccnc2C 34a_100011217746_100000732876 [0,2,0,0,0,0|1,0,0]=3 27735 B18R2.65882 Cc1cccc(c1)COCc2cccnc2C 7a_100000729262_100000211840 [0,2,0,0,0,0|1,0,0]=3 27736 B18R2.65882 Cc1cccc(c1)COCc2cccnc2C 7a_100011217746_100000732876 [0,2,0,0,0,0|1,0,0]=3 27737 B18R2.65882 Cc1cccc(c1)COCc2cccnc2Cl 34a_100000748726_100000211840 [0,2,0,0,0,0|1,0,0]=3 27738 B18R2.65882 Cc1cccc(c1)COCc2cccnc2Cl 34a_100011217746_100000045678 [0,2,0,0,0,0|1,0,0]=3 27739 B18R2.65882 Cc1cccc(c1)COCc2cccnc2Cl 7a_100000748726_100000211840 [0,2,0,0,0,0|1,0,0]=3 27740 B18R2.65882 Cc1cccc(c1)COCc2cccnc2Cl 7a_100011217746_100000045678 [0,2,0,0,0,0|1,0,0]=3 27741 B18R2.65882 Cc1cccc(c1)COCc2cccnc2F 34a_100000079888_100000211840 [0,2,0,0,0,0|1,0,0]=3 27742 B18R2.65882 Cc1cccc(c1)COCc2cccnc2F 34a_100011217746_100000099810 [0,2,0,0,0,0|1,0,0]=3 27743 B18R2.65882 Cc1cccc(c1)COCc2cccnc2F 7a_100000079888_100000211840 [0,2,0,0,0,0|1,0,0]=3 27744 B18R2.65882 Cc1cccc(c1)COCc2cccnc2F 7a_100011217746_100000099810 [0,2,0,0,0,0|1,0,0]=3 27745 B18R2.65882 Cc1cccc(c1)COCc2ccncc2C 34a_100011217746_100020672809 [0,2,0,0,0,0|1,0,0]=3 27746 B18R2.65882 Cc1cccc(c1)COCc2ccncc2C 34a_100011997032_100000211840 [0,2,0,0,0,0|1,0,0]=3 27747 B18R2.65882 Cc1cccc(c1)COCc2ccncc2C 7a_100011217746_100020672808 [0,2,0,0,0,0|1,0,0]=3 27748 B18R2.65882 Cc1cccc(c1)COCc2ccncc2Cl 7a_100011217746_100000763264 [0,2,0,0,0,0|1,0,0]=3 27749 B18R2.65882 Cc1cccc(c1)COCc2ccncc2F 34a_100012172863_100000211840 [0,2,0,0,0,0|1,0,0]=3 27750 B18R2.65882 Cc1cccc(c1)COCc2cnccc2C 34a_100011217746_100000690890 [0,2,0,0,0,0|1,0,0]=3 27751 B18R2.65882 Cc1cccc(c1)COCc2cnccc2C 34a_100011996381_100000211840 [0,2,0,0,0,0|1,0,0]=3 27752 B18R2.65882 Cc1cccc(c1)COCc2cnccc2C 7a_100011217746_100000690890 [0,2,0,0,0,0|1,0,0]=3 27753 B18R2.65882 Cc1cccc(c1)COCc2cnccc2Cl 34a_100000117392_100000211840 [0,2,0,0,0,0|1,0,0]=3 27754 B18R2.65882 Cc1cccc(c1)COCc2ncccc2Br 34a_100011217746_100025702911 [0,2,0,0,0,0|1,0,0]=3 27755 B18R2.65882 Cc1cccc(c1)COCc2ncccc2Br 34a_100011996772_100000211840 [0,2,0,0,0,0|1,0,0]=3 27756 B18R2.65882 Cc1cccc(c1)COCc2ncccc2Br 7a_100011217746_100025702911 [0,2,0,0,0,0|1,0,0]=3 27757 B18R2.65882 Cc1cccc(c1)COCc2ncccc2C 34a_100000698912_100000211840 [0,2,0,0,0,0|1,0,0]=3 27758 B18R2.65882 Cc1cccc(c1)COCc2ncccc2C 34a_100011217746_100000696600 [0,2,0,0,0,0|1,0,0]=3 27759 B18R2.65882 Cc1cccc(c1)COCc2ncccc2C 7a_100011217746_100000696600 [0,2,0,0,0,0|1,0,0]=3 27760 B18R2.65882 Cc1cccc(c1)COCc2ncccc2Cl 34a_100012002383_100000211840 [0,2,0,0,0,0|1,0,0]=3 27761 B18R2.65882 Cc1cccc(c1)COCc2ncccc2Cl 7a_100011217746_100000099807 [0,2,0,0,0,0|1,0,0]=3 27762 B18R2.65882 Cc1cccc(c1)COCc2ncccc2F 34a_100011217746_100000104219 [0,2,0,0,0,0|1,0,0]=3 27763 B18R2.65882 Cc1cccc(c1)COCc2ncccc2F 34a_100011934865_100000211840 [0,2,0,0,0,0|1,0,0]=3 27764 B18R2.65882 Cc1cccc(c1)COCc2ncccc2F 7a_100011217746_100000104219 [0,2,0,0,0,0|1,0,0]=3 27765 B18R2.65882 Cc1cccc(c1)COCc2ncccc2N 34a_114873767017_100000211840 [0,2,0,0,0,0|1,0,0]=3 27766 B18R2.65882 Cc1cccc(c1)COCc2ncccc2O 34a_100011217746_200020655725 [0,2,0,0,0,0|1,0,0]=3 27767 B18R2.65882 Cc1cccc(c1)COCc2ncccc2O 7a_100011217746_200020655725 [0,2,0,0,0,0|1,0,0]=3 27768 B18R2.65882 Cc1cccc(c1)COCc2nccnc2Cl 34a_100000057004_100000211840 [0,2,0,0,0,0|2,0,0]=4 27769 B18R2.65882 Cc1cccc(c1)CSCc2ccccc2Br 62a_100000184730_100000211840 [0,2,0,0,0,0|0,1,0]=3 27770 B18R2.65882 Cc1cccc(c1)CSCc2ccccc2Br 62a_100000211840_100000184730 [0,2,0,0,0,0|0,1,0]=3 27771 B18R2.65882 Cc1cccc(c1)CSCc2ccccc2C 62a_100000211839_100000211840 [0,2,0,0,0,0|0,1,0]=3 27772 B18R2.65882 Cc1cccc(c1)CSCc2ccccc2C 62a_100000211840_100000211839 [0,2,0,0,0,0|0,1,0]=3 27773 B18R2.65882 Cc1cccc(c1)CSCc2ccccc2Cl 62a_100000187162_100000211840 [0,2,0,0,0,0|0,1,0]=3 27774 B18R2.65882 Cc1cccc(c1)CSCc2ccccc2Cl 62a_100000211840_100000187162 [0,2,0,0,0,0|0,1,0]=3 27775 B18R2.65882 Cc1cccc(c1)CSCc2ccccc2F 62a_100000211605_100000211840 [0,2,0,0,0,0|0,1,0]=3 27776 B18R2.65882 Cc1cccc(c1)CSCc2ccccc2F 62a_100000211840_100000211605 [0,2,0,0,0,0|0,1,0]=3 27777 B18R2.65882 Cc1cccc(c1)CSCc2ccccc2I 62a_100000211840_100011216222 [0,2,0,0,0,0|0,1,0]=3 27778 B18R2.65882 Cc1cccc(c1)CSCc2ccccc2I 62a_100011216222_100000211840 [0,2,0,0,0,0|0,1,0]=3 27779 B18R2.65882 Cc1cccc(c1)CSCc2cccnc2Br 62a_100000211840_100010140945 [0,2,0,0,0,0|1,1,0]=4 27780 B18R2.65882 Cc1cccc(c1)CSCc2cccnc2Br 62a_100010140945_100000211840 [0,2,0,0,0,0|1,1,0]=4 27781 B18R2.65882 Cc1cccc(c1)CSCc2cccnc2C 62a_100000211840_100000732876 [0,2,0,0,0,0|1,1,0]=4 27782 B18R2.65882 Cc1cccc(c1)CSCc2cccnc2C 62a_100000732876_100000211840 [0,2,0,0,0,0|1,1,0]=4 27783 B18R2.65882 Cc1cccc(c1)CSCc2cccnc2Cl 62a_100000045678_100000211840 [0,2,0,0,0,0|1,1,0]=4 27784 B18R2.65882 Cc1cccc(c1)CSCc2cccnc2Cl 62a_100000211840_100000045678 [0,2,0,0,0,0|1,1,0]=4 27785 B18R2.65882 Cc1cccc(c1)CSCc2cccnc2F 62a_100000099810_100000211840 [0,2,0,0,0,0|1,1,0]=4 27786 B18R2.65882 Cc1cccc(c1)CSCc2cccnc2F 62a_100000211840_100000099810 [0,2,0,0,0,0|1,1,0]=4 27787 B18R2.65882 Cc1cccc(c1)CSCc2ccncc2C 62a_100000211840_100020672808 [0,2,0,0,0,0|1,1,0]=4 27788 B18R2.65882 Cc1cccc(c1)CSCc2ccncc2C 62a_100020672808_100000211840 [0,2,0,0,0,0|1,1,0]=4 27789 B18R2.65882 Cc1cccc(c1)CSCc2ccncc2Cl 62a_100000211840_100000763264 [0,2,0,0,0,0|1,1,0]=4 27790 B18R2.65882 Cc1cccc(c1)CSCc2ccncc2Cl 62a_100000763264_100000211840 [0,2,0,0,0,0|1,1,0]=4 27791 B18R2.65882 Cc1cccc(c1)CSCc2cnccc2C 62a_100000211840_100000690890 [0,2,0,0,0,0|1,1,0]=4 27792 B18R2.65882 Cc1cccc(c1)CSCc2cnccc2C 62a_100000690890_100000211840 [0,2,0,0,0,0|1,1,0]=4 27793 B18R2.65882 Cc1cccc(c1)CSCc2ncccc2Br 62a_100000211840_100025702911 [0,2,0,0,0,0|1,1,0]=4 27794 B18R2.65882 Cc1cccc(c1)CSCc2ncccc2Br 62a_100025702911_100000211840 [0,2,0,0,0,0|1,1,0]=4 27795 B18R2.65882 Cc1cccc(c1)CSCc2ncccc2C 62a_100000211840_100000696600 [0,2,0,0,0,0|1,1,0]=4 27796 B18R2.65882 Cc1cccc(c1)CSCc2ncccc2C 62a_100000696600_100000211840 [0,2,0,0,0,0|1,1,0]=4 27797 B18R2.65882 Cc1cccc(c1)CSCc2ncccc2Cl 62a_100000099807_100000211840 [0,2,0,0,0,0|1,1,0]=4 27798 B18R2.65882 Cc1cccc(c1)CSCc2ncccc2Cl 62a_100000211840_100000099807 [0,2,0,0,0,0|1,1,0]=4 27799 B18R2.65882 Cc1cccc(c1)CSCc2ncccc2F 62a_100000104219_100000211840 [0,2,0,0,0,0|1,1,0]=4 27800 B18R2.65882 Cc1cccc(c1)CSCc2ncccc2F 62a_100000211840_100000104219 [0,2,0,0,0,0|1,1,0]=4 27801 B18R2.65882 Cc1cccc(c1)CSCc2ncccc2O 62a_100000211840_200020655725 [0,2,0,0,0,0|1,1,0]=4 27802 B18R2.65882 Cc1cccc(c1)CSCc2ncccc2O 62a_200020655725_100000211840 [0,2,0,0,0,0|1,1,0]=4 27803 B18R2.65882 Cc1cccc(c1)NCCc2ccccc2Br 2230a_100000188690_100012161201 [0,2,0,0,0,0|2,0,0]=4 27804 B18R2.65882 Cc1cccc(c1)NCCc2ccccc2Br 34a_100000188690_100012161201 [0,2,0,0,0,0|2,0,0]=4 27805 B18R2.65882 Cc1cccc(c1)NCCc2ccccc2C 2230a_100000188690_100011713688 [0,2,0,0,0,0|2,0,0]=4 27806 B18R2.65882 Cc1cccc(c1)NCCc2ccccc2C 34a_100000188690_100011713688 [0,2,0,0,0,0|2,0,0]=4 27807 B18R2.65882 Cc1cccc(c1)NCCc2ccccc2Cl 2230a_100000188690_100011713703 [0,2,0,0,0,0|2,0,0]=4 27808 B18R2.65882 Cc1cccc(c1)NCCc2ccccc2Cl 34a_100000188690_100011713703 [0,2,0,0,0,0|2,0,0]=4 27809 B18R2.65882 Cc1cccc(c1)NCCc2ccccc2F 2230a_100000188690_100011713696 [0,2,0,0,0,0|2,0,0]=4 27810 B18R2.65882 Cc1cccc(c1)NCCc2ccccc2F 34a_100000188690_100000720011 [0,2,0,0,0,0|2,0,0]=4 27811 B18R2.65882 Cc1cccc(c1)NCCc2ccccc2O 34a_100000188690_100000722297 [0,2,0,0,0,0|2,0,0]=4 27812 B18R2.65882 Cc1cccc(c1)OCCc2ccccc2Br 34a_100000210337_100012161201 [0,2,0,0,0,0|2,0,0]=4 27813 B18R2.65882 Cc1cccc(c1)OCCc2ccccc2Br 7a_100000210337_100012161201 [0,2,0,0,0,0|2,0,0]=4 27814 B18R2.65882 Cc1cccc(c1)OCCc2ccccc2C 34a_100000210337_100011713688 [0,2,0,0,0,0|2,0,0]=4 27815 B18R2.65882 Cc1cccc(c1)OCCc2ccccc2C 7a_100000210337_100011713688 [0,2,0,0,0,0|2,0,0]=4 27816 B18R2.65882 Cc1cccc(c1)OCCc2ccccc2Cl 34a_100000210337_100011713703 [0,2,0,0,0,0|2,0,0]=4 27817 B18R2.65882 Cc1cccc(c1)OCCc2ccccc2Cl 7a_100000210337_100011713703 [0,2,0,0,0,0|2,0,0]=4 27818 B18R2.65882 Cc1cccc(c1)OCCc2ccccc2F 34a_100000210337_100000720011 [0,2,0,0,0,0|2,0,0]=4 27819 B18R2.65882 Cc1cccc(c1)OCCc2ccccc2F 7a_100000210337_100000720011 [0,2,0,0,0,0|2,0,0]=4 27820 B18R2.65882 Cc1cccc(c1)OCCc2ccccc2O 34a_100000210337_100000722297 [0,2,0,0,0,0|2,0,0]=4 27821 B18R2.65882 Cc1cccc(c1)OCCc2ccccc2O 7a_100000210337_100000722297 [0,2,0,0,0,0|2,0,0]=4 27822 B18R2.65882 Cc1cccc(c1)SCCc2ccccc2Br 62a_100011215228_100012161201 [0,2,0,0,0,0|2,0,0]=4 27823 B18R2.65882 Cc1cccc(c1)SCCc2ccccc2Br 62a_100012161201_100011215228 [0,2,0,0,0,0|2,0,0]=4 27824 B18R2.65882 Cc1cccc(c1)SCCc2ccccc2C 62a_100011215228_100011713688 [0,2,0,0,0,0|2,0,0]=4 27825 B18R2.65882 Cc1cccc(c1)SCCc2ccccc2C 62a_100011713688_100011215228 [0,2,0,0,0,0|2,0,0]=4 27826 B18R2.65882 Cc1cccc(c1)SCCc2ccccc2Cl 62a_100011215228_100011713703 [0,2,0,0,0,0|2,0,0]=4 27827 B18R2.65882 Cc1cccc(c1)SCCc2ccccc2Cl 62a_100011713703_100011215228 [0,2,0,0,0,0|2,0,0]=4 27828 B18R2.65882 Cc1cccc(c1)SCCc2ccccc2F 62a_100011215228_100011713696 [0,2,0,0,0,0|2,0,0]=4 27829 B18R2.65882 Cc1cccc(c1)SCCc2ccccc2F 62a_100011713696_100011215228 [0,2,0,0,0,0|2,0,0]=4 27830 B18R2.65882 Cc1cccc(c1)SCCc2ccccc2O 62a_100000722297_100011215228 [0,2,0,0,0,0|2,0,0]=4 27831 B18R2.65882 Cc1cccc(c1)SCCc2ccccc2O 62a_100011215228_100000722297 [0,2,0,0,0,0|2,0,0]=4 27832 B18R2.65882 Cc1cccc(n1)CNCc2ccccc2Br 207a_100000689332_100011215050 [0,2,0,0,0,0|2,0,0]=4 27833 B18R2.65882 Cc1cccc(n1)CNCc2ccccc2Br 2230a_100000689332_100000757606 [0,2,0,0,0,0|2,0,0]=4 27834 B18R2.65882 Cc1cccc(n1)CNCc2ccccc2Br 270004a_100000689332_100011215050 [0,2,0,0,0,0|2,0,0]=4 27835 B18R2.65882 Cc1cccc(n1)CNCc2ccccc2Br 34a_100000689332_100000757606 [0,2,0,0,0,0|2,0,0]=4 27836 B18R2.65882 Cc1cccc(n1)CNCc2ccccc2Br 34a_100000701342_100000184730 [0,2,0,0,0,0|2,0,0]=4 27837 B18R2.65882 Cc1cccc(n1)CNCc2ccccc2C 207a_100000174972_100011215050 [0,2,0,0,0,0|2,0,0]=4 27838 B18R2.65882 Cc1cccc(n1)CNCc2ccccc2C 270004a_100000174972_100011215050 [0,2,0,0,0,0|2,0,0]=4 27839 B18R2.65882 Cc1cccc(n1)CNCc2ccccc2C 34a_100000174972_100000757606 [0,2,0,0,0,0|2,0,0]=4 27840 B18R2.65882 Cc1cccc(n1)CNCc2ccccc2C 34a_100000701342_100000211839 [0,2,0,0,0,0|2,0,0]=4 27841 B18R2.65882 Cc1cccc(n1)CNCc2ccccc2Cl 207a_100000174879_100011215050 [0,2,0,0,0,0|2,0,0]=4 27842 B18R2.65882 Cc1cccc(n1)CNCc2ccccc2Cl 2230a_100000174879_100000757606 [0,2,0,0,0,0|2,0,0]=4 27843 B18R2.65882 Cc1cccc(n1)CNCc2ccccc2Cl 270004a_100000174879_100011215050 [0,2,0,0,0,0|2,0,0]=4 27844 B18R2.65882 Cc1cccc(n1)CNCc2ccccc2Cl 34a_100000174879_100000757606 [0,2,0,0,0,0|2,0,0]=4 27845 B18R2.65882 Cc1cccc(n1)CNCc2ccccc2Cl 34a_100000701342_100000187162 [0,2,0,0,0,0|2,0,0]=4 27846 B18R2.65882 Cc1cccc(n1)CNCc2ccccc2F 207a_100000174869_100011215050 [0,2,0,0,0,0|2,0,0]=4 27847 B18R2.65882 Cc1cccc(n1)CNCc2ccccc2F 270004a_100000174869_100011215050 [0,2,0,0,0,0|2,0,0]=4 27848 B18R2.65882 Cc1cccc(n1)CNCc2ccccc2F 34a_100000174869_100000757606 [0,2,0,0,0,0|2,0,0]=4 27849 B18R2.65882 Cc1cccc(n1)CNCc2ccccc2F 34a_100000701342_100000211605 [0,2,0,0,0,0|2,0,0]=4 27850 B18R2.65882 Cc1cccc(n1)CNCc2ccccc2I 207a_100015347259_100011215050 [0,2,0,0,0,0|2,0,0]=4 27851 B18R2.65882 Cc1cccc(n1)CNCc2ccccc2I 270004a_100015347259_100011215050 [0,2,0,0,0,0|2,0,0]=4 27852 B18R2.65882 Cc1cccc(n1)CNCc2ccccc2I 34a_100000701342_100011215278 [0,2,0,0,0,0|2,0,0]=4 27853 B18R2.65882 Cc1cccc(n1)CNCc2ccccc2O 207a_100000185550_100011215050 [0,2,0,0,0,0|2,0,0]=4 27854 B18R2.65882 Cc1cccc(n1)CNCc2ccccc2O 270004a_100000185550_100011215050 [0,2,0,0,0,0|2,0,0]=4 27855 B18R2.65882 Cc1cccc(n1)CNCc2ccccc2O 34a_100000185550_100000757606 [0,2,0,0,0,0|2,0,0]=4 27856 B18R2.65882 Cc1cccc(n1)COCc2ccccc2Br 34a_100000690600_100000184730 [0,2,0,0,0,0|1,0,0]=3 27857 B18R2.65882 Cc1cccc(n1)COCc2ccccc2Br 34a_100000756307_100000757606 [0,2,0,0,0,0|1,0,0]=3 27858 B18R2.65882 Cc1cccc(n1)COCc2ccccc2Br 7a_100000756307_100000757606 [0,2,0,0,0,0|1,0,0]=3 27859 B18R2.65882 Cc1cccc(n1)COCc2ccccc2C 34a_100000690600_100000211839 [0,2,0,0,0,0|1,0,0]=3 27860 B18R2.65882 Cc1cccc(n1)COCc2ccccc2C 34a_100000698903_100000757606 [0,2,0,0,0,0|1,0,0]=3 27861 B18R2.65882 Cc1cccc(n1)COCc2ccccc2C 7a_100000698903_100000757606 [0,2,0,0,0,0|1,0,0]=3 27862 B18R2.65882 Cc1cccc(n1)COCc2ccccc2Cl 34a_100000210847_100000757606 [0,2,0,0,0,0|1,0,0]=3 27863 B18R2.65882 Cc1cccc(n1)COCc2ccccc2Cl 34a_100000690600_100000187162 [0,2,0,0,0,0|1,0,0]=3 27864 B18R2.65882 Cc1cccc(n1)COCc2ccccc2Cl 7a_100000210847_100000757606 [0,2,0,0,0,0|1,0,0]=3 27865 B18R2.65882 Cc1cccc(n1)COCc2ccccc2F 34a_100000211962_100000757606 [0,2,0,0,0,0|1,0,0]=3 27866 B18R2.65882 Cc1cccc(n1)COCc2ccccc2F 34a_100000690600_100000211605 [0,2,0,0,0,0|1,0,0]=3 27867 B18R2.65882 Cc1cccc(n1)COCc2ccccc2F 7a_100000211962_100000757606 [0,2,0,0,0,0|1,0,0]=3 27868 B18R2.65882 Cc1cccc(n1)COCc2ccccc2I 34a_100000187465_100000757606 [0,2,0,0,0,0|1,0,0]=3 27869 B18R2.65882 Cc1cccc(n1)COCc2ccccc2I 34a_100000690600_100011215278 [0,2,0,0,0,0|1,0,0]=3 27870 B18R2.65882 Cc1cccc(n1)COCc2ccccc2I 7a_100000187465_100000757606 [0,2,0,0,0,0|1,0,0]=3 27871 B18R2.65882 Cc1cccc(n1)COCc2ccccc2N 34a_100000212039_100000757606 [0,2,0,0,0,0|1,0,0]=3 27872 B18R2.65882 Cc1cccc(n1)COCc2cccnc2Br 34a_100000690600_100010140945 [0,2,0,0,0,0|2,0,0]=4 27873 B18R2.65882 Cc1cccc(n1)COCc2cccnc2Br 34a_100000719692_100000757606 [0,2,0,0,0,0|2,0,0]=4 27874 B18R2.65882 Cc1cccc(n1)COCc2cccnc2Br 7a_100000719692_100000757606 [0,2,0,0,0,0|2,0,0]=4 27875 B18R2.65882 Cc1cccc(n1)COCc2cccnc2C 34a_100000690600_100000732876 [0,2,0,0,0,0|2,0,0]=4 27876 B18R2.65882 Cc1cccc(n1)COCc2cccnc2C 34a_100000729262_100000757606 [0,2,0,0,0,0|2,0,0]=4 27877 B18R2.65882 Cc1cccc(n1)COCc2cccnc2C 7a_100000729262_100000757606 [0,2,0,0,0,0|2,0,0]=4 27878 B18R2.65882 Cc1cccc(n1)COCc2cccnc2Cl 34a_100000690600_100000045678 [0,2,0,0,0,0|2,0,0]=4 27879 B18R2.65882 Cc1cccc(n1)COCc2cccnc2Cl 34a_100000748726_100000757606 [0,2,0,0,0,0|2,0,0]=4 27880 B18R2.65882 Cc1cccc(n1)COCc2cccnc2Cl 7a_100000748726_100000757606 [0,2,0,0,0,0|2,0,0]=4 27881 B18R2.65882 Cc1cccc(n1)COCc2cccnc2F 34a_100000079888_100000757606 [0,2,0,0,0,0|2,0,0]=4 27882 B18R2.65882 Cc1cccc(n1)COCc2cccnc2F 34a_100000690600_100000099810 [0,2,0,0,0,0|2,0,0]=4 27883 B18R2.65882 Cc1cccc(n1)COCc2cccnc2F 7a_100000079888_100000757606 [0,2,0,0,0,0|2,0,0]=4 27884 B18R2.65882 Cc1cccc(n1)COCc2ccncc2C 34a_100000690600_100020672809 [0,2,0,0,0,0|2,0,0]=4 27885 B18R2.65882 Cc1cccc(n1)COCc2ccncc2C 34a_100011997032_100000757606 [0,2,0,0,0,0|2,0,0]=4 27886 B18R2.65882 Cc1cccc(n1)COCc2ccncc2F 34a_100012172863_100000757606 [0,2,0,0,0,0|2,0,0]=4 27887 B18R2.65882 Cc1cccc(n1)COCc2cnccc2C 34a_100000690600_100000690890 [0,2,0,0,0,0|2,0,0]=4 27888 B18R2.65882 Cc1cccc(n1)COCc2cnccc2C 34a_100011996381_100000757606 [0,2,0,0,0,0|2,0,0]=4 27889 B18R2.65882 Cc1cccc(n1)COCc2cnccc2Cl 34a_100000117392_100000757606 [0,2,0,0,0,0|2,0,0]=4 27890 B18R2.65882 Cc1cccc(n1)COCc2ncccc2Br 34a_100000690600_100025702911 [0,2,0,0,0,0|2,0,0]=4 27891 B18R2.65882 Cc1cccc(n1)COCc2ncccc2Br 34a_100011996772_100000757606 [0,2,0,0,0,0|2,0,0]=4 27892 B18R2.65882 Cc1cccc(n1)COCc2ncccc2C 34a_100000690600_100000696600 [0,2,0,0,0,0|2,0,0]=4 27893 B18R2.65882 Cc1cccc(n1)COCc2ncccc2C 34a_100000698912_100000757606 [0,2,0,0,0,0|2,0,0]=4 27894 B18R2.65882 Cc1cccc(n1)COCc2ncccc2Cl 34a_100012002383_100000757606 [0,2,0,0,0,0|2,0,0]=4 27895 B18R2.65882 Cc1cccc(n1)COCc2ncccc2F 34a_100000690600_100000104219 [0,2,0,0,0,0|2,0,0]=4 27896 B18R2.65882 Cc1cccc(n1)COCc2ncccc2F 34a_100011934865_100000757606 [0,2,0,0,0,0|2,0,0]=4 27897 B18R2.65882 Cc1cccc(n1)COCc2ncccc2N 34a_114873767017_100000757606 [0,2,0,0,0,0|2,0,0]=4 27898 B18R2.65882 Cc1cccc(n1)COCc2ncccc2O 34a_100000690600_200020655725 [0,2,0,0,0,0|2,0,0]=4 27899 B18R2.65882 Cc1cccc(n1)CSCc2ccccc2Br 62a_100000184730_100000757606 [0,2,0,0,0,0|1,1,0]=4 27900 B18R2.65882 Cc1cccc(n1)CSCc2ccccc2Br 62a_100000757606_100000184730 [0,2,0,0,0,0|1,1,0]=4 27901 B18R2.65882 Cc1cccc(n1)CSCc2ccccc2C 62a_100000211839_100000757606 [0,2,0,0,0,0|1,1,0]=4 27902 B18R2.65882 Cc1cccc(n1)CSCc2ccccc2C 62a_100000757606_100000211839 [0,2,0,0,0,0|1,1,0]=4 27903 B18R2.65882 Cc1cccc(n1)CSCc2ccccc2Cl 62a_100000187162_100000757606 [0,2,0,0,0,0|1,1,0]=4 27904 B18R2.65882 Cc1cccc(n1)CSCc2ccccc2Cl 62a_100000757606_100000187162 [0,2,0,0,0,0|1,1,0]=4 27905 B18R2.65882 Cc1cccc(n1)CSCc2ccccc2F 62a_100000211605_100000757606 [0,2,0,0,0,0|1,1,0]=4 27906 B18R2.65882 Cc1cccc(n1)CSCc2ccccc2F 62a_100000757606_100000211605 [0,2,0,0,0,0|1,1,0]=4 27907 B18R2.65882 Cc1cccc(n1)CSCc2ccccc2I 62a_100000757606_100011216222 [0,2,0,0,0,0|1,1,0]=4 27908 B18R2.65882 Cc1cccc(n1)CSCc2ccccc2I 62a_100011216222_100000757606 [0,2,0,0,0,0|1,1,0]=4 27909 B18R2.65882 Cc1ccccc1CCNc2cccc(c2)Br 34a_100000210019_100011713688 [0,2,0,0,0,0|2,0,0]=4 27910 B18R2.65882 Cc1ccccc1CCNc2cccc(c2)Cl 34a_100000185859_100011713688 [0,2,0,0,0,0|2,0,0]=4 27911 B18R2.65882 Cc1ccccc1CCNc2cccc(c2)F 34a_100000210047_100011713688 [0,2,0,0,0,0|2,0,0]=4 27912 B18R2.65882 Cc1ccccc1CCNc2cccc(c2)I 34a_100000211102_100011713688 [0,2,0,0,0,0|2,0,0]=4 27913 B18R2.65882 Cc1ccccc1CCNc2cccc(c2)O 34a_100000210217_100011713688 [0,2,0,0,0,0|2,0,0]=4 27914 B18R2.65882 Cc1ccccc1CCOc2cccc(c2)Br 34a_100000210342_100011713688 [0,2,0,0,0,0|2,0,0]=4 27915 B18R2.65882 Cc1ccccc1CCOc2cccc(c2)Br 7a_100000210342_100011713688 [0,2,0,0,0,0|2,0,0]=4 27916 B18R2.65882 Cc1ccccc1CCOc2cccc(c2)Cl 34a_100000210295_100011713688 [0,2,0,0,0,0|2,0,0]=4 27917 B18R2.65882 Cc1ccccc1CCOc2cccc(c2)Cl 7a_100000210295_100011713688 [0,2,0,0,0,0|2,0,0]=4 27918 B18R2.65882 Cc1ccccc1CCOc2cccc(c2)F 34a_100000210426_100011713688 [0,2,0,0,0,0|2,0,0]=4 27919 B18R2.65882 Cc1ccccc1CCOc2cccc(c2)F 7a_100000210426_100011713688 [0,2,0,0,0,0|2,0,0]=4 27920 B18R2.65882 Cc1ccccc1CCOc2cccc(c2)I 34a_100000211634_100011713688 [0,2,0,0,0,0|2,0,0]=4 27921 B18R2.65882 Cc1ccccc1CCOc2cccc(c2)I 7a_100000211634_100011713688 [0,2,0,0,0,0|2,0,0]=4 27922 B18R2.65882 Cc1ccccc1CCOc2cccc(c2)N 34a_100000210217_100011713688 [0,2,0,0,0,0|2,0,0]=4 27923 B18R2.65882 Cc1ccccc1CCSc2cccc(c2)Br 62a_100000691529_100011713688 [0,2,0,0,0,0|2,0,0]=4 27924 B18R2.65882 Cc1ccccc1CCSc2cccc(c2)Br 62a_100011713688_100000691529 [0,2,0,0,0,0|2,0,0]=4 27925 B18R2.65882 Cc1ccccc1CCSc2cccc(c2)Cl 62a_100000699651_100011713688 [0,2,0,0,0,0|2,0,0]=4 27926 B18R2.65882 Cc1ccccc1CCSc2cccc(c2)Cl 62a_100011713688_100000699651 [0,2,0,0,0,0|2,0,0]=4 27927 B18R2.65882 Cc1ccccc1CCSc2cccc(c2)F 62a_100000685547_100011713688 [0,2,0,0,0,0|2,0,0]=4 27928 B18R2.65882 Cc1ccccc1CCSc2cccc(c2)F 62a_100011713688_100000685547 [0,2,0,0,0,0|2,0,0]=4 27929 B18R2.65882 Cc1ccccc1CCSc2cccc(c2)N 62a_100000210019_100011713688 [0,2,0,0,0,0|2,0,0]=4 27930 B18R2.65882 Cc1ccccc1CCSc2cccc(c2)N 62a_100011713688_100000210019 [0,2,0,0,0,0|2,0,0]=4 27931 B18R2.65882 Cc1ccccc1CCSc2cccc(c2)O 62a_100011713688_100000211634 [0,2,0,0,0,0|2,0,0]=4 27932 B18R2.65882 Cc1ccccc1CCSc2cccc(c2)[S] 62a_100011713688_114929384022 [0,2,0,0,0,0|2,0,0]=4 27933 B18R2.65882 Cc1ccccc1CCSc2cccc(c2)[S] 62a_114929384022_100011713688 [0,2,0,0,0,0|2,0,0]=4 27934 B18R2.65882 Cc1ccccc1CNCc2cc(ccn2)Br 270004a_100000174972_100009818557 [0,2,0,0,0,0|2,0,0]=4 27935 B18R2.65882 Cc1ccccc1CNCc2cc(ccn2)Br 34a_100000174972_100010173614 [0,2,0,0,0,0|2,0,0]=4 27936 B18R2.65882 Cc1ccccc1CNCc2cc(ccn2)Cl 270004a_100000174972_100011998288 [0,2,0,0,0,0|2,0,0]=4 27937 B18R2.65882 Cc1ccccc1CNCc2cc(ccn2)Cl 34a_100000174972_100016988179 [0,2,0,0,0,0|2,0,0]=4 27938 B18R2.65882 Cc1ccccc1CNCc2cccc(=O)[nH]2 207a_100000174972_100011935257 [0,2,0,0,0,0|2,0,0]=4 27939 B18R2.65882 Cc1ccccc1CNCc2cccc(=O)[nH]2 2230a_100000696482_100000211839 [0,2,0,0,0,0|2,0,0]=4 27940 B18R2.65882 Cc1ccccc1CNCc2cccc(c2)Br 207a_100000174972_100000210085 [0,2,0,0,0,0|1,0,0]=3 27941 B18R2.65882 Cc1ccccc1CNCc2cccc(c2)Br 207a_100000174977_100000211143 [0,2,0,0,0,0|1,0,0]=3 27942 B18R2.65882 Cc1ccccc1CNCc2cccc(c2)Br 2230a_100000174977_100000211839 [0,2,0,0,0,0|1,0,0]=3 27943 B18R2.65882 Cc1ccccc1CNCc2cccc(c2)Br 270004a_100000174972_100000210085 [0,2,0,0,0,0|1,0,0]=3 27944 B18R2.65882 Cc1ccccc1CNCc2cccc(c2)Br 270004a_100000174977_100000211143 [0,2,0,0,0,0|1,0,0]=3 27945 B18R2.65882 Cc1ccccc1CNCc2cccc(c2)Br 34a_100000174972_100000698116 [0,2,0,0,0,0|1,0,0]=3 27946 B18R2.65882 Cc1ccccc1CNCc2cccc(c2)Br 34a_100000174977_100000211839 [0,2,0,0,0,0|1,0,0]=3 27947 B18R2.65882 Cc1ccccc1CNCc2cccc(c2)Cl 207a_100000174878_100000211143 [0,2,0,0,0,0|1,0,0]=3 27948 B18R2.65882 Cc1ccccc1CNCc2cccc(c2)Cl 207a_100000174972_100000210801 [0,2,0,0,0,0|1,0,0]=3 27949 B18R2.65882 Cc1ccccc1CNCc2cccc(c2)Cl 2230a_100000174878_100000211839 [0,2,0,0,0,0|1,0,0]=3 27950 B18R2.65882 Cc1ccccc1CNCc2cccc(c2)Cl 270004a_100000174878_100000211143 [0,2,0,0,0,0|1,0,0]=3 27951 B18R2.65882 Cc1ccccc1CNCc2cccc(c2)Cl 270004a_100000174972_100000210801 [0,2,0,0,0,0|1,0,0]=3 27952 B18R2.65882 Cc1ccccc1CNCc2cccc(c2)Cl 34a_100000174878_100000211839 [0,2,0,0,0,0|1,0,0]=3 27953 B18R2.65882 Cc1ccccc1CNCc2cccc(c2)Cl 34a_100000174972_100000187163 [0,2,0,0,0,0|1,0,0]=3 27954 B18R2.65882 Cc1ccccc1CNCc2cccc(c2)F 207a_100000174948_100000211143 [0,2,0,0,0,0|1,0,0]=3 27955 B18R2.65882 Cc1ccccc1CNCc2cccc(c2)F 207a_100000174972_100000210812 [0,2,0,0,0,0|1,0,0]=3 27956 B18R2.65882 Cc1ccccc1CNCc2cccc(c2)F 2230a_100000174948_100000211839 [0,2,0,0,0,0|1,0,0]=3 27957 B18R2.65882 Cc1ccccc1CNCc2cccc(c2)F 270004a_100000174948_100000211143 [0,2,0,0,0,0|1,0,0]=3 27958 B18R2.65882 Cc1ccccc1CNCc2cccc(c2)F 270004a_100000174972_100000210812 [0,2,0,0,0,0|1,0,0]=3 27959 B18R2.65882 Cc1ccccc1CNCc2cccc(c2)F 34a_100000174948_100000211839 [0,2,0,0,0,0|1,0,0]=3 27960 B18R2.65882 Cc1ccccc1CNCc2cccc(c2)F 34a_100000174972_100000187166 [0,2,0,0,0,0|1,0,0]=3 27961 B18R2.65882 Cc1ccccc1CNCc2cccc(c2)I 207a_100000106179_100000211143 [0,2,0,0,0,0|1,0,0]=3 27962 B18R2.65882 Cc1ccccc1CNCc2cccc(c2)I 207a_100000174972_100000014684 [0,2,0,0,0,0|1,0,0]=3 27963 B18R2.65882 Cc1ccccc1CNCc2cccc(c2)I 2230a_100000106179_100000211839 [0,2,0,0,0,0|1,0,0]=3 27964 B18R2.65882 Cc1ccccc1CNCc2cccc(c2)I 270004a_100000106179_100000211143 [0,2,0,0,0,0|1,0,0]=3 27965 B18R2.65882 Cc1ccccc1CNCc2cccc(c2)I 270004a_100000174972_100000014684 [0,2,0,0,0,0|1,0,0]=3 27966 B18R2.65882 Cc1ccccc1CNCc2cccc(c2)I 34a_100000106179_100000211839 [0,2,0,0,0,0|1,0,0]=3 27967 B18R2.65882 Cc1ccccc1CNCc2cccc(c2)I 34a_100000174972_100011218688 [0,2,0,0,0,0|1,0,0]=3 27968 B18R2.65882 Cc1ccccc1CNCc2cccc(c2)O 207a_100000174972_100000188321 [0,2,0,0,0,0|1,0,0]=3 27969 B18R2.65882 Cc1ccccc1CNCc2cccc(c2)O 207a_100000743036_100000211143 [0,2,0,0,0,0|1,0,0]=3 27970 B18R2.65882 Cc1ccccc1CNCc2cccc(c2)O 2230a_100000743036_100000211839 [0,2,0,0,0,0|1,0,0]=3 27971 B18R2.65882 Cc1ccccc1CNCc2cccc(c2)O 270004a_100000174972_100000188321 [0,2,0,0,0,0|1,0,0]=3 27972 B18R2.65882 Cc1ccccc1CNCc2cccc(c2)O 270004a_100000743036_100000211143 [0,2,0,0,0,0|1,0,0]=3 27973 B18R2.65882 Cc1ccccc1CNCc2cccc(c2)O 34a_100000174972_100011660834 [0,2,0,0,0,0|1,0,0]=3 27974 B18R2.65882 Cc1ccccc1CNCc2cccc(c2)O 34a_100000743036_100000211839 [0,2,0,0,0,0|1,0,0]=3 27975 B18R2.65882 Cc1ccccc1CNCc2cccc(n2)Br 2230a_100016987751_100000211839 [0,2,0,0,0,0|2,0,0]=4 27976 B18R2.65882 Cc1ccccc1CNCc2cccc(n2)Br 270004a_100000174972_100000688028 [0,2,0,0,0,0|2,0,0]=4 27977 B18R2.65882 Cc1ccccc1CNCc2cccc(n2)Br 34a_100000174972_100009889011 [0,2,0,0,0,0|2,0,0]=4 27978 B18R2.65882 Cc1ccccc1CNCc2cccc(n2)Cl 2230a_100016990191_100000211839 [0,2,0,0,0,0|2,0,0]=4 27979 B18R2.65882 Cc1ccccc1CNCc2cccc(n2)Cl 270004a_100000174972_100011361687 [0,2,0,0,0,0|2,0,0]=4 27980 B18R2.65882 Cc1ccccc1CNCc2cccc(n2)Cl 34a_100000174972_100000086093 [0,2,0,0,0,0|2,0,0]=4 27981 B18R2.65882 Cc1ccccc1CNCc2cccc(n2)F 2230a_100015188798_100000211839 [0,2,0,0,0,0|2,0,0]=4 27982 B18R2.65882 Cc1ccccc1CNCc2cccc(n2)F 270004a_100000174972_100000050434 [0,2,0,0,0,0|2,0,0]=4 27983 B18R2.65882 Cc1ccccc1CNCc2cccc(n2)F 34a_100000174972_100009819644 [0,2,0,0,0,0|2,0,0]=4 27984 B18R2.65882 Cc1ccccc1CNCc2cccc(n2)F 34a_100015188798_100000211839 [0,2,0,0,0,0|2,0,0]=4 27985 B18R2.65882 Cc1ccccc1CNCc2ccnc(c2)Br 2230a_100025757509_100000211839 [0,2,0,0,0,0|2,0,0]=4 27986 B18R2.65882 Cc1ccccc1CNCc2ccnc(c2)Br 270004a_100000174972_100009814634 [0,2,0,0,0,0|2,0,0]=4 27987 B18R2.65882 Cc1ccccc1CNCc2ccnc(c2)Br 270004a_100025757509_100000211143 [0,2,0,0,0,0|2,0,0]=4 27988 B18R2.65882 Cc1ccccc1CNCc2ccnc(c2)Br 34a_100000174972_100010243470 [0,2,0,0,0,0|2,0,0]=4 27989 B18R2.65882 Cc1ccccc1CNCc2ccnc(c2)Br 34a_100025757509_100000211839 [0,2,0,0,0,0|2,0,0]=4 27990 B18R2.65882 Cc1ccccc1CNCc2ccnc(c2)Cl 2230a_100015205668_100000211839 [0,2,0,0,0,0|2,0,0]=4 27991 B18R2.65882 Cc1ccccc1CNCc2ccnc(c2)Cl 270004a_100000174972_100011290808 [0,2,0,0,0,0|2,0,0]=4 27992 B18R2.65882 Cc1ccccc1CNCc2ccnc(c2)Cl 270004a_100015205668_100000211143 [0,2,0,0,0,0|2,0,0]=4 27993 B18R2.65882 Cc1ccccc1CNCc2ccnc(c2)Cl 34a_100000174972_100000764220 [0,2,0,0,0,0|2,0,0]=4 27994 B18R2.65882 Cc1ccccc1CNCc2ccnc(c2)Cl 34a_100015205668_100000211839 [0,2,0,0,0,0|2,0,0]=4 27995 B18R2.65882 Cc1ccccc1CNCc2ccnc(c2)F 2230a_100015188774_100000211839 [0,2,0,0,0,0|2,0,0]=4 27996 B18R2.65882 Cc1ccccc1CNCc2ccnc(c2)F 270004a_100000174972_100000068331 [0,2,0,0,0,0|2,0,0]=4 27997 B18R2.65882 Cc1ccccc1CNCc2ccnc(c2)F 270004a_100015188774_100000211143 [0,2,0,0,0,0|2,0,0]=4 27998 B18R2.65882 Cc1ccccc1CNCc2ccnc(c2)F 34a_100015188774_100000211839 [0,2,0,0,0,0|2,0,0]=4 27999 B18R2.65882 Cc1ccccc1CNCc2ccnc(c2)O 207a_100000174972_100000688113 [0,2,0,0,0,0|2,0,0]=4 28000 B18R2.65882 Cc1ccccc1CNCc2cncc(c2)Br 207a_100000174972_100000687066 [0,2,0,0,0,0|2,0,0]=4 28001 B18R2.65882 Cc1ccccc1CNCc2cncc(c2)Br 207a_100011249555_100000211143 [0,2,0,0,0,0|2,0,0]=4 28002 B18R2.65882 Cc1ccccc1CNCc2cncc(c2)Br 270004a_100000174972_100000687066 [0,2,0,0,0,0|2,0,0]=4 28003 B18R2.65882 Cc1ccccc1CNCc2cncc(c2)Br 270004a_100011249555_100000211143 [0,2,0,0,0,0|2,0,0]=4 28004 B18R2.65882 Cc1ccccc1CNCc2cncc(c2)Br 34a_100000174972_100000738771 [0,2,0,0,0,0|2,0,0]=4 28005 B18R2.65882 Cc1ccccc1CNCc2cncc(c2)Cl 207a_100000174972_100000088910 [0,2,0,0,0,0|2,0,0]=4 28006 B18R2.65882 Cc1ccccc1CNCc2cncc(c2)Cl 207a_200020614424_100000211143 [0,2,0,0,0,0|2,0,0]=4 28007 B18R2.65882 Cc1ccccc1CNCc2cncc(c2)Cl 2230a_200020614424_100000211839 [0,2,0,0,0,0|2,0,0]=4 28008 B18R2.65882 Cc1ccccc1CNCc2cncc(c2)Cl 270004a_100000174972_100000088910 [0,2,0,0,0,0|2,0,0]=4 28009 B18R2.65882 Cc1ccccc1CNCc2cncc(c2)Cl 270004a_200020614424_100000211143 [0,2,0,0,0,0|2,0,0]=4 28010 B18R2.65882 Cc1ccccc1CNCc2cncc(c2)Cl 34a_100000174972_100016992070 [0,2,0,0,0,0|2,0,0]=4 28011 B18R2.65882 Cc1ccccc1CNCc2cncc(c2)F 207a_100000174972_100011361476 [0,2,0,0,0,0|2,0,0]=4 28012 B18R2.65882 Cc1ccccc1CNCc2cncc(c2)F 207a_100011962886_100000211143 [0,2,0,0,0,0|2,0,0]=4 28013 B18R2.65882 Cc1ccccc1CNCc2cncc(c2)F 2230a_100011962886_100000211839 [0,2,0,0,0,0|2,0,0]=4 28014 B18R2.65882 Cc1ccccc1CNCc2cncc(c2)F 270004a_100000174972_100011361476 [0,2,0,0,0,0|2,0,0]=4 28015 B18R2.65882 Cc1ccccc1CNCc2cncc(c2)F 270004a_100011962886_100000211143 [0,2,0,0,0,0|2,0,0]=4 28016 B18R2.65882 Cc1ccccc1CNCc2cncc(c2)F 34a_100000174972_100000725299 [0,2,0,0,0,0|2,0,0]=4 28017 B18R2.65882 Cc1ccccc1CNCc2cncc(c2)F 34a_100011962886_100000211839 [0,2,0,0,0,0|2,0,0]=4 28018 B18R2.65882 Cc1ccccc1CNCc2cncc(c2)O 207a_100000174972_100012187055 [0,2,0,0,0,0|2,0,0]=4 28019 B18R2.65882 Cc1ccccc1CNCc2cncc(c2)O 270004a_100000174972_100012187055 [0,2,0,0,0,0|2,0,0]=4 28020 B18R2.65882 Cc1ccccc1COCc2cc(ccn2)Br 34a_100000698903_100010173614 [0,2,0,0,0,0|1,0,0]=3 28021 B18R2.65882 Cc1ccccc1COCc2cc(ccn2)Br 7a_100000698903_100010173614 [0,2,0,0,0,0|1,0,0]=3 28022 B18R2.65882 Cc1ccccc1COCc2cc(ccn2)Cl 34a_100000698903_100016988179 [0,2,0,0,0,0|1,0,0]=3 28023 B18R2.65882 Cc1ccccc1COCc2cc(ccn2)Cl 34a_100000748867_100000211839 [0,2,0,0,0,0|1,0,0]=3 28024 B18R2.65882 Cc1ccccc1COCc2cc(ccn2)Cl 7a_100000698903_100016988179 [0,2,0,0,0,0|1,0,0]=3 28025 B18R2.65882 Cc1ccccc1COCc2cc(ccn2)N 34a_100000692640_100000211839 [0,2,0,0,0,0|1,0,0]=3 28026 B18R2.65882 Cc1ccccc1COCc2ccc[n+](c2)[O-] 34a_100000037817_100000211839 [0,2,0,0,0,0|1,0,0]=3 28027 B18R2.65882 Cc1ccccc1COCc2ccc[n+](c2)[O-] 7a_100000037817_100000211839 [0,2,0,0,0,0|1,0,0]=3 28028 B18R2.65882 Cc1ccccc1COCc2cccc(c2)Br 34a_100000687537_100000211839 [0,2,0,0,0,0|0,0,0]=2 28029 B18R2.65882 Cc1ccccc1COCc2cccc(c2)Br 34a_100000698903_100000698116 [0,2,0,0,0,0|0,0,0]=2 28030 B18R2.65882 Cc1ccccc1COCc2cccc(c2)Br 7a_100000687537_100000211839 [0,2,0,0,0,0|0,0,0]=2 28031 B18R2.65882 Cc1ccccc1COCc2cccc(c2)Br 7a_100000698903_100000211773 [0,2,0,0,0,0|0,0,0]=2 28032 B18R2.65882 Cc1ccccc1COCc2cccc(c2)Cl 34a_100000241301_100000211839 [0,2,0,0,0,0|0,0,0]=2 28033 B18R2.65882 Cc1ccccc1COCc2cccc(c2)Cl 34a_100000698903_100000187163 [0,2,0,0,0,0|0,0,0]=2 28034 B18R2.65882 Cc1ccccc1COCc2cccc(c2)Cl 7a_100000241301_100000211839 [0,2,0,0,0,0|0,0,0]=2 28035 B18R2.65882 Cc1ccccc1COCc2cccc(c2)Cl 7a_100000698903_100000187163 [0,2,0,0,0,0|0,0,0]=2 28036 B18R2.65882 Cc1ccccc1COCc2cccc(c2)F 34a_100000210976_100000211839 [0,2,0,0,0,0|0,0,0]=2 28037 B18R2.65882 Cc1ccccc1COCc2cccc(c2)F 34a_100000698903_100000187166 [0,2,0,0,0,0|0,0,0]=2 28038 B18R2.65882 Cc1ccccc1COCc2cccc(c2)F 7a_100000210976_100000211839 [0,2,0,0,0,0|0,0,0]=2 28039 B18R2.65882 Cc1ccccc1COCc2cccc(c2)F 7a_100000698903_100000230114 [0,2,0,0,0,0|0,0,0]=2 28040 B18R2.65882 Cc1ccccc1COCc2cccc(c2)I 34a_100000698903_100011218688 [0,2,0,0,0,0|0,0,0]=2 28041 B18R2.65882 Cc1ccccc1COCc2cccc(c2)I 34a_100011215336_100000211839 [0,2,0,0,0,0|0,0,0]=2 28042 B18R2.65882 Cc1ccccc1COCc2cccc(c2)I 7a_100000698903_100011218688 [0,2,0,0,0,0|0,0,0]=2 28043 B18R2.65882 Cc1ccccc1COCc2cccc(c2)I 7a_100011215336_100000211839 [0,2,0,0,0,0|0,0,0]=2 28044 B18R2.65882 Cc1ccccc1COCc2cccc(c2)N 34a_100000211919_100000211839 [0,2,0,0,0,0|0,0,0]=2 28045 B18R2.65882 Cc1ccccc1COCc2cccc(c2)O 34a_100000698903_100011660834 [0,2,0,0,0,0|0,0,0]=2 28046 B18R2.65882 Cc1ccccc1COCc2cccc(c2)O 7a_100000698903_100000084143 [0,2,0,0,0,0|0,0,0]=2 28047 B18R2.65882 Cc1ccccc1COCc2cccc(n2)Br 34a_100000694195_100000211839 [0,2,0,0,0,0|1,0,0]=3 28048 B18R2.65882 Cc1ccccc1COCc2cccc(n2)Br 34a_100000698903_100009889011 [0,2,0,0,0,0|1,0,0]=3 28049 B18R2.65882 Cc1ccccc1COCc2cccc(n2)Br 7a_100000698903_100009889011 [0,2,0,0,0,0|1,0,0]=3 28050 B18R2.65882 Cc1ccccc1COCc2cccc(n2)Cl 34a_100000698903_100000086093 [0,2,0,0,0,0|1,0,0]=3 28051 B18R2.65882 Cc1ccccc1COCc2cccc(n2)Cl 34a_100011998359_100000211839 [0,2,0,0,0,0|1,0,0]=3 28052 B18R2.65882 Cc1ccccc1COCc2cccc(n2)Cl 7a_100000698903_100000086093 [0,2,0,0,0,0|1,0,0]=3 28053 B18R2.65882 Cc1ccccc1COCc2cccc(n2)F 34a_100000086748_100000211839 [0,2,0,0,0,0|1,0,0]=3 28054 B18R2.65882 Cc1ccccc1COCc2cccc(n2)F 34a_100000698903_100009819644 [0,2,0,0,0,0|1,0,0]=3 28055 B18R2.65882 Cc1ccccc1COCc2cccc(n2)F 7a_100000698903_100009819644 [0,2,0,0,0,0|1,0,0]=3 28056 B18R2.65882 Cc1ccccc1COCc2ccnc(c2)Br 34a_100000698903_100010243470 [0,2,0,0,0,0|1,0,0]=3 28057 B18R2.65882 Cc1ccccc1COCc2ccnc(c2)Br 34a_100009814636_100000211839 [0,2,0,0,0,0|1,0,0]=3 28058 B18R2.65882 Cc1ccccc1COCc2ccnc(c2)Br 7a_100000698903_100010254460 [0,2,0,0,0,0|1,0,0]=3 28059 B18R2.65882 Cc1ccccc1COCc2ccnc(c2)Br 7a_100009814636_100000211839 [0,2,0,0,0,0|1,0,0]=3 28060 B18R2.65882 Cc1ccccc1COCc2ccnc(c2)Cl 34a_100000698903_100000764220 [0,2,0,0,0,0|1,0,0]=3 28061 B18R2.65882 Cc1ccccc1COCc2ccnc(c2)Cl 34a_100000748751_100000211839 [0,2,0,0,0,0|1,0,0]=3 28062 B18R2.65882 Cc1ccccc1COCc2ccnc(c2)Cl 7a_100000698903_100000764220 [0,2,0,0,0,0|1,0,0]=3 28063 B18R2.65882 Cc1ccccc1COCc2ccnc(c2)F 34a_100000082451_100000211839 [0,2,0,0,0,0|1,0,0]=3 28064 B18R2.65882 Cc1ccccc1COCc2ccnc(n2)Cl 34a_100000698903_100000099655 [0,2,0,0,0,0|2,0,0]=4 28065 B18R2.65882 Cc1ccccc1COCc2ccnc(n2)Cl 7a_100000698903_100000099655 [0,2,0,0,0,0|2,0,0]=4 28066 B18R2.65882 Cc1ccccc1COCc2cncc(c2)Br 34a_100000698903_100000738771 [0,2,0,0,0,0|1,0,0]=3 28067 B18R2.65882 Cc1ccccc1COCc2cncc(c2)Br 34a_100011259137_100000211839 [0,2,0,0,0,0|1,0,0]=3 28068 B18R2.65882 Cc1ccccc1COCc2cncc(c2)Br 7a_100000698903_100000738771 [0,2,0,0,0,0|1,0,0]=3 28069 B18R2.65882 Cc1ccccc1COCc2cncc(c2)Br 7a_100011259137_100000211839 [0,2,0,0,0,0|1,0,0]=3 28070 B18R2.65882 Cc1ccccc1COCc2cncc(c2)Cl 34a_100000092867_100000211839 [0,2,0,0,0,0|1,0,0]=3 28071 B18R2.65882 Cc1ccccc1COCc2cncc(c2)Cl 34a_100000698903_100016992070 [0,2,0,0,0,0|1,0,0]=3 28072 B18R2.65882 Cc1ccccc1COCc2cncc(c2)Cl 7a_100000092867_100000211839 [0,2,0,0,0,0|1,0,0]=3 28073 B18R2.65882 Cc1ccccc1COCc2cncc(c2)Cl 7a_100000698903_100016992070 [0,2,0,0,0,0|1,0,0]=3 28074 B18R2.65882 Cc1ccccc1COCc2cncc(c2)F 34a_100000698903_100000725299 [0,2,0,0,0,0|1,0,0]=3 28075 B18R2.65882 Cc1ccccc1COCc2cncc(c2)F 34a_100011962875_100000211839 [0,2,0,0,0,0|1,0,0]=3 28076 B18R2.65882 Cc1ccccc1COCc2cncc(c2)F 7a_100000698903_100000725299 [0,2,0,0,0,0|1,0,0]=3 28077 B18R2.65882 Cc1ccccc1COCc2cncc(c2)F 7a_100011962875_100000211839 [0,2,0,0,0,0|1,0,0]=3 28078 B18R2.65882 Cc1ccccc1COCc2cncc(c2)N 34a_100000085308_100000211839 [0,2,0,0,0,0|1,0,0]=3 28079 B18R2.65882 Cc1ccccc1CSCc2cc(ccn2)Br 62a_100000211839_100010173614 [0,2,0,0,0,0|1,1,0]=4 28080 B18R2.65882 Cc1ccccc1CSCc2cc(ccn2)Br 62a_100010173614_100000211839 [0,2,0,0,0,0|1,1,0]=4 28081 B18R2.65882 Cc1ccccc1CSCc2cc(ccn2)Cl 62a_100000211839_100016988179 [0,2,0,0,0,0|1,1,0]=4 28082 B18R2.65882 Cc1ccccc1CSCc2cc(ccn2)Cl 62a_100016988179_100000211839 [0,2,0,0,0,0|1,1,0]=4 28083 B18R2.65882 Cc1ccccc1CSCc2cccc(c2)Br 62a_100000211773_100000211839 [0,2,0,0,0,0|0,1,0]=3 28084 B18R2.65882 Cc1ccccc1CSCc2cccc(c2)Br 62a_100000211839_100000211773 [0,2,0,0,0,0|0,1,0]=3 28085 B18R2.65882 Cc1ccccc1CSCc2cccc(c2)Cl 62a_100000187163_100000211839 [0,2,0,0,0,0|0,1,0]=3 28086 B18R2.65882 Cc1ccccc1CSCc2cccc(c2)Cl 62a_100000211839_100000187163 [0,2,0,0,0,0|0,1,0]=3 28087 B18R2.65882 Cc1ccccc1CSCc2cccc(c2)F 62a_100000211839_100000230114 [0,2,0,0,0,0|0,1,0]=3 28088 B18R2.65882 Cc1ccccc1CSCc2cccc(c2)F 62a_100000230114_100000211839 [0,2,0,0,0,0|0,1,0]=3 28089 B18R2.65882 Cc1ccccc1CSCc2cccc(c2)I 62a_100000211839_100011218688 [0,2,0,0,0,0|0,1,0]=3 28090 B18R2.65882 Cc1ccccc1CSCc2cccc(c2)I 62a_100011218688_100000211839 [0,2,0,0,0,0|0,1,0]=3 28091 B18R2.65882 Cc1ccccc1CSCc2cccc(c2)O 62a_100000211839_100011660834 [0,2,0,0,0,0|0,1,0]=3 28092 B18R2.65882 Cc1ccccc1CSCc2cccc(c2)O 62a_100011660834_100000211839 [0,2,0,0,0,0|0,1,0]=3 28093 B18R2.65882 Cc1ccccc1CSCc2cccc(n2)Br 62a_100000211839_100009889011 [0,2,0,0,0,0|1,1,0]=4 28094 B18R2.65882 Cc1ccccc1CSCc2cccc(n2)Br 62a_100009889011_100000211839 [0,2,0,0,0,0|1,1,0]=4 28095 B18R2.65882 Cc1ccccc1CSCc2cccc(n2)Cl 62a_100000086093_100000211839 [0,2,0,0,0,0|1,1,0]=4 28096 B18R2.65882 Cc1ccccc1CSCc2cccc(n2)Cl 62a_100000211839_100000086093 [0,2,0,0,0,0|1,1,0]=4 28097 B18R2.65882 Cc1ccccc1CSCc2cccc(n2)F 62a_100000211839_100009819644 [0,2,0,0,0,0|1,1,0]=4 28098 B18R2.65882 Cc1ccccc1CSCc2cccc(n2)F 62a_100009819644_100000211839 [0,2,0,0,0,0|1,1,0]=4 28099 B18R2.65882 Cc1ccccc1CSCc2ccnc(c2)Br 62a_100000211839_100010243470 [0,2,0,0,0,0|1,1,0]=4 28100 B18R2.65882 Cc1ccccc1CSCc2ccnc(c2)Br 62a_100010254460_100000211839 [0,2,0,0,0,0|1,1,0]=4 28101 B18R2.65882 Cc1ccccc1CSCc2ccnc(c2)Cl 62a_100000211839_100000764220 [0,2,0,0,0,0|1,1,0]=4 28102 B18R2.65882 Cc1ccccc1CSCc2ccnc(c2)Cl 62a_100000764220_100000211839 [0,2,0,0,0,0|1,1,0]=4 28103 B18R2.65882 Cc1ccccc1CSCc2cncc(c2)Br 62a_100000211839_100000738771 [0,2,0,0,0,0|1,1,0]=4 28104 B18R2.65882 Cc1ccccc1CSCc2cncc(c2)Br 62a_100000738771_100000211839 [0,2,0,0,0,0|1,1,0]=4 28105 B18R2.65882 Cc1ccccc1CSCc2cncc(c2)Cl 62a_100000211839_100016992070 [0,2,0,0,0,0|1,1,0]=4 28106 B18R2.65882 Cc1ccccc1CSCc2cncc(c2)Cl 62a_100016992070_100000211839 [0,2,0,0,0,0|1,1,0]=4 28107 B18R2.65882 Cc1ccccc1CSCc2cncc(c2)F 62a_100000211839_100000725299 [0,2,0,0,0,0|1,1,0]=4 28108 B18R2.65882 Cc1ccccc1CSCc2cncc(c2)F 62a_100000725299_100000211839 [0,2,0,0,0,0|1,1,0]=4 28109 B18R2.65882 Cc1ccccc1NCCc2cccc(c2)Br 34a_100015192222_100011740638 [0,2,0,0,0,0|2,0,0]=4 28110 B18R2.65882 Cc1ccccc1NCCc2cccc(c2)Cl 34a_100015192222_100011713710 [0,2,0,0,0,0|2,0,0]=4 28111 B18R2.65882 Cc1ccccc1NCCc2cccc(c2)F 34a_100015192222_100011217235 [0,2,0,0,0,0|2,0,0]=4 28112 B18R2.65882 Cc1ccccc1OCCc2cccc(c2)Br 34a_100000210338_100011740638 [0,2,0,0,0,0|2,0,0]=4 28113 B18R2.65882 Cc1ccccc1OCCc2cccc(c2)Br 7a_100000210338_100011740638 [0,2,0,0,0,0|2,0,0]=4 28114 B18R2.65882 Cc1ccccc1OCCc2cccc(c2)Cl 34a_100000210338_100011713710 [0,2,0,0,0,0|2,0,0]=4 28115 B18R2.65882 Cc1ccccc1OCCc2cccc(c2)Cl 7a_100000210338_100011713710 [0,2,0,0,0,0|2,0,0]=4 28116 B18R2.65882 Cc1ccccc1OCCc2cccc(c2)F 34a_100000210338_100011217235 [0,2,0,0,0,0|2,0,0]=4 28117 B18R2.65882 Cc1ccccc1OCCc2cccc(c2)F 7a_100000210338_100011217235 [0,2,0,0,0,0|2,0,0]=4 28118 B18R2.65882 Cc1ccccc1SCCc2cccc(c2)Br 62a_100000210755_100011740638 [0,2,0,0,0,0|2,0,0]=4 28119 B18R2.65882 Cc1ccccc1SCCc2cccc(c2)Br 62a_100011740638_100000210755 [0,2,0,0,0,0|2,0,0]=4 28120 B18R2.65882 Cc1ccccc1SCCc2cccc(c2)Cl 62a_100000210755_100011713710 [0,2,0,0,0,0|2,0,0]=4 28121 B18R2.65882 Cc1ccccc1SCCc2cccc(c2)Cl 62a_100011713710_100000210755 [0,2,0,0,0,0|2,0,0]=4 28122 B18R2.65882 Cc1ccccc1SCCc2cccc(c2)F 62a_100000210755_100011217235 [0,2,0,0,0,0|2,0,0]=4 28123 B18R2.65882 Cc1ccccc1SCCc2cccc(c2)F 62a_100011217235_100000210755 [0,2,0,0,0,0|2,0,0]=4 28124 B18R2.65882 Cc1cccnc1CNCc2cccc(c2)Br 207a_100000174977_100000698913 [0,2,0,0,0,0|2,0,0]=4 28125 B18R2.65882 Cc1cccnc1CNCc2cccc(c2)Br 2230a_100000174977_100000696600 [0,2,0,0,0,0|2,0,0]=4 28126 B18R2.65882 Cc1cccnc1CNCc2cccc(c2)Br 270004a_100000174977_100000698913 [0,2,0,0,0,0|2,0,0]=4 28127 B18R2.65882 Cc1cccnc1CNCc2cccc(c2)Br 34a_100000174977_100000696600 [0,2,0,0,0,0|2,0,0]=4 28128 B18R2.65882 Cc1cccnc1CNCc2cccc(c2)Br 34a_100011223789_100000698116 [0,2,0,0,0,0|2,0,0]=4 28129 B18R2.65882 Cc1cccnc1CNCc2cccc(c2)Cl 207a_100000174878_100000698913 [0,2,0,0,0,0|2,0,0]=4 28130 B18R2.65882 Cc1cccnc1CNCc2cccc(c2)Cl 2230a_100000174878_100000696600 [0,2,0,0,0,0|2,0,0]=4 28131 B18R2.65882 Cc1cccnc1CNCc2cccc(c2)Cl 270004a_100000174878_100000698913 [0,2,0,0,0,0|2,0,0]=4 28132 B18R2.65882 Cc1cccnc1CNCc2cccc(c2)Cl 34a_100000174878_100000696600 [0,2,0,0,0,0|2,0,0]=4 28133 B18R2.65882 Cc1cccnc1CNCc2cccc(c2)Cl 34a_100011223789_100000187163 [0,2,0,0,0,0|2,0,0]=4 28134 B18R2.65882 Cc1cccnc1CNCc2cccc(c2)F 207a_100000174948_100000698913 [0,2,0,0,0,0|2,0,0]=4 28135 B18R2.65882 Cc1cccnc1CNCc2cccc(c2)F 2230a_100000174948_100000696600 [0,2,0,0,0,0|2,0,0]=4 28136 B18R2.65882 Cc1cccnc1CNCc2cccc(c2)F 270004a_100000174948_100000698913 [0,2,0,0,0,0|2,0,0]=4 28137 B18R2.65882 Cc1cccnc1CNCc2cccc(c2)F 34a_100000174948_100000696600 [0,2,0,0,0,0|2,0,0]=4 28138 B18R2.65882 Cc1cccnc1CNCc2cccc(c2)F 34a_100011223789_100000187166 [0,2,0,0,0,0|2,0,0]=4 28139 B18R2.65882 Cc1cccnc1CNCc2cccc(c2)I 207a_100000106179_100000698913 [0,2,0,0,0,0|2,0,0]=4 28140 B18R2.65882 Cc1cccnc1CNCc2cccc(c2)I 2230a_100000106179_100000696600 [0,2,0,0,0,0|2,0,0]=4 28141 B18R2.65882 Cc1cccnc1CNCc2cccc(c2)I 270004a_100000106179_100000698913 [0,2,0,0,0,0|2,0,0]=4 28142 B18R2.65882 Cc1cccnc1CNCc2cccc(c2)I 34a_100000106179_100000696600 [0,2,0,0,0,0|2,0,0]=4 28143 B18R2.65882 Cc1cccnc1CNCc2cccc(c2)I 34a_100011223789_100011218688 [0,2,0,0,0,0|2,0,0]=4 28144 B18R2.65882 Cc1cccnc1CNCc2cccc(c2)O 207a_100000743036_100000698913 [0,2,0,0,0,0|2,0,0]=4 28145 B18R2.65882 Cc1cccnc1CNCc2cccc(c2)O 2230a_100000743036_100000696600 [0,2,0,0,0,0|2,0,0]=4 28146 B18R2.65882 Cc1cccnc1CNCc2cccc(c2)O 270004a_100000743036_100000698913 [0,2,0,0,0,0|2,0,0]=4 28147 B18R2.65882 Cc1cccnc1CNCc2cccc(c2)O 34a_100000743036_100000696600 [0,2,0,0,0,0|2,0,0]=4 28148 B18R2.65882 Cc1cccnc1CNCc2cccc(c2)O 34a_100011223789_100011660834 [0,2,0,0,0,0|2,0,0]=4 28149 B18R2.65882 Cc1cccnc1COCc2cc(ccn2)Br 34a_100000698912_100010173614 [0,2,0,0,0,0|2,0,0]=4 28150 B18R2.65882 Cc1cccnc1COCc2cc(ccn2)Cl 34a_100000698912_100016988179 [0,2,0,0,0,0|2,0,0]=4 28151 B18R2.65882 Cc1cccnc1COCc2cc(ccn2)Cl 34a_100000748867_100000696600 [0,2,0,0,0,0|2,0,0]=4 28152 B18R2.65882 Cc1cccnc1COCc2cc(ccn2)N 34a_100000692640_100000696600 [0,2,0,0,0,0|2,0,0]=4 28153 B18R2.65882 Cc1cccnc1COCc2ccc[n+](c2)[O-] 34a_100000037817_100000696600 [0,2,0,0,0,0|2,0,0]=4 28154 B18R2.65882 Cc1cccnc1COCc2ccc[n+](c2)[O-] 7a_100000037817_100000696600 [0,2,0,0,0,0|2,0,0]=4 28155 B18R2.65882 Cc1cccnc1COCc2cccc(c2)Br 34a_100000687537_100000696600 [0,2,0,0,0,0|1,0,0]=3 28156 B18R2.65882 Cc1cccnc1COCc2cccc(c2)Br 34a_100000698912_100000698116 [0,2,0,0,0,0|1,0,0]=3 28157 B18R2.65882 Cc1cccnc1COCc2cccc(c2)Br 7a_100000687537_100000696600 [0,2,0,0,0,0|1,0,0]=3 28158 B18R2.65882 Cc1cccnc1COCc2cccc(c2)Cl 34a_100000241301_100000696600 [0,2,0,0,0,0|1,0,0]=3 28159 B18R2.65882 Cc1cccnc1COCc2cccc(c2)Cl 34a_100000698912_100000187163 [0,2,0,0,0,0|1,0,0]=3 28160 B18R2.65882 Cc1cccnc1COCc2cccc(c2)Cl 7a_100000241301_100000696600 [0,2,0,0,0,0|1,0,0]=3 28161 B18R2.65882 Cc1cccnc1COCc2cccc(c2)F 34a_100000210976_100000696600 [0,2,0,0,0,0|1,0,0]=3 28162 B18R2.65882 Cc1cccnc1COCc2cccc(c2)F 34a_100000698912_100000187166 [0,2,0,0,0,0|1,0,0]=3 28163 B18R2.65882 Cc1cccnc1COCc2cccc(c2)F 7a_100000210976_100000696600 [0,2,0,0,0,0|1,0,0]=3 28164 B18R2.65882 Cc1cccnc1COCc2cccc(c2)I 34a_100000698912_100011218688 [0,2,0,0,0,0|1,0,0]=3 28165 B18R2.65882 Cc1cccnc1COCc2cccc(c2)I 34a_100011215336_100000696600 [0,2,0,0,0,0|1,0,0]=3 28166 B18R2.65882 Cc1cccnc1COCc2cccc(c2)I 7a_100011215336_100000696600 [0,2,0,0,0,0|1,0,0]=3 28167 B18R2.65882 Cc1cccnc1COCc2cccc(c2)N 34a_100000211919_100000696600 [0,2,0,0,0,0|1,0,0]=3 28168 B18R2.65882 Cc1cccnc1COCc2cccc(c2)O 34a_100000698912_100011660834 [0,2,0,0,0,0|1,0,0]=3 28169 B18R2.65882 Cc1cccnc1COCc2cccc(n2)Br 34a_100000694195_100000696600 [0,2,0,0,0,0|2,0,0]=4 28170 B18R2.65882 Cc1cccnc1COCc2cccc(n2)Br 34a_100000698912_100009889011 [0,2,0,0,0,0|2,0,0]=4 28171 B18R2.65882 Cc1cccnc1COCc2cccc(n2)Cl 34a_100000698912_100000086093 [0,2,0,0,0,0|2,0,0]=4 28172 B18R2.65882 Cc1cccnc1COCc2cccc(n2)Cl 34a_100011998359_100000696600 [0,2,0,0,0,0|2,0,0]=4 28173 B18R2.65882 Cc1cccnc1COCc2cccc(n2)F 34a_100000086748_100000696600 [0,2,0,0,0,0|2,0,0]=4 28174 B18R2.65882 Cc1cccnc1COCc2cccc(n2)F 34a_100000698912_100009819644 [0,2,0,0,0,0|2,0,0]=4 28175 B18R2.65882 Cc1cccnc1COCc2ccnc(c2)Br 34a_100000698912_100010243470 [0,2,0,0,0,0|2,0,0]=4 28176 B18R2.65882 Cc1cccnc1COCc2ccnc(c2)Br 34a_100009814636_100000696600 [0,2,0,0,0,0|2,0,0]=4 28177 B18R2.65882 Cc1cccnc1COCc2ccnc(c2)Br 7a_100009814636_100000696600 [0,2,0,0,0,0|2,0,0]=4 28178 B18R2.65882 Cc1cccnc1COCc2ccnc(c2)Cl 34a_100000698912_100000764220 [0,2,0,0,0,0|2,0,0]=4 28179 B18R2.65882 Cc1cccnc1COCc2ccnc(c2)Cl 34a_100000748751_100000696600 [0,2,0,0,0,0|2,0,0]=4 28180 B18R2.65882 Cc1cccnc1COCc2ccnc(c2)F 34a_100000082451_100000696600 [0,2,0,0,0,0|2,0,0]=4 28181 B18R2.65882 Cc1cccnc1COCc2cncc(c2)Br 34a_100000698912_100000738771 [0,2,0,0,0,0|2,0,0]=4 28182 B18R2.65882 Cc1cccnc1COCc2cncc(c2)Br 34a_100011259137_100000696600 [0,2,0,0,0,0|2,0,0]=4 28183 B18R2.65882 Cc1cccnc1COCc2cncc(c2)Br 7a_100011259137_100000696600 [0,2,0,0,0,0|2,0,0]=4 28184 B18R2.65882 Cc1cccnc1COCc2cncc(c2)Cl 34a_100000092867_100000696600 [0,2,0,0,0,0|2,0,0]=4 28185 B18R2.65882 Cc1cccnc1COCc2cncc(c2)Cl 34a_100000698912_100016992070 [0,2,0,0,0,0|2,0,0]=4 28186 B18R2.65882 Cc1cccnc1COCc2cncc(c2)Cl 7a_100000092867_100000696600 [0,2,0,0,0,0|2,0,0]=4 28187 B18R2.65882 Cc1cccnc1COCc2cncc(c2)F 34a_100000698912_100000725299 [0,2,0,0,0,0|2,0,0]=4 28188 B18R2.65882 Cc1cccnc1COCc2cncc(c2)F 34a_100011962875_100000696600 [0,2,0,0,0,0|2,0,0]=4 28189 B18R2.65882 Cc1cccnc1COCc2cncc(c2)F 7a_100011962875_100000696600 [0,2,0,0,0,0|2,0,0]=4 28190 B18R2.65882 Cc1cccnc1COCc2cncc(c2)N 34a_100000085308_100000696600 [0,2,0,0,0,0|2,0,0]=4 28191 B18R2.65882 Cc1cccnc1CSCc2cccc(c2)Br 62a_100000211773_100000696600 [0,2,0,0,0,0|1,1,0]=4 28192 B18R2.65882 Cc1cccnc1CSCc2cccc(c2)Br 62a_100000696600_100000211773 [0,2,0,0,0,0|1,1,0]=4 28193 B18R2.65882 Cc1cccnc1CSCc2cccc(c2)Cl 62a_100000187163_100000696600 [0,2,0,0,0,0|1,1,0]=4 28194 B18R2.65882 Cc1cccnc1CSCc2cccc(c2)Cl 62a_100000696600_100000187163 [0,2,0,0,0,0|1,1,0]=4 28195 B18R2.65882 Cc1cccnc1CSCc2cccc(c2)F 62a_100000230114_100000696600 [0,2,0,0,0,0|1,1,0]=4 28196 B18R2.65882 Cc1cccnc1CSCc2cccc(c2)F 62a_100000696600_100000230114 [0,2,0,0,0,0|1,1,0]=4 28197 B18R2.65882 Cc1cccnc1CSCc2cccc(c2)I 62a_100000696600_100011218688 [0,2,0,0,0,0|1,1,0]=4 28198 B18R2.65882 Cc1cccnc1CSCc2cccc(c2)I 62a_100011218688_100000696600 [0,2,0,0,0,0|1,1,0]=4 28199 B18R2.65882 Cc1cccnc1CSCc2cccc(c2)O 62a_100000696600_100011660834 [0,2,0,0,0,0|1,1,0]=4 28200 B18R2.65882 Cc1cccnc1CSCc2cccc(c2)O 62a_100011660834_100000696600 [0,2,0,0,0,0|1,1,0]=4 28201 B18R2.65882 Cc1ccnc(c1)CNCc2ccccc2Br 207a_100000689332_100011361488 [0,2,0,0,0,0|2,0,0]=4 28202 B18R2.65882 Cc1ccnc(c1)CNCc2ccccc2Br 2230a_100000689332_100000718516 [0,2,0,0,0,0|2,0,0]=4 28203 B18R2.65882 Cc1ccnc(c1)CNCc2ccccc2Br 270004a_100000689332_100011361488 [0,2,0,0,0,0|2,0,0]=4 28204 B18R2.65882 Cc1ccnc(c1)CNCc2ccccc2Br 34a_100000689332_100000718516 [0,2,0,0,0,0|2,0,0]=4 28205 B18R2.65882 Cc1ccnc(c1)CNCc2ccccc2C 207a_100000174972_100011361488 [0,2,0,0,0,0|2,0,0]=4 28206 B18R2.65882 Cc1ccnc(c1)CNCc2ccccc2C 270004a_100000174972_100011361488 [0,2,0,0,0,0|2,0,0]=4 28207 B18R2.65882 Cc1ccnc(c1)CNCc2ccccc2C 34a_100000174972_100000718516 [0,2,0,0,0,0|2,0,0]=4 28208 B18R2.65882 Cc1ccnc(c1)CNCc2ccccc2Cl 207a_100000174879_100011361488 [0,2,0,0,0,0|2,0,0]=4 28209 B18R2.65882 Cc1ccnc(c1)CNCc2ccccc2Cl 2230a_100000174879_100000718516 [0,2,0,0,0,0|2,0,0]=4 28210 B18R2.65882 Cc1ccnc(c1)CNCc2ccccc2Cl 270004a_100000174879_100011361488 [0,2,0,0,0,0|2,0,0]=4 28211 B18R2.65882 Cc1ccnc(c1)CNCc2ccccc2Cl 34a_100000174879_100000718516 [0,2,0,0,0,0|2,0,0]=4 28212 B18R2.65882 Cc1ccnc(c1)CNCc2ccccc2F 207a_100000174869_100011361488 [0,2,0,0,0,0|2,0,0]=4 28213 B18R2.65882 Cc1ccnc(c1)CNCc2ccccc2F 270004a_100000174869_100011361488 [0,2,0,0,0,0|2,0,0]=4 28214 B18R2.65882 Cc1ccnc(c1)CNCc2ccccc2F 34a_100000174869_100000718516 [0,2,0,0,0,0|2,0,0]=4 28215 B18R2.65882 Cc1ccnc(c1)CNCc2ccccc2I 207a_100015347259_100011361488 [0,2,0,0,0,0|2,0,0]=4 28216 B18R2.65882 Cc1ccnc(c1)CNCc2ccccc2I 270004a_100015347259_100011361488 [0,2,0,0,0,0|2,0,0]=4 28217 B18R2.65882 Cc1ccnc(c1)CNCc2ccccc2O 207a_100000185550_100011361488 [0,2,0,0,0,0|2,0,0]=4 28218 B18R2.65882 Cc1ccnc(c1)CNCc2ccccc2O 270004a_100000185550_100011361488 [0,2,0,0,0,0|2,0,0]=4 28219 B18R2.65882 Cc1ccnc(c1)CNCc2ccccc2O 34a_100000185550_100000718516 [0,2,0,0,0,0|2,0,0]=4 28220 B18R2.65882 Cc1ccnc(c1)COCc2ccccc2Br 34a_100000756307_100000718516 [0,2,0,0,0,0|1,0,0]=3 28221 B18R2.65882 Cc1ccnc(c1)COCc2ccccc2Br 34a_100011998357_100000184730 [0,2,0,0,0,0|1,0,0]=3 28222 B18R2.65882 Cc1ccnc(c1)COCc2ccccc2Br 7a_100000756307_100000718516 [0,2,0,0,0,0|1,0,0]=3 28223 B18R2.65882 Cc1ccnc(c1)COCc2ccccc2C 34a_100000698903_100000718516 [0,2,0,0,0,0|1,0,0]=3 28224 B18R2.65882 Cc1ccnc(c1)COCc2ccccc2C 34a_100011998357_100000211839 [0,2,0,0,0,0|1,0,0]=3 28225 B18R2.65882 Cc1ccnc(c1)COCc2ccccc2C 7a_100000698903_100000718516 [0,2,0,0,0,0|1,0,0]=3 28226 B18R2.65882 Cc1ccnc(c1)COCc2ccccc2Cl 34a_100000210847_100000718516 [0,2,0,0,0,0|1,0,0]=3 28227 B18R2.65882 Cc1ccnc(c1)COCc2ccccc2Cl 34a_100011998357_100000187162 [0,2,0,0,0,0|1,0,0]=3 28228 B18R2.65882 Cc1ccnc(c1)COCc2ccccc2Cl 7a_100000210847_100000718516 [0,2,0,0,0,0|1,0,0]=3 28229 B18R2.65882 Cc1ccnc(c1)COCc2ccccc2F 34a_100000211962_100000718516 [0,2,0,0,0,0|1,0,0]=3 28230 B18R2.65882 Cc1ccnc(c1)COCc2ccccc2F 34a_100011998357_100000211605 [0,2,0,0,0,0|1,0,0]=3 28231 B18R2.65882 Cc1ccnc(c1)COCc2ccccc2F 7a_100000211962_100000718516 [0,2,0,0,0,0|1,0,0]=3 28232 B18R2.65882 Cc1ccnc(c1)COCc2ccccc2I 34a_100000187465_100000718516 [0,2,0,0,0,0|1,0,0]=3 28233 B18R2.65882 Cc1ccnc(c1)COCc2ccccc2I 34a_100011998357_100011215278 [0,2,0,0,0,0|1,0,0]=3 28234 B18R2.65882 Cc1ccnc(c1)COCc2ccccc2I 7a_100000187465_100000718516 [0,2,0,0,0,0|1,0,0]=3 28235 B18R2.65882 Cc1ccnc(c1)COCc2ccccc2N 34a_100000212039_100000718516 [0,2,0,0,0,0|1,0,0]=3 28236 B18R2.65882 Cc1ccnc(c1)COCc2cccnc2Br 34a_100000719692_100000718516 [0,2,0,0,0,0|2,0,0]=4 28237 B18R2.65882 Cc1ccnc(c1)COCc2cccnc2Br 34a_100011998357_100010140945 [0,2,0,0,0,0|2,0,0]=4 28238 B18R2.65882 Cc1ccnc(c1)COCc2cccnc2Br 7a_100000719692_100000718516 [0,2,0,0,0,0|2,0,0]=4 28239 B18R2.65882 Cc1ccnc(c1)COCc2cccnc2C 34a_100000729262_100000718516 [0,2,0,0,0,0|2,0,0]=4 28240 B18R2.65882 Cc1ccnc(c1)COCc2cccnc2C 34a_100011998357_100000732876 [0,2,0,0,0,0|2,0,0]=4 28241 B18R2.65882 Cc1ccnc(c1)COCc2cccnc2C 7a_100000729262_100000718516 [0,2,0,0,0,0|2,0,0]=4 28242 B18R2.65882 Cc1ccnc(c1)COCc2cccnc2Cl 34a_100000748726_100000718516 [0,2,0,0,0,0|2,0,0]=4 28243 B18R2.65882 Cc1ccnc(c1)COCc2cccnc2Cl 34a_100011998357_100000045678 [0,2,0,0,0,0|2,0,0]=4 28244 B18R2.65882 Cc1ccnc(c1)COCc2cccnc2Cl 7a_100000748726_100000718516 [0,2,0,0,0,0|2,0,0]=4 28245 B18R2.65882 Cc1ccnc(c1)COCc2cccnc2F 34a_100000079888_100000718516 [0,2,0,0,0,0|2,0,0]=4 28246 B18R2.65882 Cc1ccnc(c1)COCc2cccnc2F 34a_100011998357_100000099810 [0,2,0,0,0,0|2,0,0]=4 28247 B18R2.65882 Cc1ccnc(c1)COCc2cccnc2F 7a_100000079888_100000718516 [0,2,0,0,0,0|2,0,0]=4 28248 B18R2.65882 Cc1ccnc(c1)COCc2ccncc2C 34a_100011997032_100000718516 [0,2,0,0,0,0|2,0,0]=4 28249 B18R2.65882 Cc1ccnc(c1)COCc2ccncc2C 34a_100011998357_100020672809 [0,2,0,0,0,0|2,0,0]=4 28250 B18R2.65882 Cc1ccnc(c1)COCc2ccncc2F 34a_100012172863_100000718516 [0,2,0,0,0,0|2,0,0]=4 28251 B18R2.65882 Cc1ccnc(c1)COCc2cnccc2C 34a_100011996381_100000718516 [0,2,0,0,0,0|2,0,0]=4 28252 B18R2.65882 Cc1ccnc(c1)COCc2cnccc2C 34a_100011998357_100000690890 [0,2,0,0,0,0|2,0,0]=4 28253 B18R2.65882 Cc1ccnc(c1)COCc2cnccc2Cl 34a_100000117392_100000718516 [0,2,0,0,0,0|2,0,0]=4 28254 B18R2.65882 Cc1ccnc(c1)COCc2ncccc2Br 34a_100011996772_100000718516 [0,2,0,0,0,0|2,0,0]=4 28255 B18R2.65882 Cc1ccnc(c1)COCc2ncccc2Br 34a_100011998357_100025702911 [0,2,0,0,0,0|2,0,0]=4 28256 B18R2.65882 Cc1ccnc(c1)COCc2ncccc2C 34a_100000698912_100000718516 [0,2,0,0,0,0|2,0,0]=4 28257 B18R2.65882 Cc1ccnc(c1)COCc2ncccc2C 34a_100011998357_100000696600 [0,2,0,0,0,0|2,0,0]=4 28258 B18R2.65882 Cc1ccnc(c1)COCc2ncccc2Cl 34a_100012002383_100000718516 [0,2,0,0,0,0|2,0,0]=4 28259 B18R2.65882 Cc1ccnc(c1)COCc2ncccc2F 34a_100011934865_100000718516 [0,2,0,0,0,0|2,0,0]=4 28260 B18R2.65882 Cc1ccnc(c1)COCc2ncccc2F 34a_100011998357_100000104219 [0,2,0,0,0,0|2,0,0]=4 28261 B18R2.65882 Cc1ccnc(c1)COCc2ncccc2N 34a_114873767017_100000718516 [0,2,0,0,0,0|2,0,0]=4 28262 B18R2.65882 Cc1ccnc(c1)COCc2ncccc2O 34a_100011998357_200020655725 [0,2,0,0,0,0|2,0,0]=4 28263 B18R2.65882 Cc1ccnc(c1)CSCc2ccccc2Br 62a_100000184730_100000718516 [0,2,0,0,0,0|1,1,0]=4 28264 B18R2.65882 Cc1ccnc(c1)CSCc2ccccc2Br 62a_100000718516_100000184730 [0,2,0,0,0,0|1,1,0]=4 28265 B18R2.65882 Cc1ccnc(c1)CSCc2ccccc2C 62a_100000211839_100000718516 [0,2,0,0,0,0|1,1,0]=4 28266 B18R2.65882 Cc1ccnc(c1)CSCc2ccccc2C 62a_100000718516_100000211839 [0,2,0,0,0,0|1,1,0]=4 28267 B18R2.65882 Cc1ccnc(c1)CSCc2ccccc2Cl 62a_100000187162_100000718516 [0,2,0,0,0,0|1,1,0]=4 28268 B18R2.65882 Cc1ccnc(c1)CSCc2ccccc2Cl 62a_100000718516_100000187162 [0,2,0,0,0,0|1,1,0]=4 28269 B18R2.65882 Cc1ccnc(c1)CSCc2ccccc2F 62a_100000211605_100000718516 [0,2,0,0,0,0|1,1,0]=4 28270 B18R2.65882 Cc1ccnc(c1)CSCc2ccccc2F 62a_100000718516_100000211605 [0,2,0,0,0,0|1,1,0]=4 28271 B18R2.65882 Cc1ccnc(c1)CSCc2ccccc2I 62a_100000718516_100011216222 [0,2,0,0,0,0|1,1,0]=4 28272 B18R2.65882 Cc1ccnc(c1)CSCc2ccccc2I 62a_100011216222_100000718516 [0,2,0,0,0,0|1,1,0]=4 28273 B18R2.65882 Cc1ccncc1CNCc2cccc(c2)Br 207a_100000174977_100000685662 [0,2,0,0,0,0|2,0,0]=4 28274 B18R2.65882 Cc1ccncc1CNCc2cccc(c2)Br 207a_100011997553_100000210085 [0,2,0,0,0,0|2,0,0]=4 28275 B18R2.65882 Cc1ccncc1CNCc2cccc(c2)Br 2230a_100000174977_100000690890 [0,2,0,0,0,0|2,0,0]=4 28276 B18R2.65882 Cc1ccncc1CNCc2cccc(c2)Br 270004a_100000174977_100000685662 [0,2,0,0,0,0|2,0,0]=4 28277 B18R2.65882 Cc1ccncc1CNCc2cccc(c2)Br 270004a_100011997553_100000210085 [0,2,0,0,0,0|2,0,0]=4 28278 B18R2.65882 Cc1ccncc1CNCc2cccc(c2)Br 34a_100000174977_100000690890 [0,2,0,0,0,0|2,0,0]=4 28279 B18R2.65882 Cc1ccncc1CNCc2cccc(c2)Cl 207a_100000174878_100000685662 [0,2,0,0,0,0|2,0,0]=4 28280 B18R2.65882 Cc1ccncc1CNCc2cccc(c2)Cl 207a_100011997553_100000210801 [0,2,0,0,0,0|2,0,0]=4 28281 B18R2.65882 Cc1ccncc1CNCc2cccc(c2)Cl 2230a_100000174878_100000690890 [0,2,0,0,0,0|2,0,0]=4 28282 B18R2.65882 Cc1ccncc1CNCc2cccc(c2)Cl 270004a_100000174878_100000685662 [0,2,0,0,0,0|2,0,0]=4 28283 B18R2.65882 Cc1ccncc1CNCc2cccc(c2)Cl 270004a_100011997553_100000210801 [0,2,0,0,0,0|2,0,0]=4 28284 B18R2.65882 Cc1ccncc1CNCc2cccc(c2)Cl 34a_100000174878_100000690890 [0,2,0,0,0,0|2,0,0]=4 28285 B18R2.65882 Cc1ccncc1CNCc2cccc(c2)F 207a_100000174948_100000685662 [0,2,0,0,0,0|2,0,0]=4 28286 B18R2.65882 Cc1ccncc1CNCc2cccc(c2)F 207a_100011997553_100000210812 [0,2,0,0,0,0|2,0,0]=4 28287 B18R2.65882 Cc1ccncc1CNCc2cccc(c2)F 2230a_100000174948_100000690890 [0,2,0,0,0,0|2,0,0]=4 28288 B18R2.65882 Cc1ccncc1CNCc2cccc(c2)F 270004a_100000174948_100000685662 [0,2,0,0,0,0|2,0,0]=4 28289 B18R2.65882 Cc1ccncc1CNCc2cccc(c2)F 270004a_100011997553_100000210812 [0,2,0,0,0,0|2,0,0]=4 28290 B18R2.65882 Cc1ccncc1CNCc2cccc(c2)F 34a_100000174948_100000690890 [0,2,0,0,0,0|2,0,0]=4 28291 B18R2.65882 Cc1ccncc1CNCc2cccc(c2)I 207a_100000106179_100000685662 [0,2,0,0,0,0|2,0,0]=4 28292 B18R2.65882 Cc1ccncc1CNCc2cccc(c2)I 207a_100011997553_100000014684 [0,2,0,0,0,0|2,0,0]=4 28293 B18R2.65882 Cc1ccncc1CNCc2cccc(c2)I 2230a_100000106179_100000690890 [0,2,0,0,0,0|2,0,0]=4 28294 B18R2.65882 Cc1ccncc1CNCc2cccc(c2)I 270004a_100000106179_100000685662 [0,2,0,0,0,0|2,0,0]=4 28295 B18R2.65882 Cc1ccncc1CNCc2cccc(c2)I 270004a_100011997553_100000014684 [0,2,0,0,0,0|2,0,0]=4 28296 B18R2.65882 Cc1ccncc1CNCc2cccc(c2)I 34a_100000106179_100000690890 [0,2,0,0,0,0|2,0,0]=4 28297 B18R2.65882 Cc1ccncc1CNCc2cccc(c2)O 207a_100000743036_100000685662 [0,2,0,0,0,0|2,0,0]=4 28298 B18R2.65882 Cc1ccncc1CNCc2cccc(c2)O 207a_100011997553_100000188321 [0,2,0,0,0,0|2,0,0]=4 28299 B18R2.65882 Cc1ccncc1CNCc2cccc(c2)O 2230a_100000743036_100000690890 [0,2,0,0,0,0|2,0,0]=4 28300 B18R2.65882 Cc1ccncc1CNCc2cccc(c2)O 270004a_100000743036_100000685662 [0,2,0,0,0,0|2,0,0]=4 28301 B18R2.65882 Cc1ccncc1CNCc2cccc(c2)O 270004a_100011997553_100000188321 [0,2,0,0,0,0|2,0,0]=4 28302 B18R2.65882 Cc1ccncc1CNCc2cccc(c2)O 34a_100000743036_100000690890 [0,2,0,0,0,0|2,0,0]=4 28303 B18R2.65882 Cc1ccncc1COCc2cc(ccn2)Br 34a_100011996381_100010173614 [0,2,0,0,0,0|2,0,0]=4 28304 B18R2.65882 Cc1ccncc1COCc2cc(ccn2)Cl 34a_100000748867_100000690890 [0,2,0,0,0,0|2,0,0]=4 28305 B18R2.65882 Cc1ccncc1COCc2cc(ccn2)Cl 34a_100011996381_100016988179 [0,2,0,0,0,0|2,0,0]=4 28306 B18R2.65882 Cc1ccncc1COCc2cc(ccn2)N 34a_100000692640_100000690890 [0,2,0,0,0,0|2,0,0]=4 28307 B18R2.65882 Cc1ccncc1COCc2ccc[n+](c2)[O-] 34a_100000037817_100000690890 [0,2,0,0,0,0|2,0,0]=4 28308 B18R2.65882 Cc1ccncc1COCc2ccc[n+](c2)[O-] 7a_100000037817_100000690890 [0,2,0,0,0,0|2,0,0]=4 28309 B18R2.65882 Cc1ccncc1COCc2cccc(c2)Br 34a_100000687537_100000690890 [0,2,0,0,0,0|1,0,0]=3 28310 B18R2.65882 Cc1ccncc1COCc2cccc(c2)Br 34a_100011996381_100000698116 [0,2,0,0,0,0|1,0,0]=3 28311 B18R2.65882 Cc1ccncc1COCc2cccc(c2)Br 7a_100000687537_100000690890 [0,2,0,0,0,0|1,0,0]=3 28312 B18R2.65882 Cc1ccncc1COCc2cccc(c2)Cl 34a_100000241301_100000690890 [0,2,0,0,0,0|1,0,0]=3 28313 B18R2.65882 Cc1ccncc1COCc2cccc(c2)Cl 34a_100011996381_100000187163 [0,2,0,0,0,0|1,0,0]=3 28314 B18R2.65882 Cc1ccncc1COCc2cccc(c2)Cl 7a_100000241301_100000690890 [0,2,0,0,0,0|1,0,0]=3 28315 B18R2.65882 Cc1ccncc1COCc2cccc(c2)F 34a_100000210976_100000690890 [0,2,0,0,0,0|1,0,0]=3 28316 B18R2.65882 Cc1ccncc1COCc2cccc(c2)F 34a_100011996381_100000187166 [0,2,0,0,0,0|1,0,0]=3 28317 B18R2.65882 Cc1ccncc1COCc2cccc(c2)F 7a_100000210976_100000690890 [0,2,0,0,0,0|1,0,0]=3 28318 B18R2.65882 Cc1ccncc1COCc2cccc(c2)I 34a_100011215336_100000690890 [0,2,0,0,0,0|1,0,0]=3 28319 B18R2.65882 Cc1ccncc1COCc2cccc(c2)I 34a_100011996381_100011218688 [0,2,0,0,0,0|1,0,0]=3 28320 B18R2.65882 Cc1ccncc1COCc2cccc(c2)I 7a_100011215336_100000690890 [0,2,0,0,0,0|1,0,0]=3 28321 B18R2.65882 Cc1ccncc1COCc2cccc(c2)N 34a_100000211919_100000690890 [0,2,0,0,0,0|1,0,0]=3 28322 B18R2.65882 Cc1ccncc1COCc2cccc(c2)O 34a_100011996381_100011660834 [0,2,0,0,0,0|1,0,0]=3 28323 B18R2.65882 Cc1ccncc1COCc2cccc(n2)Br 34a_100000694195_100000690890 [0,2,0,0,0,0|2,0,0]=4 28324 B18R2.65882 Cc1ccncc1COCc2cccc(n2)Br 34a_100011996381_100009889011 [0,2,0,0,0,0|2,0,0]=4 28325 B18R2.65882 Cc1ccncc1COCc2cccc(n2)Cl 34a_100011996381_100000086093 [0,2,0,0,0,0|2,0,0]=4 28326 B18R2.65882 Cc1ccncc1COCc2cccc(n2)Cl 34a_100011998359_100000690890 [0,2,0,0,0,0|2,0,0]=4 28327 B18R2.65882 Cc1ccncc1COCc2cccc(n2)F 34a_100000086748_100000690890 [0,2,0,0,0,0|2,0,0]=4 28328 B18R2.65882 Cc1ccncc1COCc2cccc(n2)F 34a_100011996381_100009819644 [0,2,0,0,0,0|2,0,0]=4 28329 B18R2.65882 Cc1ccncc1COCc2ccnc(c2)Br 34a_100009814636_100000690890 [0,2,0,0,0,0|2,0,0]=4 28330 B18R2.65882 Cc1ccncc1COCc2ccnc(c2)Br 34a_100011996381_100010243470 [0,2,0,0,0,0|2,0,0]=4 28331 B18R2.65882 Cc1ccncc1COCc2ccnc(c2)Br 7a_100009814636_100000690890 [0,2,0,0,0,0|2,0,0]=4 28332 B18R2.65882 Cc1ccncc1COCc2ccnc(c2)Cl 34a_100000748751_100000690890 [0,2,0,0,0,0|2,0,0]=4 28333 B18R2.65882 Cc1ccncc1COCc2ccnc(c2)Cl 34a_100011996381_100000764220 [0,2,0,0,0,0|2,0,0]=4 28334 B18R2.65882 Cc1ccncc1COCc2ccnc(c2)F 34a_100000082451_100000690890 [0,2,0,0,0,0|2,0,0]=4 28335 B18R2.65882 Cc1ccncc1COCc2cncc(c2)Br 34a_100011259137_100000690890 [0,2,0,0,0,0|2,0,0]=4 28336 B18R2.65882 Cc1ccncc1COCc2cncc(c2)Br 34a_100011996381_100000738771 [0,2,0,0,0,0|2,0,0]=4 28337 B18R2.65882 Cc1ccncc1COCc2cncc(c2)Br 7a_100011259137_100000690890 [0,2,0,0,0,0|2,0,0]=4 28338 B18R2.65882 Cc1ccncc1COCc2cncc(c2)Cl 34a_100000092867_100000690890 [0,2,0,0,0,0|2,0,0]=4 28339 B18R2.65882 Cc1ccncc1COCc2cncc(c2)Cl 34a_100011996381_100016992070 [0,2,0,0,0,0|2,0,0]=4 28340 B18R2.65882 Cc1ccncc1COCc2cncc(c2)Cl 7a_100000092867_100000690890 [0,2,0,0,0,0|2,0,0]=4 28341 B18R2.65882 Cc1ccncc1COCc2cncc(c2)F 34a_100011962875_100000690890 [0,2,0,0,0,0|2,0,0]=4 28342 B18R2.65882 Cc1ccncc1COCc2cncc(c2)F 34a_100011996381_100000725299 [0,2,0,0,0,0|2,0,0]=4 28343 B18R2.65882 Cc1ccncc1COCc2cncc(c2)F 7a_100011962875_100000690890 [0,2,0,0,0,0|2,0,0]=4 28344 B18R2.65882 Cc1ccncc1COCc2cncc(c2)N 34a_100000085308_100000690890 [0,2,0,0,0,0|2,0,0]=4 28345 B18R2.65882 Cc1ccncc1CSCc2cccc(c2)Br 62a_100000211773_100000690890 [0,2,0,0,0,0|1,1,0]=4 28346 B18R2.65882 Cc1ccncc1CSCc2cccc(c2)Br 62a_100000690890_100000211773 [0,2,0,0,0,0|1,1,0]=4 28347 B18R2.65882 Cc1ccncc1CSCc2cccc(c2)Cl 62a_100000187163_100000690890 [0,2,0,0,0,0|1,1,0]=4 28348 B18R2.65882 Cc1ccncc1CSCc2cccc(c2)Cl 62a_100000690890_100000187163 [0,2,0,0,0,0|1,1,0]=4 28349 B18R2.65882 Cc1ccncc1CSCc2cccc(c2)F 62a_100000230114_100000690890 [0,2,0,0,0,0|1,1,0]=4 28350 B18R2.65882 Cc1ccncc1CSCc2cccc(c2)F 62a_100000690890_100000230114 [0,2,0,0,0,0|1,1,0]=4 28351 B18R2.65882 Cc1ccncc1CSCc2cccc(c2)I 62a_100000690890_100011218688 [0,2,0,0,0,0|1,1,0]=4 28352 B18R2.65882 Cc1ccncc1CSCc2cccc(c2)I 62a_100011218688_100000690890 [0,2,0,0,0,0|1,1,0]=4 28353 B18R2.65882 Cc1ccncc1CSCc2cccc(c2)O 62a_100000690890_100011660834 [0,2,0,0,0,0|1,1,0]=4 28354 B18R2.65882 Cc1ccncc1CSCc2cccc(c2)O 62a_100011660834_100000690890 [0,2,0,0,0,0|1,1,0]=4 28355 B18R2.65882 Cc1cncc(c1)CNCc2ccccc2Br 207a_100000689332_100011998712 [0,2,0,0,0,0|2,0,0]=4 28356 B18R2.65882 Cc1cncc(c1)CNCc2ccccc2Br 207a_100000692839_100000211189 [0,2,0,0,0,0|2,0,0]=4 28357 B18R2.65882 Cc1cncc(c1)CNCc2ccccc2Br 2230a_100000689332_100000716715 [0,2,0,0,0,0|2,0,0]=4 28358 B18R2.65882 Cc1cncc(c1)CNCc2ccccc2Br 2230a_100000692839_100000184730 [0,2,0,0,0,0|2,0,0]=4 28359 B18R2.65882 Cc1cncc(c1)CNCc2ccccc2Br 270004a_100000689332_100011998712 [0,2,0,0,0,0|2,0,0]=4 28360 B18R2.65882 Cc1cncc(c1)CNCc2ccccc2Br 270004a_100000692839_100000211189 [0,2,0,0,0,0|2,0,0]=4 28361 B18R2.65882 Cc1cncc(c1)CNCc2ccccc2Br 34a_100000689332_100000716715 [0,2,0,0,0,0|2,0,0]=4 28362 B18R2.65882 Cc1cncc(c1)CNCc2ccccc2Br 34a_100000692839_100000184730 [0,2,0,0,0,0|2,0,0]=4 28363 B18R2.65882 Cc1cncc(c1)CNCc2ccccc2C 207a_100000174972_100011998712 [0,2,0,0,0,0|2,0,0]=4 28364 B18R2.65882 Cc1cncc(c1)CNCc2ccccc2C 207a_100000692839_100000211143 [0,2,0,0,0,0|2,0,0]=4 28365 B18R2.65882 Cc1cncc(c1)CNCc2ccccc2C 2230a_100000692839_100000211839 [0,2,0,0,0,0|2,0,0]=4 28366 B18R2.65882 Cc1cncc(c1)CNCc2ccccc2C 270004a_100000174972_100011998712 [0,2,0,0,0,0|2,0,0]=4 28367 B18R2.65882 Cc1cncc(c1)CNCc2ccccc2C 270004a_100000692839_100000211143 [0,2,0,0,0,0|2,0,0]=4 28368 B18R2.65882 Cc1cncc(c1)CNCc2ccccc2C 34a_100000174972_100000716715 [0,2,0,0,0,0|2,0,0]=4 28369 B18R2.65882 Cc1cncc(c1)CNCc2ccccc2C 34a_100000692839_100000211839 [0,2,0,0,0,0|2,0,0]=4 28370 B18R2.65882 Cc1cncc(c1)CNCc2ccccc2Cl 207a_100000174879_100011998712 [0,2,0,0,0,0|2,0,0]=4 28371 B18R2.65882 Cc1cncc(c1)CNCc2ccccc2Cl 207a_100000692839_100000210073 [0,2,0,0,0,0|2,0,0]=4 28372 B18R2.65882 Cc1cncc(c1)CNCc2ccccc2Cl 2230a_100000174879_100000716715 [0,2,0,0,0,0|2,0,0]=4 28373 B18R2.65882 Cc1cncc(c1)CNCc2ccccc2Cl 2230a_100000692839_100000187162 [0,2,0,0,0,0|2,0,0]=4 28374 B18R2.65882 Cc1cncc(c1)CNCc2ccccc2Cl 270004a_100000174879_100011998712 [0,2,0,0,0,0|2,0,0]=4 28375 B18R2.65882 Cc1cncc(c1)CNCc2ccccc2Cl 270004a_100000692839_100000210073 [0,2,0,0,0,0|2,0,0]=4 28376 B18R2.65882 Cc1cncc(c1)CNCc2ccccc2Cl 34a_100000174879_100000716715 [0,2,0,0,0,0|2,0,0]=4 28377 B18R2.65882 Cc1cncc(c1)CNCc2ccccc2Cl 34a_100000692839_100000187162 [0,2,0,0,0,0|2,0,0]=4 28378 B18R2.65882 Cc1cncc(c1)CNCc2ccccc2F 207a_100000174869_100011998712 [0,2,0,0,0,0|2,0,0]=4 28379 B18R2.65882 Cc1cncc(c1)CNCc2ccccc2F 207a_100000692839_100000210811 [0,2,0,0,0,0|2,0,0]=4 28380 B18R2.65882 Cc1cncc(c1)CNCc2ccccc2F 2230a_100000692839_100000211605 [0,2,0,0,0,0|2,0,0]=4 28381 B18R2.65882 Cc1cncc(c1)CNCc2ccccc2F 270004a_100000174869_100011998712 [0,2,0,0,0,0|2,0,0]=4 28382 B18R2.65882 Cc1cncc(c1)CNCc2ccccc2F 270004a_100000692839_100000210811 [0,2,0,0,0,0|2,0,0]=4 28383 B18R2.65882 Cc1cncc(c1)CNCc2ccccc2F 34a_100000174869_100000716715 [0,2,0,0,0,0|2,0,0]=4 28384 B18R2.65882 Cc1cncc(c1)CNCc2ccccc2F 34a_100000692839_100000211605 [0,2,0,0,0,0|2,0,0]=4 28385 B18R2.65882 Cc1cncc(c1)CNCc2ccccc2I 207a_100000692839_100000010305 [0,2,0,0,0,0|2,0,0]=4 28386 B18R2.65882 Cc1cncc(c1)CNCc2ccccc2I 207a_100015347259_100011998712 [0,2,0,0,0,0|2,0,0]=4 28387 B18R2.65882 Cc1cncc(c1)CNCc2ccccc2I 2230a_100000692839_100011215278 [0,2,0,0,0,0|2,0,0]=4 28388 B18R2.65882 Cc1cncc(c1)CNCc2ccccc2I 270004a_100000692839_100000010305 [0,2,0,0,0,0|2,0,0]=4 28389 B18R2.65882 Cc1cncc(c1)CNCc2ccccc2I 270004a_100015347259_100011998712 [0,2,0,0,0,0|2,0,0]=4 28390 B18R2.65882 Cc1cncc(c1)CNCc2ccccc2I 34a_100000692839_100011215278 [0,2,0,0,0,0|2,0,0]=4 28391 B18R2.65882 Cc1cncc(c1)CNCc2ccccc2O 207a_100000185550_100011998712 [0,2,0,0,0,0|2,0,0]=4 28392 B18R2.65882 Cc1cncc(c1)CNCc2ccccc2O 270004a_100000185550_100011998712 [0,2,0,0,0,0|2,0,0]=4 28393 B18R2.65882 Cc1cncc(c1)CNCc2ccccc2O 34a_100000185550_100000716715 [0,2,0,0,0,0|2,0,0]=4 28394 B18R2.65882 Cc1cncc(c1)COCc2ccccc2Br 34a_100000756307_100000716715 [0,2,0,0,0,0|1,0,0]=3 28395 B18R2.65882 Cc1cncc(c1)COCc2ccccc2Br 34a_100011998709_100000184730 [0,2,0,0,0,0|1,0,0]=3 28396 B18R2.65882 Cc1cncc(c1)COCc2ccccc2Br 7a_100000756307_100000716715 [0,2,0,0,0,0|1,0,0]=3 28397 B18R2.65882 Cc1cncc(c1)COCc2ccccc2Br 7a_100011998709_100000184730 [0,2,0,0,0,0|1,0,0]=3 28398 B18R2.65882 Cc1cncc(c1)COCc2ccccc2C 34a_100000698903_100000716715 [0,2,0,0,0,0|1,0,0]=3 28399 B18R2.65882 Cc1cncc(c1)COCc2ccccc2C 34a_100011998709_100000211839 [0,2,0,0,0,0|1,0,0]=3 28400 B18R2.65882 Cc1cncc(c1)COCc2ccccc2C 7a_100000698903_100000716715 [0,2,0,0,0,0|1,0,0]=3 28401 B18R2.65882 Cc1cncc(c1)COCc2ccccc2C 7a_100011998709_100000211839 [0,2,0,0,0,0|1,0,0]=3 28402 B18R2.65882 Cc1cncc(c1)COCc2ccccc2Cl 34a_100000210847_100000716715 [0,2,0,0,0,0|1,0,0]=3 28403 B18R2.65882 Cc1cncc(c1)COCc2ccccc2Cl 34a_100011998709_100000187162 [0,2,0,0,0,0|1,0,0]=3 28404 B18R2.65882 Cc1cncc(c1)COCc2ccccc2Cl 7a_100000210847_100000716715 [0,2,0,0,0,0|1,0,0]=3 28405 B18R2.65882 Cc1cncc(c1)COCc2ccccc2Cl 7a_100011998709_100000187162 [0,2,0,0,0,0|1,0,0]=3 28406 B18R2.65882 Cc1cncc(c1)COCc2ccccc2F 34a_100000211962_100000716715 [0,2,0,0,0,0|1,0,0]=3 28407 B18R2.65882 Cc1cncc(c1)COCc2ccccc2F 34a_100011998709_100000211605 [0,2,0,0,0,0|1,0,0]=3 28408 B18R2.65882 Cc1cncc(c1)COCc2ccccc2F 7a_100000211962_100000716715 [0,2,0,0,0,0|1,0,0]=3 28409 B18R2.65882 Cc1cncc(c1)COCc2ccccc2F 7a_100011998709_100000211605 [0,2,0,0,0,0|1,0,0]=3 28410 B18R2.65882 Cc1cncc(c1)COCc2ccccc2I 34a_100000187465_100000716715 [0,2,0,0,0,0|1,0,0]=3 28411 B18R2.65882 Cc1cncc(c1)COCc2ccccc2I 34a_100011998709_100011215278 [0,2,0,0,0,0|1,0,0]=3 28412 B18R2.65882 Cc1cncc(c1)COCc2ccccc2I 7a_100000187465_100000716715 [0,2,0,0,0,0|1,0,0]=3 28413 B18R2.65882 Cc1cncc(c1)COCc2ccccc2I 7a_100011998709_100011215278 [0,2,0,0,0,0|1,0,0]=3 28414 B18R2.65882 Cc1cncc(c1)COCc2ccccc2N 34a_100000212039_100000716715 [0,2,0,0,0,0|1,0,0]=3 28415 B18R2.65882 Cc1cncc(c1)COCc2cccnc2Br 34a_100000719692_100000716715 [0,2,0,0,0,0|2,0,0]=4 28416 B18R2.65882 Cc1cncc(c1)COCc2cccnc2Br 34a_100011998709_100010140945 [0,2,0,0,0,0|2,0,0]=4 28417 B18R2.65882 Cc1cncc(c1)COCc2cccnc2Br 7a_100000719692_100000716715 [0,2,0,0,0,0|2,0,0]=4 28418 B18R2.65882 Cc1cncc(c1)COCc2cccnc2Br 7a_100011998709_100010140945 [0,2,0,0,0,0|2,0,0]=4 28419 B18R2.65882 Cc1cncc(c1)COCc2cccnc2C 34a_100000729262_100000716715 [0,2,0,0,0,0|2,0,0]=4 28420 B18R2.65882 Cc1cncc(c1)COCc2cccnc2C 34a_100011998709_100000732876 [0,2,0,0,0,0|2,0,0]=4 28421 B18R2.65882 Cc1cncc(c1)COCc2cccnc2C 7a_100000729262_100000716715 [0,2,0,0,0,0|2,0,0]=4 28422 B18R2.65882 Cc1cncc(c1)COCc2cccnc2C 7a_100011998709_100000732876 [0,2,0,0,0,0|2,0,0]=4 28423 B18R2.65882 Cc1cncc(c1)COCc2cccnc2Cl 34a_100000748726_100000716715 [0,2,0,0,0,0|2,0,0]=4 28424 B18R2.65882 Cc1cncc(c1)COCc2cccnc2Cl 34a_100011998709_100000045678 [0,2,0,0,0,0|2,0,0]=4 28425 B18R2.65882 Cc1cncc(c1)COCc2cccnc2Cl 7a_100000748726_100000716715 [0,2,0,0,0,0|2,0,0]=4 28426 B18R2.65882 Cc1cncc(c1)COCc2cccnc2Cl 7a_100011998709_100000045678 [0,2,0,0,0,0|2,0,0]=4 28427 B18R2.65882 Cc1cncc(c1)COCc2cccnc2F 34a_100000079888_100000716715 [0,2,0,0,0,0|2,0,0]=4 28428 B18R2.65882 Cc1cncc(c1)COCc2cccnc2F 34a_100011998709_100000099810 [0,2,0,0,0,0|2,0,0]=4 28429 B18R2.65882 Cc1cncc(c1)COCc2cccnc2F 7a_100000079888_100000716715 [0,2,0,0,0,0|2,0,0]=4 28430 B18R2.65882 Cc1cncc(c1)COCc2cccnc2F 7a_100011998709_100000099810 [0,2,0,0,0,0|2,0,0]=4 28431 B18R2.65882 Cc1cncc(c1)COCc2ccncc2C 34a_100011997032_100000716715 [0,2,0,0,0,0|2,0,0]=4 28432 B18R2.65882 Cc1cncc(c1)COCc2ccncc2C 34a_100011998709_100020672809 [0,2,0,0,0,0|2,0,0]=4 28433 B18R2.65882 Cc1cncc(c1)COCc2ccncc2C 7a_100011998709_100020672808 [0,2,0,0,0,0|2,0,0]=4 28434 B18R2.65882 Cc1cncc(c1)COCc2ccncc2Cl 7a_100011998709_100000763264 [0,2,0,0,0,0|2,0,0]=4 28435 B18R2.65882 Cc1cncc(c1)COCc2ccncc2F 34a_100012172863_100000716715 [0,2,0,0,0,0|2,0,0]=4 28436 B18R2.65882 Cc1cncc(c1)COCc2cnccc2C 34a_100011996381_100000716715 [0,2,0,0,0,0|2,0,0]=4 28437 B18R2.65882 Cc1cncc(c1)COCc2cnccc2C 34a_100011998709_100000690890 [0,2,0,0,0,0|2,0,0]=4 28438 B18R2.65882 Cc1cncc(c1)COCc2cnccc2C 7a_100011998709_100000690890 [0,2,0,0,0,0|2,0,0]=4 28439 B18R2.65882 Cc1cncc(c1)COCc2cnccc2Cl 34a_100000117392_100000716715 [0,2,0,0,0,0|2,0,0]=4 28440 B18R2.65882 Cc1cncc(c1)COCc2ncccc2Br 34a_100011996772_100000716715 [0,2,0,0,0,0|2,0,0]=4 28441 B18R2.65882 Cc1cncc(c1)COCc2ncccc2Br 34a_100011998709_100025702911 [0,2,0,0,0,0|2,0,0]=4 28442 B18R2.65882 Cc1cncc(c1)COCc2ncccc2Br 7a_100011998709_100025702911 [0,2,0,0,0,0|2,0,0]=4 28443 B18R2.65882 Cc1cncc(c1)COCc2ncccc2C 34a_100000698912_100000716715 [0,2,0,0,0,0|2,0,0]=4 28444 B18R2.65882 Cc1cncc(c1)COCc2ncccc2C 34a_100011998709_100000696600 [0,2,0,0,0,0|2,0,0]=4 28445 B18R2.65882 Cc1cncc(c1)COCc2ncccc2C 7a_100011998709_100000696600 [0,2,0,0,0,0|2,0,0]=4 28446 B18R2.65882 Cc1cncc(c1)COCc2ncccc2Cl 34a_100012002383_100000716715 [0,2,0,0,0,0|2,0,0]=4 28447 B18R2.65882 Cc1cncc(c1)COCc2ncccc2Cl 7a_100011998709_100000099807 [0,2,0,0,0,0|2,0,0]=4 28448 B18R2.65882 Cc1cncc(c1)COCc2ncccc2F 34a_100011934865_100000716715 [0,2,0,0,0,0|2,0,0]=4 28449 B18R2.65882 Cc1cncc(c1)COCc2ncccc2F 34a_100011998709_100000104219 [0,2,0,0,0,0|2,0,0]=4 28450 B18R2.65882 Cc1cncc(c1)COCc2ncccc2F 7a_100011998709_100000104219 [0,2,0,0,0,0|2,0,0]=4 28451 B18R2.65882 Cc1cncc(c1)COCc2ncccc2N 34a_114873767017_100000716715 [0,2,0,0,0,0|2,0,0]=4 28452 B18R2.65882 Cc1cncc(c1)COCc2ncccc2O 34a_100011998709_200020655725 [0,2,0,0,0,0|2,0,0]=4 28453 B18R2.65882 Cc1cncc(c1)COCc2ncccc2O 7a_100011998709_200020655725 [0,2,0,0,0,0|2,0,0]=4 28454 B18R2.65882 Cc1cncc(c1)CSCc2ccccc2Br 62a_100000184730_100000716715 [0,2,0,0,0,0|1,1,0]=4 28455 B18R2.65882 Cc1cncc(c1)CSCc2ccccc2Br 62a_100000716715_100000184730 [0,2,0,0,0,0|1,1,0]=4 28456 B18R2.65882 Cc1cncc(c1)CSCc2ccccc2C 62a_100000211839_100000716715 [0,2,0,0,0,0|1,1,0]=4 28457 B18R2.65882 Cc1cncc(c1)CSCc2ccccc2C 62a_100000716715_100000211839 [0,2,0,0,0,0|1,1,0]=4 28458 B18R2.65882 Cc1cncc(c1)CSCc2ccccc2Cl 62a_100000187162_100000716715 [0,2,0,0,0,0|1,1,0]=4 28459 B18R2.65882 Cc1cncc(c1)CSCc2ccccc2Cl 62a_100000716715_100000187162 [0,2,0,0,0,0|1,1,0]=4 28460 B18R2.65882 Cc1cncc(c1)CSCc2ccccc2F 62a_100000211605_100000716715 [0,2,0,0,0,0|1,1,0]=4 28461 B18R2.65882 Cc1cncc(c1)CSCc2ccccc2F 62a_100000716715_100000211605 [0,2,0,0,0,0|1,1,0]=4 28462 B18R2.65882 Cc1cncc(c1)CSCc2ccccc2I 62a_100000716715_100011216222 [0,2,0,0,0,0|1,1,0]=4 28463 B18R2.65882 Cc1cncc(c1)CSCc2ccccc2I 62a_100011216222_100000716715 [0,2,0,0,0,0|1,1,0]=4 28464 B18R2.65882 Cc1cnccc1CNCc2cccc(c2)Br 207a_100000708811_100000210085 [0,2,0,0,0,0|2,0,0]=4 28465 B18R2.65882 Cc1cnccc1CNCc2cccc(c2)Br 2230a_100000174977_100020672808 [0,2,0,0,0,0|2,0,0]=4 28466 B18R2.65882 Cc1cnccc1CNCc2cccc(c2)Br 270004a_100000708811_100000210085 [0,2,0,0,0,0|2,0,0]=4 28467 B18R2.65882 Cc1cnccc1CNCc2cccc(c2)Br 34a_100000174977_100020672809 [0,2,0,0,0,0|2,0,0]=4 28468 B18R2.65882 Cc1cnccc1CNCc2cccc(c2)Cl 207a_100000708811_100000210801 [0,2,0,0,0,0|2,0,0]=4 28469 B18R2.65882 Cc1cnccc1CNCc2cccc(c2)Cl 2230a_100000174878_100020672808 [0,2,0,0,0,0|2,0,0]=4 28470 B18R2.65882 Cc1cnccc1CNCc2cccc(c2)Cl 270004a_100000708811_100000210801 [0,2,0,0,0,0|2,0,0]=4 28471 B18R2.65882 Cc1cnccc1CNCc2cccc(c2)Cl 34a_100000174878_100020672809 [0,2,0,0,0,0|2,0,0]=4 28472 B18R2.65882 Cc1cnccc1CNCc2cccc(c2)F 207a_100000708811_100000210812 [0,2,0,0,0,0|2,0,0]=4 28473 B18R2.65882 Cc1cnccc1CNCc2cccc(c2)F 2230a_100000174948_100020672808 [0,2,0,0,0,0|2,0,0]=4 28474 B18R2.65882 Cc1cnccc1CNCc2cccc(c2)F 270004a_100000708811_100000210812 [0,2,0,0,0,0|2,0,0]=4 28475 B18R2.65882 Cc1cnccc1CNCc2cccc(c2)F 34a_100000174948_100020672809 [0,2,0,0,0,0|2,0,0]=4 28476 B18R2.65882 Cc1cnccc1CNCc2cccc(c2)I 207a_100000708811_100000014684 [0,2,0,0,0,0|2,0,0]=4 28477 B18R2.65882 Cc1cnccc1CNCc2cccc(c2)I 2230a_100000106179_100020672808 [0,2,0,0,0,0|2,0,0]=4 28478 B18R2.65882 Cc1cnccc1CNCc2cccc(c2)I 270004a_100000708811_100000014684 [0,2,0,0,0,0|2,0,0]=4 28479 B18R2.65882 Cc1cnccc1CNCc2cccc(c2)I 34a_100000106179_100020672809 [0,2,0,0,0,0|2,0,0]=4 28480 B18R2.65882 Cc1cnccc1CNCc2cccc(c2)O 207a_100000708811_100000188321 [0,2,0,0,0,0|2,0,0]=4 28481 B18R2.65882 Cc1cnccc1CNCc2cccc(c2)O 2230a_100000743036_100020672808 [0,2,0,0,0,0|2,0,0]=4 28482 B18R2.65882 Cc1cnccc1CNCc2cccc(c2)O 270004a_100000708811_100000188321 [0,2,0,0,0,0|2,0,0]=4 28483 B18R2.65882 Cc1cnccc1CNCc2cccc(c2)O 34a_100000743036_100020672809 [0,2,0,0,0,0|2,0,0]=4 28484 B18R2.65882 Cc1cnccc1COCc2cc(ccn2)Br 34a_100011997032_100010173614 [0,2,0,0,0,0|2,0,0]=4 28485 B18R2.65882 Cc1cnccc1COCc2cc(ccn2)Cl 34a_100000748867_100020672809 [0,2,0,0,0,0|2,0,0]=4 28486 B18R2.65882 Cc1cnccc1COCc2cc(ccn2)Cl 34a_100011997032_100016988179 [0,2,0,0,0,0|2,0,0]=4 28487 B18R2.65882 Cc1cnccc1COCc2cc(ccn2)N 34a_100000692640_100020672809 [0,2,0,0,0,0|2,0,0]=4 28488 B18R2.65882 Cc1cnccc1COCc2ccc[n+](c2)[O-] 34a_100000037817_100020672809 [0,2,0,0,0,0|2,0,0]=4 28489 B18R2.65882 Cc1cnccc1COCc2ccc[n+](c2)[O-] 7a_100000037817_100020672808 [0,2,0,0,0,0|2,0,0]=4 28490 B18R2.65882 Cc1cnccc1COCc2cccc(c2)Br 34a_100000687537_100020672809 [0,2,0,0,0,0|1,0,0]=3 28491 B18R2.65882 Cc1cnccc1COCc2cccc(c2)Br 34a_100011997032_100000698116 [0,2,0,0,0,0|1,0,0]=3 28492 B18R2.65882 Cc1cnccc1COCc2cccc(c2)Br 7a_100000687537_100020672808 [0,2,0,0,0,0|1,0,0]=3 28493 B18R2.65882 Cc1cnccc1COCc2cccc(c2)Cl 34a_100000241301_100020672809 [0,2,0,0,0,0|1,0,0]=3 28494 B18R2.65882 Cc1cnccc1COCc2cccc(c2)Cl 34a_100011997032_100000187163 [0,2,0,0,0,0|1,0,0]=3 28495 B18R2.65882 Cc1cnccc1COCc2cccc(c2)Cl 7a_100000241301_100020672808 [0,2,0,0,0,0|1,0,0]=3 28496 B18R2.65882 Cc1cnccc1COCc2cccc(c2)F 34a_100000210976_100020672809 [0,2,0,0,0,0|1,0,0]=3 28497 B18R2.65882 Cc1cnccc1COCc2cccc(c2)F 34a_100011997032_100000187166 [0,2,0,0,0,0|1,0,0]=3 28498 B18R2.65882 Cc1cnccc1COCc2cccc(c2)F 7a_100000210976_100020672808 [0,2,0,0,0,0|1,0,0]=3 28499 B18R2.65882 Cc1cnccc1COCc2cccc(c2)I 34a_100011215336_100020672809 [0,2,0,0,0,0|1,0,0]=3 28500 B18R2.65882 Cc1cnccc1COCc2cccc(c2)I 34a_100011997032_100011218688 [0,2,0,0,0,0|1,0,0]=3 28501 B18R2.65882 Cc1cnccc1COCc2cccc(c2)I 7a_100011215336_100020672808 [0,2,0,0,0,0|1,0,0]=3 28502 B18R2.65882 Cc1cnccc1COCc2cccc(c2)N 34a_100000211919_100020672809 [0,2,0,0,0,0|1,0,0]=3 28503 B18R2.65882 Cc1cnccc1COCc2cccc(c2)O 34a_100011997032_100011660834 [0,2,0,0,0,0|1,0,0]=3 28504 B18R2.65882 Cc1cnccc1COCc2cccc(n2)Br 34a_100000694195_100020672809 [0,2,0,0,0,0|2,0,0]=4 28505 B18R2.65882 Cc1cnccc1COCc2cccc(n2)Br 34a_100011997032_100009889011 [0,2,0,0,0,0|2,0,0]=4 28506 B18R2.65882 Cc1cnccc1COCc2cccc(n2)Cl 34a_100011997032_100000086093 [0,2,0,0,0,0|2,0,0]=4 28507 B18R2.65882 Cc1cnccc1COCc2cccc(n2)Cl 34a_100011998359_100020672809 [0,2,0,0,0,0|2,0,0]=4 28508 B18R2.65882 Cc1cnccc1COCc2cccc(n2)F 34a_100000086748_100020672809 [0,2,0,0,0,0|2,0,0]=4 28509 B18R2.65882 Cc1cnccc1COCc2cccc(n2)F 34a_100011997032_100009819644 [0,2,0,0,0,0|2,0,0]=4 28510 B18R2.65882 Cc1cnccc1COCc2ccnc(c2)Br 34a_100009814636_100020672809 [0,2,0,0,0,0|2,0,0]=4 28511 B18R2.65882 Cc1cnccc1COCc2ccnc(c2)Br 34a_100011997032_100010243470 [0,2,0,0,0,0|2,0,0]=4 28512 B18R2.65882 Cc1cnccc1COCc2ccnc(c2)Br 7a_100009814636_100020672808 [0,2,0,0,0,0|2,0,0]=4 28513 B18R2.65882 Cc1cnccc1COCc2ccnc(c2)Cl 34a_100000748751_100020672809 [0,2,0,0,0,0|2,0,0]=4 28514 B18R2.65882 Cc1cnccc1COCc2ccnc(c2)Cl 34a_100011997032_100000764220 [0,2,0,0,0,0|2,0,0]=4 28515 B18R2.65882 Cc1cnccc1COCc2ccnc(c2)F 34a_100000082451_100020672809 [0,2,0,0,0,0|2,0,0]=4 28516 B18R2.65882 Cc1cnccc1COCc2cncc(c2)Br 34a_100011259137_100020672809 [0,2,0,0,0,0|2,0,0]=4 28517 B18R2.65882 Cc1cnccc1COCc2cncc(c2)Br 34a_100011997032_100000738771 [0,2,0,0,0,0|2,0,0]=4 28518 B18R2.65882 Cc1cnccc1COCc2cncc(c2)Br 7a_100011259137_100020672808 [0,2,0,0,0,0|2,0,0]=4 28519 B18R2.65882 Cc1cnccc1COCc2cncc(c2)Cl 34a_100000092867_100020672809 [0,2,0,0,0,0|2,0,0]=4 28520 B18R2.65882 Cc1cnccc1COCc2cncc(c2)Cl 34a_100011997032_100016992070 [0,2,0,0,0,0|2,0,0]=4 28521 B18R2.65882 Cc1cnccc1COCc2cncc(c2)Cl 7a_100000092867_100020672808 [0,2,0,0,0,0|2,0,0]=4 28522 B18R2.65882 Cc1cnccc1COCc2cncc(c2)F 34a_100011962875_100020672809 [0,2,0,0,0,0|2,0,0]=4 28523 B18R2.65882 Cc1cnccc1COCc2cncc(c2)F 34a_100011997032_100000725299 [0,2,0,0,0,0|2,0,0]=4 28524 B18R2.65882 Cc1cnccc1COCc2cncc(c2)F 7a_100011962875_100020672808 [0,2,0,0,0,0|2,0,0]=4 28525 B18R2.65882 Cc1cnccc1COCc2cncc(c2)N 34a_100000085308_100020672809 [0,2,0,0,0,0|2,0,0]=4 28526 B18R2.65882 Cc1cnccc1CSCc2cccc(c2)Br 62a_100000211773_100020672808 [0,2,0,0,0,0|1,1,0]=4 28527 B18R2.65882 Cc1cnccc1CSCc2cccc(c2)Br 62a_100020672808_100000211773 [0,2,0,0,0,0|1,1,0]=4 28528 B18R2.65882 Cc1cnccc1CSCc2cccc(c2)Cl 62a_100000187163_100020672808 [0,2,0,0,0,0|1,1,0]=4 28529 B18R2.65882 Cc1cnccc1CSCc2cccc(c2)Cl 62a_100020672808_100000187163 [0,2,0,0,0,0|1,1,0]=4 28530 B18R2.65882 Cc1cnccc1CSCc2cccc(c2)F 62a_100000230114_100020672808 [0,2,0,0,0,0|1,1,0]=4 28531 B18R2.65882 Cc1cnccc1CSCc2cccc(c2)F 62a_100020672808_100000230114 [0,2,0,0,0,0|1,1,0]=4 28532 B18R2.65882 Cc1cnccc1CSCc2cccc(c2)I 62a_100011218688_100020672808 [0,2,0,0,0,0|1,1,0]=4 28533 B18R2.65882 Cc1cnccc1CSCc2cccc(c2)I 62a_100020672808_100011218688 [0,2,0,0,0,0|1,1,0]=4 28534 B18R2.65882 Cc1cnccc1CSCc2cccc(c2)O 62a_100011660834_100020672808 [0,2,0,0,0,0|1,1,0]=4 28535 B18R2.65882 Cc1cnccc1CSCc2cccc(c2)O 62a_100020672808_100011660834 [0,2,0,0,0,0|1,1,0]=4 28536 B18R2.65882 Cc1cnnc(c1)COCc2ccccc2Br 34a_100016212594_100000184730 [0,2,0,0,0,0|2,0,0]=4 28537 B18R2.65882 Cc1cnnc(c1)COCc2ccccc2C 34a_100016212594_100000211839 [0,2,0,0,0,0|2,0,0]=4 28538 B18R2.65882 Cc1cnnc(c1)COCc2ccccc2Cl 34a_100016212594_100000187162 [0,2,0,0,0,0|2,0,0]=4 28539 B18R2.65882 Cc1cnnc(c1)COCc2ccccc2F 34a_100016212594_100000211605 [0,2,0,0,0,0|2,0,0]=4 28540 B18R2.65882 Cc1cnnc(c1)COCc2ccccc2I 34a_100016212594_100011215278 [0,2,0,0,0,0|2,0,0]=4 28541 B18R2.65882 Cc1ncccc1CNCc2cccc(c2)Br 207a_100000174977_100000751968 [0,2,0,0,0,0|2,0,0]=4 28542 B18R2.65882 Cc1ncccc1CNCc2cccc(c2)Br 2230a_100000174977_100000732876 [0,2,0,0,0,0|2,0,0]=4 28543 B18R2.65882 Cc1ncccc1CNCc2cccc(c2)Br 270004a_100000174977_100000751968 [0,2,0,0,0,0|2,0,0]=4 28544 B18R2.65882 Cc1ncccc1CNCc2cccc(c2)Br 34a_100000174977_100000732876 [0,2,0,0,0,0|2,0,0]=4 28545 B18R2.65882 Cc1ncccc1CNCc2cccc(c2)Cl 207a_100000174878_100000751968 [0,2,0,0,0,0|2,0,0]=4 28546 B18R2.65882 Cc1ncccc1CNCc2cccc(c2)Cl 2230a_100000174878_100000732876 [0,2,0,0,0,0|2,0,0]=4 28547 B18R2.65882 Cc1ncccc1CNCc2cccc(c2)Cl 270004a_100000174878_100000751968 [0,2,0,0,0,0|2,0,0]=4 28548 B18R2.65882 Cc1ncccc1CNCc2cccc(c2)Cl 34a_100000174878_100000732876 [0,2,0,0,0,0|2,0,0]=4 28549 B18R2.65882 Cc1ncccc1CNCc2cccc(c2)F 207a_100000174948_100000751968 [0,2,0,0,0,0|2,0,0]=4 28550 B18R2.65882 Cc1ncccc1CNCc2cccc(c2)F 2230a_100000174948_100000732876 [0,2,0,0,0,0|2,0,0]=4 28551 B18R2.65882 Cc1ncccc1CNCc2cccc(c2)F 270004a_100000174948_100000751968 [0,2,0,0,0,0|2,0,0]=4 28552 B18R2.65882 Cc1ncccc1CNCc2cccc(c2)F 34a_100000174948_100000732876 [0,2,0,0,0,0|2,0,0]=4 28553 B18R2.65882 Cc1ncccc1CNCc2cccc(c2)I 207a_100000106179_100000751968 [0,2,0,0,0,0|2,0,0]=4 28554 B18R2.65882 Cc1ncccc1CNCc2cccc(c2)I 2230a_100000106179_100000732876 [0,2,0,0,0,0|2,0,0]=4 28555 B18R2.65882 Cc1ncccc1CNCc2cccc(c2)I 270004a_100000106179_100000751968 [0,2,0,0,0,0|2,0,0]=4 28556 B18R2.65882 Cc1ncccc1CNCc2cccc(c2)I 34a_100000106179_100000732876 [0,2,0,0,0,0|2,0,0]=4 28557 B18R2.65882 Cc1ncccc1CNCc2cccc(c2)O 207a_100000743036_100000751968 [0,2,0,0,0,0|2,0,0]=4 28558 B18R2.65882 Cc1ncccc1CNCc2cccc(c2)O 2230a_100000743036_100000732876 [0,2,0,0,0,0|2,0,0]=4 28559 B18R2.65882 Cc1ncccc1CNCc2cccc(c2)O 270004a_100000743036_100000751968 [0,2,0,0,0,0|2,0,0]=4 28560 B18R2.65882 Cc1ncccc1CNCc2cccc(c2)O 34a_100000743036_100000732876 [0,2,0,0,0,0|2,0,0]=4 28561 B18R2.65882 Cc1ncccc1COCc2cc(ccn2)Br 34a_100000729262_100010173614 [0,2,0,0,0,0|2,0,0]=4 28562 B18R2.65882 Cc1ncccc1COCc2cc(ccn2)Br 7a_100000729262_100010173614 [0,2,0,0,0,0|2,0,0]=4 28563 B18R2.65882 Cc1ncccc1COCc2cc(ccn2)Cl 34a_100000729262_100016988179 [0,2,0,0,0,0|2,0,0]=4 28564 B18R2.65882 Cc1ncccc1COCc2cc(ccn2)Cl 34a_100000748867_100000732876 [0,2,0,0,0,0|2,0,0]=4 28565 B18R2.65882 Cc1ncccc1COCc2cc(ccn2)Cl 7a_100000729262_100016988179 [0,2,0,0,0,0|2,0,0]=4 28566 B18R2.65882 Cc1ncccc1COCc2cc(ccn2)N 34a_100000692640_100000732876 [0,2,0,0,0,0|2,0,0]=4 28567 B18R2.65882 Cc1ncccc1COCc2ccc[n+](c2)[O-] 34a_100000037817_100000732876 [0,2,0,0,0,0|2,0,0]=4 28568 B18R2.65882 Cc1ncccc1COCc2ccc[n+](c2)[O-] 7a_100000037817_100000732876 [0,2,0,0,0,0|2,0,0]=4 28569 B18R2.65882 Cc1ncccc1COCc2cccc(c2)Br 34a_100000687537_100000732876 [0,2,0,0,0,0|1,0,0]=3 28570 B18R2.65882 Cc1ncccc1COCc2cccc(c2)Br 34a_100000729262_100000698116 [0,2,0,0,0,0|1,0,0]=3 28571 B18R2.65882 Cc1ncccc1COCc2cccc(c2)Br 7a_100000687537_100000732876 [0,2,0,0,0,0|1,0,0]=3 28572 B18R2.65882 Cc1ncccc1COCc2cccc(c2)Br 7a_100000729262_100000211773 [0,2,0,0,0,0|1,0,0]=3 28573 B18R2.65882 Cc1ncccc1COCc2cccc(c2)Cl 34a_100000241301_100000732876 [0,2,0,0,0,0|1,0,0]=3 28574 B18R2.65882 Cc1ncccc1COCc2cccc(c2)Cl 34a_100000729262_100000187163 [0,2,0,0,0,0|1,0,0]=3 28575 B18R2.65882 Cc1ncccc1COCc2cccc(c2)Cl 7a_100000241301_100000732876 [0,2,0,0,0,0|1,0,0]=3 28576 B18R2.65882 Cc1ncccc1COCc2cccc(c2)Cl 7a_100000729262_100000187163 [0,2,0,0,0,0|1,0,0]=3 28577 B18R2.65882 Cc1ncccc1COCc2cccc(c2)F 34a_100000210976_100000732876 [0,2,0,0,0,0|1,0,0]=3 28578 B18R2.65882 Cc1ncccc1COCc2cccc(c2)F 34a_100000729262_100000187166 [0,2,0,0,0,0|1,0,0]=3 28579 B18R2.65882 Cc1ncccc1COCc2cccc(c2)F 7a_100000210976_100000732876 [0,2,0,0,0,0|1,0,0]=3 28580 B18R2.65882 Cc1ncccc1COCc2cccc(c2)F 7a_100000729262_100000230114 [0,2,0,0,0,0|1,0,0]=3 28581 B18R2.65882 Cc1ncccc1COCc2cccc(c2)I 34a_100000729262_100011218688 [0,2,0,0,0,0|1,0,0]=3 28582 B18R2.65882 Cc1ncccc1COCc2cccc(c2)I 34a_100011215336_100000732876 [0,2,0,0,0,0|1,0,0]=3 28583 B18R2.65882 Cc1ncccc1COCc2cccc(c2)I 7a_100000729262_100011218688 [0,2,0,0,0,0|1,0,0]=3 28584 B18R2.65882 Cc1ncccc1COCc2cccc(c2)I 7a_100011215336_100000732876 [0,2,0,0,0,0|1,0,0]=3 28585 B18R2.65882 Cc1ncccc1COCc2cccc(c2)N 34a_100000211919_100000732876 [0,2,0,0,0,0|1,0,0]=3 28586 B18R2.65882 Cc1ncccc1COCc2cccc(c2)O 34a_100000729262_100011660834 [0,2,0,0,0,0|1,0,0]=3 28587 B18R2.65882 Cc1ncccc1COCc2cccc(c2)O 7a_100000729262_100000084143 [0,2,0,0,0,0|1,0,0]=3 28588 B18R2.65882 Cc1ncccc1COCc2cccc(n2)Br 34a_100000694195_100000732876 [0,2,0,0,0,0|2,0,0]=4 28589 B18R2.65882 Cc1ncccc1COCc2cccc(n2)Br 34a_100000729262_100009889011 [0,2,0,0,0,0|2,0,0]=4 28590 B18R2.65882 Cc1ncccc1COCc2cccc(n2)Br 7a_100000729262_100009889011 [0,2,0,0,0,0|2,0,0]=4 28591 B18R2.65882 Cc1ncccc1COCc2cccc(n2)Cl 34a_100000729262_100000086093 [0,2,0,0,0,0|2,0,0]=4 28592 B18R2.65882 Cc1ncccc1COCc2cccc(n2)Cl 34a_100011998359_100000732876 [0,2,0,0,0,0|2,0,0]=4 28593 B18R2.65882 Cc1ncccc1COCc2cccc(n2)Cl 7a_100000729262_100000086093 [0,2,0,0,0,0|2,0,0]=4 28594 B18R2.65882 Cc1ncccc1COCc2cccc(n2)F 34a_100000086748_100000732876 [0,2,0,0,0,0|2,0,0]=4 28595 B18R2.65882 Cc1ncccc1COCc2cccc(n2)F 34a_100000729262_100009819644 [0,2,0,0,0,0|2,0,0]=4 28596 B18R2.65882 Cc1ncccc1COCc2cccc(n2)F 7a_100000729262_100009819644 [0,2,0,0,0,0|2,0,0]=4 28597 B18R2.65882 Cc1ncccc1COCc2ccnc(c2)Br 34a_100000729262_100010243470 [0,2,0,0,0,0|2,0,0]=4 28598 B18R2.65882 Cc1ncccc1COCc2ccnc(c2)Br 34a_100009814636_100000732876 [0,2,0,0,0,0|2,0,0]=4 28599 B18R2.65882 Cc1ncccc1COCc2ccnc(c2)Br 7a_100000729262_100010254460 [0,2,0,0,0,0|2,0,0]=4 28600 B18R2.65882 Cc1ncccc1COCc2ccnc(c2)Br 7a_100009814636_100000732876 [0,2,0,0,0,0|2,0,0]=4 28601 B18R2.65882 Cc1ncccc1COCc2ccnc(c2)Cl 34a_100000729262_100000764220 [0,2,0,0,0,0|2,0,0]=4 28602 B18R2.65882 Cc1ncccc1COCc2ccnc(c2)Cl 34a_100000748751_100000732876 [0,2,0,0,0,0|2,0,0]=4 28603 B18R2.65882 Cc1ncccc1COCc2ccnc(c2)Cl 7a_100000729262_100000764220 [0,2,0,0,0,0|2,0,0]=4 28604 B18R2.65882 Cc1ncccc1COCc2ccnc(c2)F 34a_100000082451_100000732876 [0,2,0,0,0,0|2,0,0]=4 28605 B18R2.65882 Cc1ncccc1COCc2cncc(c2)Br 34a_100000729262_100000738771 [0,2,0,0,0,0|2,0,0]=4 28606 B18R2.65882 Cc1ncccc1COCc2cncc(c2)Br 34a_100011259137_100000732876 [0,2,0,0,0,0|2,0,0]=4 28607 B18R2.65882 Cc1ncccc1COCc2cncc(c2)Br 7a_100000729262_100000738771 [0,2,0,0,0,0|2,0,0]=4 28608 B18R2.65882 Cc1ncccc1COCc2cncc(c2)Br 7a_100011259137_100000732876 [0,2,0,0,0,0|2,0,0]=4 28609 B18R2.65882 Cc1ncccc1COCc2cncc(c2)Cl 34a_100000092867_100000732876 [0,2,0,0,0,0|2,0,0]=4 28610 B18R2.65882 Cc1ncccc1COCc2cncc(c2)Cl 34a_100000729262_100016992070 [0,2,0,0,0,0|2,0,0]=4 28611 B18R2.65882 Cc1ncccc1COCc2cncc(c2)Cl 7a_100000092867_100000732876 [0,2,0,0,0,0|2,0,0]=4 28612 B18R2.65882 Cc1ncccc1COCc2cncc(c2)Cl 7a_100000729262_100016992070 [0,2,0,0,0,0|2,0,0]=4 28613 B18R2.65882 Cc1ncccc1COCc2cncc(c2)F 34a_100000729262_100000725299 [0,2,0,0,0,0|2,0,0]=4 28614 B18R2.65882 Cc1ncccc1COCc2cncc(c2)F 34a_100011962875_100000732876 [0,2,0,0,0,0|2,0,0]=4 28615 B18R2.65882 Cc1ncccc1COCc2cncc(c2)F 7a_100000729262_100000725299 [0,2,0,0,0,0|2,0,0]=4 28616 B18R2.65882 Cc1ncccc1COCc2cncc(c2)F 7a_100011962875_100000732876 [0,2,0,0,0,0|2,0,0]=4 28617 B18R2.65882 Cc1ncccc1COCc2cncc(c2)N 34a_100000085308_100000732876 [0,2,0,0,0,0|2,0,0]=4 28618 B18R2.65882 Cc1ncccc1CSCc2cccc(c2)Br 62a_100000211773_100000732876 [0,2,0,0,0,0|1,1,0]=4 28619 B18R2.65882 Cc1ncccc1CSCc2cccc(c2)Br 62a_100000732876_100000211773 [0,2,0,0,0,0|1,1,0]=4 28620 B18R2.65882 Cc1ncccc1CSCc2cccc(c2)Cl 62a_100000187163_100000732876 [0,2,0,0,0,0|1,1,0]=4 28621 B18R2.65882 Cc1ncccc1CSCc2cccc(c2)Cl 62a_100000732876_100000187163 [0,2,0,0,0,0|1,1,0]=4 28622 B18R2.65882 Cc1ncccc1CSCc2cccc(c2)F 62a_100000230114_100000732876 [0,2,0,0,0,0|1,1,0]=4 28623 B18R2.65882 Cc1ncccc1CSCc2cccc(c2)F 62a_100000732876_100000230114 [0,2,0,0,0,0|1,1,0]=4 28624 B18R2.65882 Cc1ncccc1CSCc2cccc(c2)I 62a_100000732876_100011218688 [0,2,0,0,0,0|1,1,0]=4 28625 B18R2.65882 Cc1ncccc1CSCc2cccc(c2)I 62a_100011218688_100000732876 [0,2,0,0,0,0|1,1,0]=4 28626 B18R2.65882 Cc1ncccc1CSCc2cccc(c2)O 62a_100000732876_100011660834 [0,2,0,0,0,0|1,1,0]=4 28627 B18R2.65882 Cc1ncccc1CSCc2cccc(c2)O 62a_100011660834_100000732876 [0,2,0,0,0,0|1,1,0]=4 28628 B18R2.65882 Clc1cc(ccn1)CNCc2ccccc2Br 2230a_100000689332_100000764220 [0,2,0,0,0,0|2,0,0]=4 28629 B18R2.65882 Clc1cc(ccn1)CNCc2ccccc2Br 2230a_100015205668_100000184730 [0,2,0,0,0,0|2,0,0]=4 28630 B18R2.65882 Clc1cc(ccn1)CNCc2ccccc2Br 26a_100015205668_100000181306 [0,2,0,0,0,0|2,0,0]=4 28631 B18R2.65882 Clc1cc(ccn1)CNCc2ccccc2Br 270004a_100000689332_100011290808 [0,2,0,0,0,0|2,0,0]=4 28632 B18R2.65882 Clc1cc(ccn1)CNCc2ccccc2Br 270004a_100015205668_100000211189 [0,2,0,0,0,0|2,0,0]=4 28633 B18R2.65882 Clc1cc(ccn1)CNCc2ccccc2Br 34a_100000689332_100000764220 [0,2,0,0,0,0|2,0,0]=4 28634 B18R2.65882 Clc1cc(ccn1)CNCc2ccccc2Br 34a_100015205668_100000184730 [0,2,0,0,0,0|2,0,0]=4 28635 B18R2.65882 Clc1cc(ccn1)CNCc2ccccc2Cl 2230a_100000174879_100000764220 [0,2,0,0,0,0|2,0,0]=4 28636 B18R2.65882 Clc1cc(ccn1)CNCc2ccccc2Cl 2230a_100015205668_100000187162 [0,2,0,0,0,0|2,0,0]=4 28637 B18R2.65882 Clc1cc(ccn1)CNCc2ccccc2Cl 26a_100015205668_100000210172 [0,2,0,0,0,0|2,0,0]=4 28638 B18R2.65882 Clc1cc(ccn1)CNCc2ccccc2Cl 270004a_100000174879_100011290808 [0,2,0,0,0,0|2,0,0]=4 28639 B18R2.65882 Clc1cc(ccn1)CNCc2ccccc2Cl 270004a_100015205668_100000210073 [0,2,0,0,0,0|2,0,0]=4 28640 B18R2.65882 Clc1cc(ccn1)CNCc2ccccc2Cl 34a_100000174879_100000764220 [0,2,0,0,0,0|2,0,0]=4 28641 B18R2.65882 Clc1cc(ccn1)CNCc2ccccc2Cl 34a_100015205668_100000187162 [0,2,0,0,0,0|2,0,0]=4 28642 B18R2.65882 Clc1cc(ccn1)CNCc2ccccc2I 2230a_100015205668_100011215278 [0,2,0,0,0,0|2,0,0]=4 28643 B18R2.65882 Clc1cc(ccn1)CNCc2ccccc2I 270004a_100015205668_100000010305 [0,2,0,0,0,0|2,0,0]=4 28644 B18R2.65882 Clc1cc(ccn1)CNCc2ccccc2I 270004a_100015347259_100011290808 [0,2,0,0,0,0|2,0,0]=4 28645 B18R2.65882 Clc1cc(ccn1)CNCc2ccccc2I 34a_100015205668_100011215278 [0,2,0,0,0,0|2,0,0]=4 28646 B18R2.65882 Clc1cc(ccn1)COCc2ccccc2Br 34a_100000748751_100000184730 [0,2,0,0,0,0|1,0,0]=3 28647 B18R2.65882 Clc1cc(ccn1)COCc2ccccc2Br 34a_100000756307_100000764220 [0,2,0,0,0,0|1,0,0]=3 28648 B18R2.65882 Clc1cc(ccn1)COCc2ccccc2Br 7a_100000756307_100000764220 [0,2,0,0,0,0|1,0,0]=3 28649 B18R2.65882 Clc1cc(ccn1)COCc2ccccc2Cl 34a_100000210847_100000764220 [0,2,0,0,0,0|1,0,0]=3 28650 B18R2.65882 Clc1cc(ccn1)COCc2ccccc2Cl 34a_100000748751_100000187162 [0,2,0,0,0,0|1,0,0]=3 28651 B18R2.65882 Clc1cc(ccn1)COCc2ccccc2Cl 7a_100000210847_100000764220 [0,2,0,0,0,0|1,0,0]=3 28652 B18R2.65882 Clc1cc(ccn1)COCc2ccccc2I 34a_100000187465_100000764220 [0,2,0,0,0,0|1,0,0]=3 28653 B18R2.65882 Clc1cc(ccn1)COCc2ccccc2I 34a_100000748751_100011215278 [0,2,0,0,0,0|1,0,0]=3 28654 B18R2.65882 Clc1cc(ccn1)COCc2ccccc2I 7a_100000187465_100000764220 [0,2,0,0,0,0|1,0,0]=3 28655 B18R2.65882 Clc1cc(ccn1)COCc2cccnc2Br 34a_100000719692_100000764220 [0,2,0,0,0,0|2,0,0]=4 28656 B18R2.65882 Clc1cc(ccn1)COCc2cccnc2Br 34a_100000748751_100010140945 [0,2,0,0,0,0|2,0,0]=4 28657 B18R2.65882 Clc1cc(ccn1)COCc2cccnc2Br 7a_100000719692_100000764220 [0,2,0,0,0,0|2,0,0]=4 28658 B18R2.65882 Clc1cc(ccn1)COCc2cccnc2Cl 34a_100000748726_100000764220 [0,2,0,0,0,0|2,0,0]=4 28659 B18R2.65882 Clc1cc(ccn1)COCc2cccnc2Cl 34a_100000748751_100000045678 [0,2,0,0,0,0|2,0,0]=4 28660 B18R2.65882 Clc1cc(ccn1)COCc2cccnc2Cl 7a_100000748726_100000764220 [0,2,0,0,0,0|2,0,0]=4 28661 B18R2.65882 Clc1cc(ccn1)COCc2cnccc2Cl 34a_100000117392_100000764220 [0,2,0,0,0,0|2,0,0]=4 28662 B18R2.65882 Clc1cc(ccn1)COCc2ncccc2Br 34a_100000748751_100025702911 [0,2,0,0,0,0|2,0,0]=4 28663 B18R2.65882 Clc1cc(ccn1)COCc2ncccc2Br 34a_100011996772_100000764220 [0,2,0,0,0,0|2,0,0]=4 28664 B18R2.65882 Clc1cc(ccn1)COCc2ncccc2Cl 34a_100012002383_100000764220 [0,2,0,0,0,0|2,0,0]=4 28665 B18R2.65882 Clc1cc(ccn1)CSCc2ccccc2Br 62a_100000184730_100000764220 [0,2,0,0,0,0|1,1,0]=4 28666 B18R2.65882 Clc1cc(ccn1)CSCc2ccccc2Br 62a_100000764220_100000184730 [0,2,0,0,0,0|1,1,0]=4 28667 B18R2.65882 Clc1cc(ccn1)CSCc2ccccc2Cl 62a_100000187162_100000764220 [0,2,0,0,0,0|1,1,0]=4 28668 B18R2.65882 Clc1cc(ccn1)CSCc2ccccc2Cl 62a_100000764220_100000187162 [0,2,0,0,0,0|1,1,0]=4 28669 B18R2.65882 Clc1cc(ccn1)CSCc2ccccc2I 62a_100000764220_100011216222 [0,2,0,0,0,0|1,1,0]=4 28670 B18R2.65882 Clc1cc(ccn1)CSCc2ccccc2I 62a_100011216222_100000764220 [0,2,0,0,0,0|1,1,0]=4 28671 B18R2.65882 Clc1cccc(c1)CCNc2ccccc2Br 34a_100000210017_100011713710 [0,2,0,0,0,0|2,0,0]=4 28672 B18R2.65882 Clc1cccc(c1)CCNc2ccccc2Cl 34a_100000185783_100011713710 [0,2,0,0,0,0|2,0,0]=4 28673 B18R2.65882 Clc1cccc(c1)CCNc2ccccc2I 34a_100000210053_100011713710 [0,2,0,0,0,0|2,0,0]=4 28674 B18R2.65882 Clc1cccc(c1)CCOc2ccccc2Br 34a_100000181306_100011713710 [0,2,0,0,0,0|2,0,0]=4 28675 B18R2.65882 Clc1cccc(c1)CCOc2ccccc2Br 7a_100000181306_100011713710 [0,2,0,0,0,0|2,0,0]=4 28676 B18R2.65882 Clc1cccc(c1)CCOc2ccccc2Cl 34a_100000210172_100011713710 [0,2,0,0,0,0|2,0,0]=4 28677 B18R2.65882 Clc1cccc(c1)CCOc2ccccc2Cl 7a_100000210172_100011713710 [0,2,0,0,0,0|2,0,0]=4 28678 B18R2.65882 Clc1cccc(c1)CCOc2ccccc2I 34a_100000739446_100011713710 [0,2,0,0,0,0|2,0,0]=4 28679 B18R2.65882 Clc1cccc(c1)CCOc2ccccc2I 7a_100000739446_100011713710 [0,2,0,0,0,0|2,0,0]=4 28680 B18R2.65882 Clc1cccc(c1)CCSc2ccccc2Br 62a_100000695589_100011713710 [0,2,0,0,0,0|2,0,0]=4 28681 B18R2.65882 Clc1cccc(c1)CCSc2ccccc2Br 62a_100011713710_100000695589 [0,2,0,0,0,0|2,0,0]=4 28682 B18R2.65882 Clc1cccc(c1)CCSc2ccccc2Cl 62a_100000764095_100011713710 [0,2,0,0,0,0|2,0,0]=4 28683 B18R2.65882 Clc1cccc(c1)CCSc2ccccc2Cl 62a_100011713710_100000764095 [0,2,0,0,0,0|2,0,0]=4 28684 B18R2.65882 Clc1cccc(c1)CNCc2ccccc2Br 207a_100000174878_100000211189 [0,2,0,0,0,0|1,0,0]=3 28685 B18R2.65882 Clc1cccc(c1)CNCc2ccccc2Br 207a_100000689332_100000210801 [0,2,0,0,0,0|1,0,0]=3 28686 B18R2.65882 Clc1cccc(c1)CNCc2ccccc2Br 2230a_100000174878_100000184730 [0,2,0,0,0,0|1,0,0]=3 28687 B18R2.65882 Clc1cccc(c1)CNCc2ccccc2Br 2230a_100000689332_100000181238 [0,2,0,0,0,0|1,0,0]=3 28688 B18R2.65882 Clc1cccc(c1)CNCc2ccccc2Br 26a_100000174878_100000181306 [0,2,0,0,0,0|1,0,0]=3 28689 B18R2.65882 Clc1cccc(c1)CNCc2ccccc2Br 270004a_100000174878_100000211189 [0,2,0,0,0,0|1,0,0]=3 28690 B18R2.65882 Clc1cccc(c1)CNCc2ccccc2Br 270004a_100000689332_100000210801 [0,2,0,0,0,0|1,0,0]=3 28691 B18R2.65882 Clc1cccc(c1)CNCc2ccccc2Br 34a_100000174878_100000184730 [0,2,0,0,0,0|1,0,0]=3 28692 B18R2.65882 Clc1cccc(c1)CNCc2ccccc2Br 34a_100000689332_100000187163 [0,2,0,0,0,0|1,0,0]=3 28693 B18R2.65882 Clc1cccc(c1)CNCc2ccccc2Cl 207a_100000174878_100000210073 [0,2,0,0,0,0|1,0,0]=3 28694 B18R2.65882 Clc1cccc(c1)CNCc2ccccc2Cl 207a_100000174879_100000210801 [0,2,0,0,0,0|1,0,0]=3 28695 B18R2.65882 Clc1cccc(c1)CNCc2ccccc2Cl 2230a_100000174878_100000187162 [0,2,0,0,0,0|1,0,0]=3 28696 B18R2.65882 Clc1cccc(c1)CNCc2ccccc2Cl 2230a_100000174879_100000181238 [0,2,0,0,0,0|1,0,0]=3 28697 B18R2.65882 Clc1cccc(c1)CNCc2ccccc2Cl 26a_100000174878_100000210172 [0,2,0,0,0,0|1,0,0]=3 28698 B18R2.65882 Clc1cccc(c1)CNCc2ccccc2Cl 270004a_100000174878_100000210073 [0,2,0,0,0,0|1,0,0]=3 28699 B18R2.65882 Clc1cccc(c1)CNCc2ccccc2Cl 270004a_100000174879_100000210801 [0,2,0,0,0,0|1,0,0]=3 28700 B18R2.65882 Clc1cccc(c1)CNCc2ccccc2Cl 34a_100000174878_100000187162 [0,2,0,0,0,0|1,0,0]=3 28701 B18R2.65882 Clc1cccc(c1)CNCc2ccccc2Cl 34a_100000174879_100000187163 [0,2,0,0,0,0|1,0,0]=3 28702 B18R2.65882 Clc1cccc(c1)CNCc2ccccc2I 207a_100000174878_100000010305 [0,2,0,0,0,0|1,0,0]=3 28703 B18R2.65882 Clc1cccc(c1)CNCc2ccccc2I 207a_100015347259_100000210801 [0,2,0,0,0,0|1,0,0]=3 28704 B18R2.65882 Clc1cccc(c1)CNCc2ccccc2I 2230a_100000174878_100011215278 [0,2,0,0,0,0|1,0,0]=3 28705 B18R2.65882 Clc1cccc(c1)CNCc2ccccc2I 270004a_100000174878_100000010305 [0,2,0,0,0,0|1,0,0]=3 28706 B18R2.65882 Clc1cccc(c1)CNCc2ccccc2I 270004a_100015347259_100000210801 [0,2,0,0,0,0|1,0,0]=3 28707 B18R2.65882 Clc1cccc(c1)CNCc2ccccc2I 34a_100000174878_100011215278 [0,2,0,0,0,0|1,0,0]=3 28708 B18R2.65882 Clc1cccc(c1)CNCc2cccnc2Br 2230a_100000174878_100010140945 [0,2,0,0,0,0|2,0,0]=4 28709 B18R2.65882 Clc1cccc(c1)CNCc2cccnc2Br 2230a_100009818023_100000181238 [0,2,0,0,0,0|2,0,0]=4 28710 B18R2.65882 Clc1cccc(c1)CNCc2cccnc2Br 270004a_100009818023_100000210801 [0,2,0,0,0,0|2,0,0]=4 28711 B18R2.65882 Clc1cccc(c1)CNCc2cccnc2Br 34a_100000174878_100010140945 [0,2,0,0,0,0|2,0,0]=4 28712 B18R2.65882 Clc1cccc(c1)CNCc2cccnc2Br 34a_100009818023_100000187163 [0,2,0,0,0,0|2,0,0]=4 28713 B18R2.65882 Clc1cccc(c1)CNCc2cccnc2Cl 207a_100015189234_100000210801 [0,2,0,0,0,0|2,0,0]=4 28714 B18R2.65882 Clc1cccc(c1)CNCc2cccnc2Cl 2230a_100000174878_100000045678 [0,2,0,0,0,0|2,0,0]=4 28715 B18R2.65882 Clc1cccc(c1)CNCc2cccnc2Cl 2230a_100015189234_100000181238 [0,2,0,0,0,0|2,0,0]=4 28716 B18R2.65882 Clc1cccc(c1)CNCc2cccnc2Cl 34a_100000174878_100000045678 [0,2,0,0,0,0|2,0,0]=4 28717 B18R2.65882 Clc1cccc(c1)CNCc2cccnc2Cl 34a_100015189234_100000187163 [0,2,0,0,0,0|2,0,0]=4 28718 B18R2.65882 Clc1cccc(c1)CNCc2ccncc2Br 207a_100020640021_100000210801 [0,2,0,0,0,0|2,0,0]=4 28719 B18R2.65882 Clc1cccc(c1)CNCc2ccncc2Br 270004a_100000174878_100000755692 [0,2,0,0,0,0|2,0,0]=4 28720 B18R2.65882 Clc1cccc(c1)CNCc2ccncc2Br 270004a_100020640021_100000210801 [0,2,0,0,0,0|2,0,0]=4 28721 B18R2.65882 Clc1cccc(c1)CNCc2ccncc2Cl 207a_100000174878_100011934409 [0,2,0,0,0,0|2,0,0]=4 28722 B18R2.65882 Clc1cccc(c1)CNCc2ccncc2Cl 2230a_100000174878_100000763264 [0,2,0,0,0,0|2,0,0]=4 28723 B18R2.65882 Clc1cccc(c1)CNCc2ccncc2Cl 270004a_100000174878_100011934409 [0,2,0,0,0,0|2,0,0]=4 28724 B18R2.65882 Clc1cccc(c1)CNCc2cnccc2Br 270004a_100000174878_100009816821 [0,2,0,0,0,0|2,0,0]=4 28725 B18R2.65882 Clc1cccc(c1)CNCc2cnccc2Cl 270004a_100000174878_100000050567 [0,2,0,0,0,0|2,0,0]=4 28726 B18R2.65882 Clc1cccc(c1)CNCc2ncccc2Br 207a_100000174878_100011934733 [0,2,0,0,0,0|2,0,0]=4 28727 B18R2.65882 Clc1cccc(c1)CNCc2ncccc2Br 2230a_100000174878_100025702911 [0,2,0,0,0,0|2,0,0]=4 28728 B18R2.65882 Clc1cccc(c1)CNCc2ncccc2Br 270004a_100000174878_100011934733 [0,2,0,0,0,0|2,0,0]=4 28729 B18R2.65882 Clc1cccc(c1)CNCc2ncccc2Br 270004a_100020591323_100000210801 [0,2,0,0,0,0|2,0,0]=4 28730 B18R2.65882 Clc1cccc(c1)CNCc2ncccc2Br 34a_100000174878_100025702911 [0,2,0,0,0,0|2,0,0]=4 28731 B18R2.65882 Clc1cccc(c1)CNCc2ncccc2Cl 207a_100000174878_100012001307 [0,2,0,0,0,0|2,0,0]=4 28732 B18R2.65882 Clc1cccc(c1)CNCc2ncccc2Cl 2230a_100000174878_100000099807 [0,2,0,0,0,0|2,0,0]=4 28733 B18R2.65882 Clc1cccc(c1)CNCc2ncccc2Cl 2230a_100015189233_100000181238 [0,2,0,0,0,0|2,0,0]=4 28734 B18R2.65882 Clc1cccc(c1)CNCc2ncccc2Cl 270004a_100000174878_100012001307 [0,2,0,0,0,0|2,0,0]=4 28735 B18R2.65882 Clc1cccc(c1)CNCc2ncccc2Cl 270004a_100015189233_100000210801 [0,2,0,0,0,0|2,0,0]=4 28736 B18R2.65882 Clc1cccc(c1)COCc2ccccc2Br 34a_100000241301_100000184730 [0,2,0,0,0,0|0,0,0]=2 28737 B18R2.65882 Clc1cccc(c1)COCc2ccccc2Br 34a_100000756307_100000187163 [0,2,0,0,0,0|0,0,0]=2 28738 B18R2.65882 Clc1cccc(c1)COCc2ccccc2Br 7a_100000241301_100000184730 [0,2,0,0,0,0|0,0,0]=2 28739 B18R2.65882 Clc1cccc(c1)COCc2ccccc2Br 7a_100000756307_100000187163 [0,2,0,0,0,0|0,0,0]=2 28740 B18R2.65882 Clc1cccc(c1)COCc2ccccc2Cl 34a_100000210847_100000187163 [0,2,0,0,0,0|0,0,0]=2 28741 B18R2.65882 Clc1cccc(c1)COCc2ccccc2Cl 34a_100000241301_100000187162 [0,2,0,0,0,0|0,0,0]=2 28742 B18R2.65882 Clc1cccc(c1)COCc2ccccc2Cl 7a_100000210847_100000187163 [0,2,0,0,0,0|0,0,0]=2 28743 B18R2.65882 Clc1cccc(c1)COCc2ccccc2Cl 7a_100000241301_100000187162 [0,2,0,0,0,0|0,0,0]=2 28744 B18R2.65882 Clc1cccc(c1)COCc2ccccc2I 34a_100000187465_100000187163 [0,2,0,0,0,0|0,0,0]=2 28745 B18R2.65882 Clc1cccc(c1)COCc2ccccc2I 34a_100000241301_100011215278 [0,2,0,0,0,0|0,0,0]=2 28746 B18R2.65882 Clc1cccc(c1)COCc2ccccc2I 7a_100000187465_100000187163 [0,2,0,0,0,0|0,0,0]=2 28747 B18R2.65882 Clc1cccc(c1)COCc2ccccc2I 7a_100000241301_100011215278 [0,2,0,0,0,0|0,0,0]=2 28748 B18R2.65882 Clc1cccc(c1)COCc2cccnc2Br 34a_100000241301_100010140945 [0,2,0,0,0,0|1,0,0]=3 28749 B18R2.65882 Clc1cccc(c1)COCc2cccnc2Br 34a_100000719692_100000187163 [0,2,0,0,0,0|1,0,0]=3 28750 B18R2.65882 Clc1cccc(c1)COCc2cccnc2Br 7a_100000241301_100010140945 [0,2,0,0,0,0|1,0,0]=3 28751 B18R2.65882 Clc1cccc(c1)COCc2cccnc2Br 7a_100000719692_100000187163 [0,2,0,0,0,0|1,0,0]=3 28752 B18R2.65882 Clc1cccc(c1)COCc2cccnc2Cl 34a_100000241301_100000045678 [0,2,0,0,0,0|1,0,0]=3 28753 B18R2.65882 Clc1cccc(c1)COCc2cccnc2Cl 34a_100000748726_100000187163 [0,2,0,0,0,0|1,0,0]=3 28754 B18R2.65882 Clc1cccc(c1)COCc2cccnc2Cl 7a_100000241301_100000045678 [0,2,0,0,0,0|1,0,0]=3 28755 B18R2.65882 Clc1cccc(c1)COCc2cccnc2Cl 7a_100000748726_100000187163 [0,2,0,0,0,0|1,0,0]=3 28756 B18R2.65882 Clc1cccc(c1)COCc2ccncc2Cl 7a_100000241301_100000763264 [0,2,0,0,0,0|1,0,0]=3 28757 B18R2.65882 Clc1cccc(c1)COCc2cnccc2Cl 34a_100000117392_100000187163 [0,2,0,0,0,0|1,0,0]=3 28758 B18R2.65882 Clc1cccc(c1)COCc2ncccc2Br 34a_100000241301_100025702911 [0,2,0,0,0,0|1,0,0]=3 28759 B18R2.65882 Clc1cccc(c1)COCc2ncccc2Br 34a_100011996772_100000187163 [0,2,0,0,0,0|1,0,0]=3 28760 B18R2.65882 Clc1cccc(c1)COCc2ncccc2Br 7a_100000241301_100025702911 [0,2,0,0,0,0|1,0,0]=3 28761 B18R2.65882 Clc1cccc(c1)COCc2ncccc2Cl 34a_100012002383_100000187163 [0,2,0,0,0,0|1,0,0]=3 28762 B18R2.65882 Clc1cccc(c1)COCc2ncccc2Cl 7a_100000241301_100000099807 [0,2,0,0,0,0|1,0,0]=3 28763 B18R2.65882 Clc1cccc(c1)COCc2nccnc2Cl 34a_100000057004_100000187163 [0,2,0,0,0,0|2,0,0]=4 28764 B18R2.65882 Clc1cccc(c1)CSCc2ccccc2Br 62a_100000184730_100000187163 [0,2,0,0,0,0|0,1,0]=3 28765 B18R2.65882 Clc1cccc(c1)CSCc2ccccc2Br 62a_100000187163_100000184730 [0,2,0,0,0,0|0,1,0]=3 28766 B18R2.65882 Clc1cccc(c1)CSCc2ccccc2Cl 62a_100000187162_100000187163 [0,2,0,0,0,0|0,1,0]=3 28767 B18R2.65882 Clc1cccc(c1)CSCc2ccccc2Cl 62a_100000187163_100000187162 [0,2,0,0,0,0|0,1,0]=3 28768 B18R2.65882 Clc1cccc(c1)CSCc2ccccc2I 62a_100000187163_100011216222 [0,2,0,0,0,0|0,1,0]=3 28769 B18R2.65882 Clc1cccc(c1)CSCc2ccccc2I 62a_100011216222_100000187163 [0,2,0,0,0,0|0,1,0]=3 28770 B18R2.65882 Clc1cccc(c1)CSCc2cccnc2Br 62a_100000187163_100010140945 [0,2,0,0,0,0|1,1,0]=4 28771 B18R2.65882 Clc1cccc(c1)CSCc2cccnc2Br 62a_100010140945_100000187163 [0,2,0,0,0,0|1,1,0]=4 28772 B18R2.65882 Clc1cccc(c1)CSCc2cccnc2Cl 62a_100000045678_100000187163 [0,2,0,0,0,0|1,1,0]=4 28773 B18R2.65882 Clc1cccc(c1)CSCc2cccnc2Cl 62a_100000187163_100000045678 [0,2,0,0,0,0|1,1,0]=4 28774 B18R2.65882 Clc1cccc(c1)CSCc2ccncc2Cl 62a_100000187163_100000763264 [0,2,0,0,0,0|1,1,0]=4 28775 B18R2.65882 Clc1cccc(c1)CSCc2ccncc2Cl 62a_100000763264_100000187163 [0,2,0,0,0,0|1,1,0]=4 28776 B18R2.65882 Clc1cccc(c1)CSCc2ncccc2Br 62a_100000187163_100025702911 [0,2,0,0,0,0|1,1,0]=4 28777 B18R2.65882 Clc1cccc(c1)CSCc2ncccc2Br 62a_100025702911_100000187163 [0,2,0,0,0,0|1,1,0]=4 28778 B18R2.65882 Clc1cccc(c1)CSCc2ncccc2Cl 62a_100000099807_100000187163 [0,2,0,0,0,0|1,1,0]=4 28779 B18R2.65882 Clc1cccc(c1)CSCc2ncccc2Cl 62a_100000187163_100000099807 [0,2,0,0,0,0|1,1,0]=4 28780 B18R2.65882 Clc1cccc(c1)NCCc2ccccc2Br 34a_100000185859_100012161201 [0,2,0,0,0,0|2,0,0]=4 28781 B18R2.65882 Clc1cccc(c1)NCCc2ccccc2Cl 34a_100000185859_100011713703 [0,2,0,0,0,0|2,0,0]=4 28782 B18R2.65882 Clc1cccc(c1)OCCc2ccccc2Br 34a_100000210295_100012161201 [0,2,0,0,0,0|2,0,0]=4 28783 B18R2.65882 Clc1cccc(c1)OCCc2ccccc2Br 7a_100000210295_100012161201 [0,2,0,0,0,0|2,0,0]=4 28784 B18R2.65882 Clc1cccc(c1)OCCc2ccccc2Cl 34a_100000210295_100011713703 [0,2,0,0,0,0|2,0,0]=4 28785 B18R2.65882 Clc1cccc(c1)OCCc2ccccc2Cl 7a_100000210295_100011713703 [0,2,0,0,0,0|2,0,0]=4 28786 B18R2.65882 Clc1cccc(c1)SCCc2ccccc2Br 62a_100000699651_100012161201 [0,2,0,0,0,0|2,0,0]=4 28787 B18R2.65882 Clc1cccc(c1)SCCc2ccccc2Br 62a_100012161201_100000699651 [0,2,0,0,0,0|2,0,0]=4 28788 B18R2.65882 Clc1cccc(c1)SCCc2ccccc2Cl 62a_100000699651_100011713703 [0,2,0,0,0,0|2,0,0]=4 28789 B18R2.65882 Clc1cccc(c1)SCCc2ccccc2Cl 62a_100011713703_100000699651 [0,2,0,0,0,0|2,0,0]=4 28790 B18R2.65882 Clc1cccc(n1)CNCc2ccccc2Br 2230a_100000689332_100000086093 [0,2,0,0,0,0|2,0,0]=4 28791 B18R2.65882 Clc1cccc(n1)CNCc2ccccc2Br 2230a_100016990191_100000184730 [0,2,0,0,0,0|2,0,0]=4 28792 B18R2.65882 Clc1cccc(n1)CNCc2ccccc2Br 270004a_100000689332_100011361687 [0,2,0,0,0,0|2,0,0]=4 28793 B18R2.65882 Clc1cccc(n1)CNCc2ccccc2Br 34a_100000689332_100000086093 [0,2,0,0,0,0|2,0,0]=4 28794 B18R2.65882 Clc1cccc(n1)CNCc2ccccc2Cl 2230a_100000174879_100000086093 [0,2,0,0,0,0|2,0,0]=4 28795 B18R2.65882 Clc1cccc(n1)CNCc2ccccc2Cl 2230a_100016990191_100000187162 [0,2,0,0,0,0|2,0,0]=4 28796 B18R2.65882 Clc1cccc(n1)CNCc2ccccc2Cl 270004a_100000174879_100011361687 [0,2,0,0,0,0|2,0,0]=4 28797 B18R2.65882 Clc1cccc(n1)CNCc2ccccc2Cl 34a_100000174879_100000086093 [0,2,0,0,0,0|2,0,0]=4 28798 B18R2.65882 Clc1cccc(n1)CNCc2ccccc2I 2230a_100016990191_100011215278 [0,2,0,0,0,0|2,0,0]=4 28799 B18R2.65882 Clc1cccc(n1)CNCc2ccccc2I 270004a_100015347259_100011361687 [0,2,0,0,0,0|2,0,0]=4 28800 B18R2.65882 Clc1cccc(n1)COCc2ccccc2Br 34a_100000756307_100000086093 [0,2,0,0,0,0|1,0,0]=3 28801 B18R2.65882 Clc1cccc(n1)COCc2ccccc2Br 34a_100011998359_100000184730 [0,2,0,0,0,0|1,0,0]=3 28802 B18R2.65882 Clc1cccc(n1)COCc2ccccc2Br 7a_100000756307_100000086093 [0,2,0,0,0,0|1,0,0]=3 28803 B18R2.65882 Clc1cccc(n1)COCc2ccccc2Cl 34a_100000210847_100000086093 [0,2,0,0,0,0|1,0,0]=3 28804 B18R2.65882 Clc1cccc(n1)COCc2ccccc2Cl 34a_100011998359_100000187162 [0,2,0,0,0,0|1,0,0]=3 28805 B18R2.65882 Clc1cccc(n1)COCc2ccccc2Cl 7a_100000210847_100000086093 [0,2,0,0,0,0|1,0,0]=3 28806 B18R2.65882 Clc1cccc(n1)COCc2ccccc2I 34a_100000187465_100000086093 [0,2,0,0,0,0|1,0,0]=3 28807 B18R2.65882 Clc1cccc(n1)COCc2ccccc2I 34a_100011998359_100011215278 [0,2,0,0,0,0|1,0,0]=3 28808 B18R2.65882 Clc1cccc(n1)COCc2ccccc2I 7a_100000187465_100000086093 [0,2,0,0,0,0|1,0,0]=3 28809 B18R2.65882 Clc1cccc(n1)COCc2cccnc2Br 34a_100000719692_100000086093 [0,2,0,0,0,0|2,0,0]=4 28810 B18R2.65882 Clc1cccc(n1)COCc2cccnc2Br 34a_100011998359_100010140945 [0,2,0,0,0,0|2,0,0]=4 28811 B18R2.65882 Clc1cccc(n1)COCc2cccnc2Br 7a_100000719692_100000086093 [0,2,0,0,0,0|2,0,0]=4 28812 B18R2.65882 Clc1cccc(n1)COCc2cccnc2Cl 34a_100000748726_100000086093 [0,2,0,0,0,0|2,0,0]=4 28813 B18R2.65882 Clc1cccc(n1)COCc2cccnc2Cl 34a_100011998359_100000045678 [0,2,0,0,0,0|2,0,0]=4 28814 B18R2.65882 Clc1cccc(n1)COCc2cccnc2Cl 7a_100000748726_100000086093 [0,2,0,0,0,0|2,0,0]=4 28815 B18R2.65882 Clc1cccc(n1)COCc2cnccc2Cl 34a_100000117392_100000086093 [0,2,0,0,0,0|2,0,0]=4 28816 B18R2.65882 Clc1cccc(n1)COCc2ncccc2Br 34a_100011996772_100000086093 [0,2,0,0,0,0|2,0,0]=4 28817 B18R2.65882 Clc1cccc(n1)COCc2ncccc2Br 34a_100011998359_100025702911 [0,2,0,0,0,0|2,0,0]=4 28818 B18R2.65882 Clc1cccc(n1)COCc2ncccc2Cl 34a_100012002383_100000086093 [0,2,0,0,0,0|2,0,0]=4 28819 B18R2.65882 Clc1cccc(n1)CSCc2ccccc2Br 62a_100000086093_100000184730 [0,2,0,0,0,0|1,1,0]=4 28820 B18R2.65882 Clc1cccc(n1)CSCc2ccccc2Br 62a_100000184730_100000086093 [0,2,0,0,0,0|1,1,0]=4 28821 B18R2.65882 Clc1cccc(n1)CSCc2ccccc2Cl 62a_100000086093_100000187162 [0,2,0,0,0,0|1,1,0]=4 28822 B18R2.65882 Clc1cccc(n1)CSCc2ccccc2Cl 62a_100000187162_100000086093 [0,2,0,0,0,0|1,1,0]=4 28823 B18R2.65882 Clc1cccc(n1)CSCc2ccccc2I 62a_100000086093_100011216222 [0,2,0,0,0,0|1,1,0]=4 28824 B18R2.65882 Clc1cccc(n1)CSCc2ccccc2I 62a_100011216222_100000086093 [0,2,0,0,0,0|1,1,0]=4 28825 B18R2.65882 Clc1ccccc1CCNc2cccc(c2)Br 34a_100000210019_100011713703 [0,2,0,0,0,0|2,0,0]=4 28826 B18R2.65882 Clc1ccccc1CCNc2cccc(c2)I 34a_100000211102_100011713703 [0,2,0,0,0,0|2,0,0]=4 28827 B18R2.65882 Clc1ccccc1CCOc2cccc(c2)Br 34a_100000210342_100011713703 [0,2,0,0,0,0|2,0,0]=4 28828 B18R2.65882 Clc1ccccc1CCOc2cccc(c2)Br 7a_100000210342_100011713703 [0,2,0,0,0,0|2,0,0]=4 28829 B18R2.65882 Clc1ccccc1CCOc2cccc(c2)I 34a_100000211634_100011713703 [0,2,0,0,0,0|2,0,0]=4 28830 B18R2.65882 Clc1ccccc1CCOc2cccc(c2)I 7a_100000211634_100011713703 [0,2,0,0,0,0|2,0,0]=4 28831 B18R2.65882 Clc1ccccc1CCSc2cccc(c2)Br 62a_100000691529_100011713703 [0,2,0,0,0,0|2,0,0]=4 28832 B18R2.65882 Clc1ccccc1CCSc2cccc(c2)Br 62a_100011713703_100000691529 [0,2,0,0,0,0|2,0,0]=4 28833 B18R2.65882 Clc1ccccc1CNCc2cc(ccn2)Br 2230a_100000174879_100010173614 [0,2,0,0,0,0|2,0,0]=4 28834 B18R2.65882 Clc1ccccc1CNCc2cc(ccn2)Br 270004a_100000174879_100009818557 [0,2,0,0,0,0|2,0,0]=4 28835 B18R2.65882 Clc1ccccc1CNCc2cc(ccn2)Br 34a_100000174879_100010173614 [0,2,0,0,0,0|2,0,0]=4 28836 B18R2.65882 Clc1ccccc1CNCc2cccc(c2)Br 207a_100000174879_100000210085 [0,2,0,0,0,0|1,0,0]=3 28837 B18R2.65882 Clc1ccccc1CNCc2cccc(c2)Br 207a_100000174977_100000210073 [0,2,0,0,0,0|1,0,0]=3 28838 B18R2.65882 Clc1ccccc1CNCc2cccc(c2)Br 2230a_100000174879_100000698116 [0,2,0,0,0,0|1,0,0]=3 28839 B18R2.65882 Clc1ccccc1CNCc2cccc(c2)Br 2230a_100000174977_100000187162 [0,2,0,0,0,0|1,0,0]=3 28840 B18R2.65882 Clc1ccccc1CNCc2cccc(c2)Br 26a_100000174879_100000210342 [0,2,0,0,0,0|1,0,0]=3 28841 B18R2.65882 Clc1ccccc1CNCc2cccc(c2)Br 26a_100000174977_100000210172 [0,2,0,0,0,0|1,0,0]=3 28842 B18R2.65882 Clc1ccccc1CNCc2cccc(c2)Br 270004a_100000174879_100000210085 [0,2,0,0,0,0|1,0,0]=3 28843 B18R2.65882 Clc1ccccc1CNCc2cccc(c2)Br 270004a_100000174977_100000210073 [0,2,0,0,0,0|1,0,0]=3 28844 B18R2.65882 Clc1ccccc1CNCc2cccc(c2)Br 34a_100000174879_100000698116 [0,2,0,0,0,0|1,0,0]=3 28845 B18R2.65882 Clc1ccccc1CNCc2cccc(c2)Br 34a_100000174977_100000187162 [0,2,0,0,0,0|1,0,0]=3 28846 B18R2.65882 Clc1ccccc1CNCc2cccc(c2)I 207a_100000106179_100000210073 [0,2,0,0,0,0|1,0,0]=3 28847 B18R2.65882 Clc1ccccc1CNCc2cccc(c2)I 207a_100000174879_100000014684 [0,2,0,0,0,0|1,0,0]=3 28848 B18R2.65882 Clc1ccccc1CNCc2cccc(c2)I 2230a_100000106179_100000187162 [0,2,0,0,0,0|1,0,0]=3 28849 B18R2.65882 Clc1ccccc1CNCc2cccc(c2)I 2230a_100000174879_100011218688 [0,2,0,0,0,0|1,0,0]=3 28850 B18R2.65882 Clc1ccccc1CNCc2cccc(c2)I 270004a_100000106179_100000210073 [0,2,0,0,0,0|1,0,0]=3 28851 B18R2.65882 Clc1ccccc1CNCc2cccc(c2)I 270004a_100000174879_100000014684 [0,2,0,0,0,0|1,0,0]=3 28852 B18R2.65882 Clc1ccccc1CNCc2cccc(c2)I 34a_100000106179_100000187162 [0,2,0,0,0,0|1,0,0]=3 28853 B18R2.65882 Clc1ccccc1CNCc2cccc(c2)I 34a_100000174879_100011218688 [0,2,0,0,0,0|1,0,0]=3 28854 B18R2.65882 Clc1ccccc1CNCc2cccc(n2)Br 2230a_100000174879_100009889011 [0,2,0,0,0,0|2,0,0]=4 28855 B18R2.65882 Clc1ccccc1CNCc2cccc(n2)Br 2230a_100016987751_100000187162 [0,2,0,0,0,0|2,0,0]=4 28856 B18R2.65882 Clc1ccccc1CNCc2cccc(n2)Br 270004a_100000174879_100000688028 [0,2,0,0,0,0|2,0,0]=4 28857 B18R2.65882 Clc1ccccc1CNCc2cccc(n2)Br 34a_100000174879_100009889011 [0,2,0,0,0,0|2,0,0]=4 28858 B18R2.65882 Clc1ccccc1CNCc2ccnc(c2)Br 2230a_100000174879_100010243470 [0,2,0,0,0,0|2,0,0]=4 28859 B18R2.65882 Clc1ccccc1CNCc2ccnc(c2)Br 2230a_100025757509_100000187162 [0,2,0,0,0,0|2,0,0]=4 28860 B18R2.65882 Clc1ccccc1CNCc2ccnc(c2)Br 26a_100025757509_100000210172 [0,2,0,0,0,0|2,0,0]=4 28861 B18R2.65882 Clc1ccccc1CNCc2ccnc(c2)Br 270004a_100000174879_100009814634 [0,2,0,0,0,0|2,0,0]=4 28862 B18R2.65882 Clc1ccccc1CNCc2ccnc(c2)Br 270004a_100025757509_100000210073 [0,2,0,0,0,0|2,0,0]=4 28863 B18R2.65882 Clc1ccccc1CNCc2ccnc(c2)Br 34a_100000174879_100010243470 [0,2,0,0,0,0|2,0,0]=4 28864 B18R2.65882 Clc1ccccc1CNCc2ccnc(c2)Br 34a_100025757509_100000187162 [0,2,0,0,0,0|2,0,0]=4 28865 B18R2.65882 Clc1ccccc1CNCc2cncc(c2)Br 207a_100000174879_100000687066 [0,2,0,0,0,0|2,0,0]=4 28866 B18R2.65882 Clc1ccccc1CNCc2cncc(c2)Br 207a_100011249555_100000210073 [0,2,0,0,0,0|2,0,0]=4 28867 B18R2.65882 Clc1ccccc1CNCc2cncc(c2)Br 2230a_100000174879_100000738771 [0,2,0,0,0,0|2,0,0]=4 28868 B18R2.65882 Clc1ccccc1CNCc2cncc(c2)Br 270004a_100000174879_100000687066 [0,2,0,0,0,0|2,0,0]=4 28869 B18R2.65882 Clc1ccccc1CNCc2cncc(c2)Br 270004a_100011249555_100000210073 [0,2,0,0,0,0|2,0,0]=4 28870 B18R2.65882 Clc1ccccc1CNCc2cncc(c2)Br 34a_100000174879_100000738771 [0,2,0,0,0,0|2,0,0]=4 28871 B18R2.65882 Clc1ccccc1COCc2cc(ccn2)Br 34a_100000210847_100010173614 [0,2,0,0,0,0|1,0,0]=3 28872 B18R2.65882 Clc1ccccc1COCc2cc(ccn2)Br 7a_100000210847_100010173614 [0,2,0,0,0,0|1,0,0]=3 28873 B18R2.65882 Clc1ccccc1COCc2cccc(c2)Br 34a_100000210847_100000698116 [0,2,0,0,0,0|0,0,0]=2 28874 B18R2.65882 Clc1ccccc1COCc2cccc(c2)Br 34a_100000687537_100000187162 [0,2,0,0,0,0|0,0,0]=2 28875 B18R2.65882 Clc1ccccc1COCc2cccc(c2)Br 7a_100000210847_100000211773 [0,2,0,0,0,0|0,0,0]=2 28876 B18R2.65882 Clc1ccccc1COCc2cccc(c2)Br 7a_100000687537_100000187162 [0,2,0,0,0,0|0,0,0]=2 28877 B18R2.65882 Clc1ccccc1COCc2cccc(c2)I 34a_100000210847_100011218688 [0,2,0,0,0,0|0,0,0]=2 28878 B18R2.65882 Clc1ccccc1COCc2cccc(c2)I 34a_100011215336_100000187162 [0,2,0,0,0,0|0,0,0]=2 28879 B18R2.65882 Clc1ccccc1COCc2cccc(c2)I 7a_100000210847_100011218688 [0,2,0,0,0,0|0,0,0]=2 28880 B18R2.65882 Clc1ccccc1COCc2cccc(c2)I 7a_100011215336_100000187162 [0,2,0,0,0,0|0,0,0]=2 28881 B18R2.65882 Clc1ccccc1COCc2cccc(n2)Br 34a_100000210847_100009889011 [0,2,0,0,0,0|1,0,0]=3 28882 B18R2.65882 Clc1ccccc1COCc2cccc(n2)Br 34a_100000694195_100000187162 [0,2,0,0,0,0|1,0,0]=3 28883 B18R2.65882 Clc1ccccc1COCc2cccc(n2)Br 7a_100000210847_100009889011 [0,2,0,0,0,0|1,0,0]=3 28884 B18R2.65882 Clc1ccccc1COCc2ccnc(c2)Br 34a_100000210847_100010243470 [0,2,0,0,0,0|1,0,0]=3 28885 B18R2.65882 Clc1ccccc1COCc2ccnc(c2)Br 34a_100009814636_100000187162 [0,2,0,0,0,0|1,0,0]=3 28886 B18R2.65882 Clc1ccccc1COCc2ccnc(c2)Br 7a_100000210847_100010254460 [0,2,0,0,0,0|1,0,0]=3 28887 B18R2.65882 Clc1ccccc1COCc2ccnc(c2)Br 7a_100009814636_100000187162 [0,2,0,0,0,0|1,0,0]=3 28888 B18R2.65882 Clc1ccccc1COCc2cncc(c2)Br 34a_100000210847_100000738771 [0,2,0,0,0,0|1,0,0]=3 28889 B18R2.65882 Clc1ccccc1COCc2cncc(c2)Br 34a_100011259137_100000187162 [0,2,0,0,0,0|1,0,0]=3 28890 B18R2.65882 Clc1ccccc1COCc2cncc(c2)Br 7a_100000210847_100000738771 [0,2,0,0,0,0|1,0,0]=3 28891 B18R2.65882 Clc1ccccc1COCc2cncc(c2)Br 7a_100011259137_100000187162 [0,2,0,0,0,0|1,0,0]=3 28892 B18R2.65882 Clc1ccccc1CSCc2cc(ccn2)Br 62a_100000187162_100010173614 [0,2,0,0,0,0|1,1,0]=4 28893 B18R2.65882 Clc1ccccc1CSCc2cc(ccn2)Br 62a_100010173614_100000187162 [0,2,0,0,0,0|1,1,0]=4 28894 B18R2.65882 Clc1ccccc1CSCc2cccc(c2)Br 62a_100000187162_100000211773 [0,2,0,0,0,0|0,1,0]=3 28895 B18R2.65882 Clc1ccccc1CSCc2cccc(c2)Br 62a_100000211773_100000187162 [0,2,0,0,0,0|0,1,0]=3 28896 B18R2.65882 Clc1ccccc1CSCc2cccc(c2)I 62a_100000187162_100011218688 [0,2,0,0,0,0|0,1,0]=3 28897 B18R2.65882 Clc1ccccc1CSCc2cccc(c2)I 62a_100011218688_100000187162 [0,2,0,0,0,0|0,1,0]=3 28898 B18R2.65882 Clc1ccccc1CSCc2cccc(n2)Br 62a_100000187162_100009889011 [0,2,0,0,0,0|1,1,0]=4 28899 B18R2.65882 Clc1ccccc1CSCc2cccc(n2)Br 62a_100009889011_100000187162 [0,2,0,0,0,0|1,1,0]=4 28900 B18R2.65882 Clc1ccccc1CSCc2ccnc(c2)Br 62a_100000187162_100010243470 [0,2,0,0,0,0|1,1,0]=4 28901 B18R2.65882 Clc1ccccc1CSCc2ccnc(c2)Br 62a_100010254460_100000187162 [0,2,0,0,0,0|1,1,0]=4 28902 B18R2.65882 Clc1ccccc1CSCc2cncc(c2)Br 62a_100000187162_100000738771 [0,2,0,0,0,0|1,1,0]=4 28903 B18R2.65882 Clc1ccccc1CSCc2cncc(c2)Br 62a_100000738771_100000187162 [0,2,0,0,0,0|1,1,0]=4 28904 B18R2.65882 Clc1ccccc1NCCc2cccc(c2)Br 34a_100000185783_100011740638 [0,2,0,0,0,0|2,0,0]=4 28905 B18R2.65882 Clc1ccccc1OCCc2cccc(c2)Br 34a_100000210172_100011740638 [0,2,0,0,0,0|2,0,0]=4 28906 B18R2.65882 Clc1ccccc1OCCc2cccc(c2)Br 7a_100000210172_100011740638 [0,2,0,0,0,0|2,0,0]=4 28907 B18R2.65882 Clc1ccccc1SCCc2cccc(c2)Br 62a_100000764095_100011740638 [0,2,0,0,0,0|2,0,0]=4 28908 B18R2.65882 Clc1ccccc1SCCc2cccc(c2)Br 62a_100011740638_100000764095 [0,2,0,0,0,0|2,0,0]=4 28909 B18R2.65882 Clc1cccnc1CNCc2cccc(c2)Br 207a_100000174977_100012001307 [0,2,0,0,0,0|2,0,0]=4 28910 B18R2.65882 Clc1cccnc1CNCc2cccc(c2)Br 2230a_100000174977_100000099807 [0,2,0,0,0,0|2,0,0]=4 28911 B18R2.65882 Clc1cccnc1CNCc2cccc(c2)Br 2230a_100015189233_100000698116 [0,2,0,0,0,0|2,0,0]=4 28912 B18R2.65882 Clc1cccnc1CNCc2cccc(c2)Br 270004a_100000174977_100012001307 [0,2,0,0,0,0|2,0,0]=4 28913 B18R2.65882 Clc1cccnc1CNCc2cccc(c2)Br 270004a_100015189233_100000210085 [0,2,0,0,0,0|2,0,0]=4 28914 B18R2.65882 Clc1cccnc1CNCc2cccc(c2)I 207a_100000106179_100012001307 [0,2,0,0,0,0|2,0,0]=4 28915 B18R2.65882 Clc1cccnc1CNCc2cccc(c2)I 2230a_100000106179_100000099807 [0,2,0,0,0,0|2,0,0]=4 28916 B18R2.65882 Clc1cccnc1CNCc2cccc(c2)I 2230a_100015189233_100011218688 [0,2,0,0,0,0|2,0,0]=4 28917 B18R2.65882 Clc1cccnc1CNCc2cccc(c2)I 270004a_100000106179_100012001307 [0,2,0,0,0,0|2,0,0]=4 28918 B18R2.65882 Clc1cccnc1CNCc2cccc(c2)I 270004a_100015189233_100000014684 [0,2,0,0,0,0|2,0,0]=4 28919 B18R2.65882 Clc1cccnc1COCc2cc(ccn2)Br 34a_100012002383_100010173614 [0,2,0,0,0,0|2,0,0]=4 28920 B18R2.65882 Clc1cccnc1COCc2cccc(c2)Br 34a_100012002383_100000698116 [0,2,0,0,0,0|1,0,0]=3 28921 B18R2.65882 Clc1cccnc1COCc2cccc(c2)Br 7a_100000687537_100000099807 [0,2,0,0,0,0|1,0,0]=3 28922 B18R2.65882 Clc1cccnc1COCc2cccc(c2)I 34a_100012002383_100011218688 [0,2,0,0,0,0|1,0,0]=3 28923 B18R2.65882 Clc1cccnc1COCc2cccc(c2)I 7a_100011215336_100000099807 [0,2,0,0,0,0|1,0,0]=3 28924 B18R2.65882 Clc1cccnc1COCc2cccc(n2)Br 34a_100012002383_100009889011 [0,2,0,0,0,0|2,0,0]=4 28925 B18R2.65882 Clc1cccnc1COCc2ccnc(c2)Br 34a_100012002383_100010243470 [0,2,0,0,0,0|2,0,0]=4 28926 B18R2.65882 Clc1cccnc1COCc2ccnc(c2)Br 7a_100009814636_100000099807 [0,2,0,0,0,0|2,0,0]=4 28927 B18R2.65882 Clc1cccnc1COCc2cncc(c2)Br 34a_100012002383_100000738771 [0,2,0,0,0,0|2,0,0]=4 28928 B18R2.65882 Clc1cccnc1COCc2cncc(c2)Br 7a_100011259137_100000099807 [0,2,0,0,0,0|2,0,0]=4 28929 B18R2.65882 Clc1cccnc1CSCc2cccc(c2)Br 62a_100000099807_100000211773 [0,2,0,0,0,0|1,1,0]=4 28930 B18R2.65882 Clc1cccnc1CSCc2cccc(c2)Br 62a_100000211773_100000099807 [0,2,0,0,0,0|1,1,0]=4 28931 B18R2.65882 Clc1cccnc1CSCc2cccc(c2)I 62a_100000099807_100011218688 [0,2,0,0,0,0|1,1,0]=4 28932 B18R2.65882 Clc1cccnc1CSCc2cccc(c2)I 62a_100011218688_100000099807 [0,2,0,0,0,0|1,1,0]=4 28933 B18R2.65882 Clc1ccnc(c1)CNCc2ccccc2Br 2230a_100000689332_100016988179 [0,2,0,0,0,0|2,0,0]=4 28934 B18R2.65882 Clc1ccnc(c1)CNCc2ccccc2Br 270004a_100000689332_100011998288 [0,2,0,0,0,0|2,0,0]=4 28935 B18R2.65882 Clc1ccnc(c1)CNCc2ccccc2Br 34a_100000689332_100016988179 [0,2,0,0,0,0|2,0,0]=4 28936 B18R2.65882 Clc1ccnc(c1)CNCc2ccccc2Cl 2230a_100000174879_100016988179 [0,2,0,0,0,0|2,0,0]=4 28937 B18R2.65882 Clc1ccnc(c1)CNCc2ccccc2Cl 270004a_100000174879_100011998288 [0,2,0,0,0,0|2,0,0]=4 28938 B18R2.65882 Clc1ccnc(c1)CNCc2ccccc2Cl 34a_100000174879_100016988179 [0,2,0,0,0,0|2,0,0]=4 28939 B18R2.65882 Clc1ccnc(c1)CNCc2ccccc2I 270004a_100015347259_100011998288 [0,2,0,0,0,0|2,0,0]=4 28940 B18R2.65882 Clc1ccnc(c1)COCc2ccccc2Br 34a_100000748867_100000184730 [0,2,0,0,0,0|1,0,0]=3 28941 B18R2.65882 Clc1ccnc(c1)COCc2ccccc2Br 34a_100000756307_100016988179 [0,2,0,0,0,0|1,0,0]=3 28942 B18R2.65882 Clc1ccnc(c1)COCc2ccccc2Br 7a_100000756307_100016988179 [0,2,0,0,0,0|1,0,0]=3 28943 B18R2.65882 Clc1ccnc(c1)COCc2ccccc2Cl 34a_100000210847_100016988179 [0,2,0,0,0,0|1,0,0]=3 28944 B18R2.65882 Clc1ccnc(c1)COCc2ccccc2Cl 34a_100000748867_100000187162 [0,2,0,0,0,0|1,0,0]=3 28945 B18R2.65882 Clc1ccnc(c1)COCc2ccccc2Cl 7a_100000210847_100016988179 [0,2,0,0,0,0|1,0,0]=3 28946 B18R2.65882 Clc1ccnc(c1)COCc2ccccc2I 34a_100000187465_100016988179 [0,2,0,0,0,0|1,0,0]=3 28947 B18R2.65882 Clc1ccnc(c1)COCc2ccccc2I 34a_100000748867_100011215278 [0,2,0,0,0,0|1,0,0]=3 28948 B18R2.65882 Clc1ccnc(c1)COCc2ccccc2I 7a_100000187465_100016988179 [0,2,0,0,0,0|1,0,0]=3 28949 B18R2.65882 Clc1ccnc(c1)COCc2cccnc2Br 34a_100000719692_100016988179 [0,2,0,0,0,0|2,0,0]=4 28950 B18R2.65882 Clc1ccnc(c1)COCc2cccnc2Br 34a_100000748867_100010140945 [0,2,0,0,0,0|2,0,0]=4 28951 B18R2.65882 Clc1ccnc(c1)COCc2cccnc2Br 7a_100000719692_100016988179 [0,2,0,0,0,0|2,0,0]=4 28952 B18R2.65882 Clc1ccnc(c1)COCc2cccnc2Cl 34a_100000748726_100016988179 [0,2,0,0,0,0|2,0,0]=4 28953 B18R2.65882 Clc1ccnc(c1)COCc2cccnc2Cl 34a_100000748867_100000045678 [0,2,0,0,0,0|2,0,0]=4 28954 B18R2.65882 Clc1ccnc(c1)COCc2cccnc2Cl 7a_100000748726_100016988179 [0,2,0,0,0,0|2,0,0]=4 28955 B18R2.65882 Clc1ccnc(c1)COCc2cnccc2Cl 34a_100000117392_100016988179 [0,2,0,0,0,0|2,0,0]=4 28956 B18R2.65882 Clc1ccnc(c1)COCc2ncccc2Br 34a_100000748867_100025702911 [0,2,0,0,0,0|2,0,0]=4 28957 B18R2.65882 Clc1ccnc(c1)COCc2ncccc2Br 34a_100011996772_100016988179 [0,2,0,0,0,0|2,0,0]=4 28958 B18R2.65882 Clc1ccnc(c1)COCc2ncccc2Cl 34a_100012002383_100016988179 [0,2,0,0,0,0|2,0,0]=4 28959 B18R2.65882 Clc1ccnc(c1)CSCc2ccccc2Br 62a_100000184730_100016988179 [0,2,0,0,0,0|1,1,0]=4 28960 B18R2.65882 Clc1ccnc(c1)CSCc2ccccc2Br 62a_100016988179_100000184730 [0,2,0,0,0,0|1,1,0]=4 28961 B18R2.65882 Clc1ccnc(c1)CSCc2ccccc2Cl 62a_100000187162_100016988179 [0,2,0,0,0,0|1,1,0]=4 28962 B18R2.65882 Clc1ccnc(c1)CSCc2ccccc2Cl 62a_100016988179_100000187162 [0,2,0,0,0,0|1,1,0]=4 28963 B18R2.65882 Clc1ccnc(c1)CSCc2ccccc2I 62a_100011216222_100016988179 [0,2,0,0,0,0|1,1,0]=4 28964 B18R2.65882 Clc1ccnc(c1)CSCc2ccccc2I 62a_100016988179_100011216222 [0,2,0,0,0,0|1,1,0]=4 28965 B18R2.65882 Clc1ccncc1CNCc2cccc(c2)Br 270004a_100000174977_100000050567 [0,2,0,0,0,0|2,0,0]=4 28966 B18R2.65882 Clc1ccncc1CNCc2cccc(c2)I 270004a_100000106179_100000050567 [0,2,0,0,0,0|2,0,0]=4 28967 B18R2.65882 Clc1ccncc1COCc2cc(ccn2)Br 34a_100000117392_100010173614 [0,2,0,0,0,0|2,0,0]=4 28968 B18R2.65882 Clc1ccncc1COCc2cccc(c2)Br 34a_100000117392_100000698116 [0,2,0,0,0,0|1,0,0]=3 28969 B18R2.65882 Clc1ccncc1COCc2cccc(c2)I 34a_100000117392_100011218688 [0,2,0,0,0,0|1,0,0]=3 28970 B18R2.65882 Clc1ccncc1COCc2cccc(n2)Br 34a_100000117392_100009889011 [0,2,0,0,0,0|2,0,0]=4 28971 B18R2.65882 Clc1ccncc1COCc2ccnc(c2)Br 34a_100000117392_100010243470 [0,2,0,0,0,0|2,0,0]=4 28972 B18R2.65882 Clc1ccncc1COCc2cncc(c2)Br 34a_100000117392_100000738771 [0,2,0,0,0,0|2,0,0]=4 28973 B18R2.65882 Clc1cncc(c1)CNCc2ccccc2Br 207a_100000689332_100000088910 [0,2,0,0,0,0|2,0,0]=4 28974 B18R2.65882 Clc1cncc(c1)CNCc2ccccc2Br 207a_200020614424_100000211189 [0,2,0,0,0,0|2,0,0]=4 28975 B18R2.65882 Clc1cncc(c1)CNCc2ccccc2Br 2230a_100000689332_100016992070 [0,2,0,0,0,0|2,0,0]=4 28976 B18R2.65882 Clc1cncc(c1)CNCc2ccccc2Br 2230a_200020614424_100000184730 [0,2,0,0,0,0|2,0,0]=4 28977 B18R2.65882 Clc1cncc(c1)CNCc2ccccc2Br 270004a_100000689332_100000088910 [0,2,0,0,0,0|2,0,0]=4 28978 B18R2.65882 Clc1cncc(c1)CNCc2ccccc2Br 270004a_200020614424_100000211189 [0,2,0,0,0,0|2,0,0]=4 28979 B18R2.65882 Clc1cncc(c1)CNCc2ccccc2Br 34a_100000689332_100016992070 [0,2,0,0,0,0|2,0,0]=4 28980 B18R2.65882 Clc1cncc(c1)CNCc2ccccc2Cl 207a_100000174879_100000088910 [0,2,0,0,0,0|2,0,0]=4 28981 B18R2.65882 Clc1cncc(c1)CNCc2ccccc2Cl 207a_200020614424_100000210073 [0,2,0,0,0,0|2,0,0]=4 28982 B18R2.65882 Clc1cncc(c1)CNCc2ccccc2Cl 2230a_100000174879_100016992070 [0,2,0,0,0,0|2,0,0]=4 28983 B18R2.65882 Clc1cncc(c1)CNCc2ccccc2Cl 2230a_200020614424_100000187162 [0,2,0,0,0,0|2,0,0]=4 28984 B18R2.65882 Clc1cncc(c1)CNCc2ccccc2Cl 270004a_100000174879_100000088910 [0,2,0,0,0,0|2,0,0]=4 28985 B18R2.65882 Clc1cncc(c1)CNCc2ccccc2Cl 270004a_200020614424_100000210073 [0,2,0,0,0,0|2,0,0]=4 28986 B18R2.65882 Clc1cncc(c1)CNCc2ccccc2Cl 34a_100000174879_100016992070 [0,2,0,0,0,0|2,0,0]=4 28987 B18R2.65882 Clc1cncc(c1)CNCc2ccccc2I 207a_100015347259_100000088910 [0,2,0,0,0,0|2,0,0]=4 28988 B18R2.65882 Clc1cncc(c1)CNCc2ccccc2I 207a_200020614424_100000010305 [0,2,0,0,0,0|2,0,0]=4 28989 B18R2.65882 Clc1cncc(c1)CNCc2ccccc2I 2230a_200020614424_100011215278 [0,2,0,0,0,0|2,0,0]=4 28990 B18R2.65882 Clc1cncc(c1)CNCc2ccccc2I 270004a_100015347259_100000088910 [0,2,0,0,0,0|2,0,0]=4 28991 B18R2.65882 Clc1cncc(c1)CNCc2ccccc2I 270004a_200020614424_100000010305 [0,2,0,0,0,0|2,0,0]=4 28992 B18R2.65882 Clc1cncc(c1)COCc2ccccc2Br 34a_100000092867_100000184730 [0,2,0,0,0,0|1,0,0]=3 28993 B18R2.65882 Clc1cncc(c1)COCc2ccccc2Br 34a_100000756307_100016992070 [0,2,0,0,0,0|1,0,0]=3 28994 B18R2.65882 Clc1cncc(c1)COCc2ccccc2Br 7a_100000092867_100000184730 [0,2,0,0,0,0|1,0,0]=3 28995 B18R2.65882 Clc1cncc(c1)COCc2ccccc2Br 7a_100000756307_100016992070 [0,2,0,0,0,0|1,0,0]=3 28996 B18R2.65882 Clc1cncc(c1)COCc2ccccc2Cl 34a_100000092867_100000187162 [0,2,0,0,0,0|1,0,0]=3 28997 B18R2.65882 Clc1cncc(c1)COCc2ccccc2Cl 34a_100000210847_100016992070 [0,2,0,0,0,0|1,0,0]=3 28998 B18R2.65882 Clc1cncc(c1)COCc2ccccc2Cl 7a_100000092867_100000187162 [0,2,0,0,0,0|1,0,0]=3 28999 B18R2.65882 Clc1cncc(c1)COCc2ccccc2Cl 7a_100000210847_100016992070 [0,2,0,0,0,0|1,0,0]=3 29000 B18R2.65882 Clc1cncc(c1)COCc2ccccc2I 34a_100000092867_100011215278 [0,2,0,0,0,0|1,0,0]=3 29001 B18R2.65882 Clc1cncc(c1)COCc2ccccc2I 34a_100000187465_100016992070 [0,2,0,0,0,0|1,0,0]=3 29002 B18R2.65882 Clc1cncc(c1)COCc2ccccc2I 7a_100000092867_100011215278 [0,2,0,0,0,0|1,0,0]=3 29003 B18R2.65882 Clc1cncc(c1)COCc2ccccc2I 7a_100000187465_100016992070 [0,2,0,0,0,0|1,0,0]=3 29004 B18R2.65882 Clc1cncc(c1)COCc2cccnc2Br 34a_100000092867_100010140945 [0,2,0,0,0,0|2,0,0]=4 29005 B18R2.65882 Clc1cncc(c1)COCc2cccnc2Br 34a_100000719692_100016992070 [0,2,0,0,0,0|2,0,0]=4 29006 B18R2.65882 Clc1cncc(c1)COCc2cccnc2Br 7a_100000092867_100010140945 [0,2,0,0,0,0|2,0,0]=4 29007 B18R2.65882 Clc1cncc(c1)COCc2cccnc2Br 7a_100000719692_100016992070 [0,2,0,0,0,0|2,0,0]=4 29008 B18R2.65882 Clc1cncc(c1)COCc2cccnc2Cl 34a_100000092867_100000045678 [0,2,0,0,0,0|2,0,0]=4 29009 B18R2.65882 Clc1cncc(c1)COCc2cccnc2Cl 34a_100000748726_100016992070 [0,2,0,0,0,0|2,0,0]=4 29010 B18R2.65882 Clc1cncc(c1)COCc2cccnc2Cl 7a_100000092867_100000045678 [0,2,0,0,0,0|2,0,0]=4 29011 B18R2.65882 Clc1cncc(c1)COCc2cccnc2Cl 7a_100000748726_100016992070 [0,2,0,0,0,0|2,0,0]=4 29012 B18R2.65882 Clc1cncc(c1)COCc2ccncc2Cl 7a_100000092867_100000763264 [0,2,0,0,0,0|2,0,0]=4 29013 B18R2.65882 Clc1cncc(c1)COCc2cnccc2Cl 34a_100000117392_100016992070 [0,2,0,0,0,0|2,0,0]=4 29014 B18R2.65882 Clc1cncc(c1)COCc2ncccc2Br 34a_100000092867_100025702911 [0,2,0,0,0,0|2,0,0]=4 29015 B18R2.65882 Clc1cncc(c1)COCc2ncccc2Br 34a_100011996772_100016992070 [0,2,0,0,0,0|2,0,0]=4 29016 B18R2.65882 Clc1cncc(c1)COCc2ncccc2Br 7a_100000092867_100025702911 [0,2,0,0,0,0|2,0,0]=4 29017 B18R2.65882 Clc1cncc(c1)COCc2ncccc2Cl 34a_100012002383_100016992070 [0,2,0,0,0,0|2,0,0]=4 29018 B18R2.65882 Clc1cncc(c1)COCc2ncccc2Cl 7a_100000092867_100000099807 [0,2,0,0,0,0|2,0,0]=4 29019 B18R2.65882 Clc1cncc(c1)CSCc2ccccc2Br 62a_100000184730_100016992070 [0,2,0,0,0,0|1,1,0]=4 29020 B18R2.65882 Clc1cncc(c1)CSCc2ccccc2Br 62a_100016992070_100000184730 [0,2,0,0,0,0|1,1,0]=4 29021 B18R2.65882 Clc1cncc(c1)CSCc2ccccc2Cl 62a_100000187162_100016992070 [0,2,0,0,0,0|1,1,0]=4 29022 B18R2.65882 Clc1cncc(c1)CSCc2ccccc2Cl 62a_100016992070_100000187162 [0,2,0,0,0,0|1,1,0]=4 29023 B18R2.65882 Clc1cncc(c1)CSCc2ccccc2I 62a_100011216222_100016992070 [0,2,0,0,0,0|1,1,0]=4 29024 B18R2.65882 Clc1cncc(c1)CSCc2ccccc2I 62a_100016992070_100011216222 [0,2,0,0,0,0|1,1,0]=4 29025 B18R2.65882 Clc1cnccc1CNCc2cccc(c2)Br 207a_100000174977_100011934409 [0,2,0,0,0,0|2,0,0]=4 29026 B18R2.65882 Clc1cnccc1CNCc2cccc(c2)Br 2230a_100000174977_100000763264 [0,2,0,0,0,0|2,0,0]=4 29027 B18R2.65882 Clc1cnccc1CNCc2cccc(c2)Br 270004a_100000174977_100011934409 [0,2,0,0,0,0|2,0,0]=4 29028 B18R2.65882 Clc1cnccc1CNCc2cccc(c2)I 207a_100000106179_100011934409 [0,2,0,0,0,0|2,0,0]=4 29029 B18R2.65882 Clc1cnccc1CNCc2cccc(c2)I 2230a_100000106179_100000763264 [0,2,0,0,0,0|2,0,0]=4 29030 B18R2.65882 Clc1cnccc1CNCc2cccc(c2)I 270004a_100000106179_100011934409 [0,2,0,0,0,0|2,0,0]=4 29031 B18R2.65882 Clc1cnccc1COCc2cccc(c2)Br 7a_100000687537_100000763264 [0,2,0,0,0,0|1,0,0]=3 29032 B18R2.65882 Clc1cnccc1COCc2cccc(c2)I 7a_100011215336_100000763264 [0,2,0,0,0,0|1,0,0]=3 29033 B18R2.65882 Clc1cnccc1COCc2ccnc(c2)Br 7a_100009814636_100000763264 [0,2,0,0,0,0|2,0,0]=4 29034 B18R2.65882 Clc1cnccc1COCc2cncc(c2)Br 7a_100011259137_100000763264 [0,2,0,0,0,0|2,0,0]=4 29035 B18R2.65882 Clc1cnccc1CSCc2cccc(c2)Br 62a_100000211773_100000763264 [0,2,0,0,0,0|1,1,0]=4 29036 B18R2.65882 Clc1cnccc1CSCc2cccc(c2)Br 62a_100000763264_100000211773 [0,2,0,0,0,0|1,1,0]=4 29037 B18R2.65882 Clc1cnccc1CSCc2cccc(c2)I 62a_100000763264_100011218688 [0,2,0,0,0,0|1,1,0]=4 29038 B18R2.65882 Clc1cnccc1CSCc2cccc(c2)I 62a_100011218688_100000763264 [0,2,0,0,0,0|1,1,0]=4 29039 B18R2.65882 Clc1nccc(n1)COCc2ccccc2Br 34a_100000756307_100000099655 [0,2,0,0,0,0|2,0,0]=4 29040 B18R2.65882 Clc1nccc(n1)COCc2ccccc2Br 7a_100000756307_100000099655 [0,2,0,0,0,0|2,0,0]=4 29041 B18R2.65882 Clc1nccc(n1)COCc2ccccc2Cl 34a_100000210847_100000099655 [0,2,0,0,0,0|2,0,0]=4 29042 B18R2.65882 Clc1nccc(n1)COCc2ccccc2Cl 7a_100000210847_100000099655 [0,2,0,0,0,0|2,0,0]=4 29043 B18R2.65882 Clc1nccc(n1)COCc2ccccc2I 34a_100000187465_100000099655 [0,2,0,0,0,0|2,0,0]=4 29044 B18R2.65882 Clc1nccc(n1)COCc2ccccc2I 7a_100000187465_100000099655 [0,2,0,0,0,0|2,0,0]=4 29045 B18R2.65882 Clc1ncccc1CNCc2cccc(c2)Br 207a_100015189234_100000210085 [0,2,0,0,0,0|2,0,0]=4 29046 B18R2.65882 Clc1ncccc1CNCc2cccc(c2)Br 2230a_100000174977_100000045678 [0,2,0,0,0,0|2,0,0]=4 29047 B18R2.65882 Clc1ncccc1CNCc2cccc(c2)Br 2230a_100015189234_100000698116 [0,2,0,0,0,0|2,0,0]=4 29048 B18R2.65882 Clc1ncccc1CNCc2cccc(c2)Br 34a_100000174977_100000045678 [0,2,0,0,0,0|2,0,0]=4 29049 B18R2.65882 Clc1ncccc1CNCc2cccc(c2)Br 34a_100015189234_100000698116 [0,2,0,0,0,0|2,0,0]=4 29050 B18R2.65882 Clc1ncccc1CNCc2cccc(c2)I 207a_100015189234_100000014684 [0,2,0,0,0,0|2,0,0]=4 29051 B18R2.65882 Clc1ncccc1CNCc2cccc(c2)I 2230a_100000106179_100000045678 [0,2,0,0,0,0|2,0,0]=4 29052 B18R2.65882 Clc1ncccc1CNCc2cccc(c2)I 2230a_100015189234_100011218688 [0,2,0,0,0,0|2,0,0]=4 29053 B18R2.65882 Clc1ncccc1CNCc2cccc(c2)I 34a_100000106179_100000045678 [0,2,0,0,0,0|2,0,0]=4 29054 B18R2.65882 Clc1ncccc1CNCc2cccc(c2)I 34a_100015189234_100011218688 [0,2,0,0,0,0|2,0,0]=4 29055 B18R2.65882 Clc1ncccc1COCc2cc(ccn2)Br 34a_100000748726_100010173614 [0,2,0,0,0,0|2,0,0]=4 29056 B18R2.65882 Clc1ncccc1COCc2cc(ccn2)Br 7a_100000748726_100010173614 [0,2,0,0,0,0|2,0,0]=4 29057 B18R2.65882 Clc1ncccc1COCc2cccc(c2)Br 34a_100000687537_100000045678 [0,2,0,0,0,0|1,0,0]=3 29058 B18R2.65882 Clc1ncccc1COCc2cccc(c2)Br 34a_100000748726_100000698116 [0,2,0,0,0,0|1,0,0]=3 29059 B18R2.65882 Clc1ncccc1COCc2cccc(c2)Br 7a_100000687537_100000045678 [0,2,0,0,0,0|1,0,0]=3 29060 B18R2.65882 Clc1ncccc1COCc2cccc(c2)Br 7a_100000748726_100000211773 [0,2,0,0,0,0|1,0,0]=3 29061 B18R2.65882 Clc1ncccc1COCc2cccc(c2)I 34a_100000748726_100011218688 [0,2,0,0,0,0|1,0,0]=3 29062 B18R2.65882 Clc1ncccc1COCc2cccc(c2)I 34a_100011215336_100000045678 [0,2,0,0,0,0|1,0,0]=3 29063 B18R2.65882 Clc1ncccc1COCc2cccc(c2)I 7a_100000748726_100011218688 [0,2,0,0,0,0|1,0,0]=3 29064 B18R2.65882 Clc1ncccc1COCc2cccc(c2)I 7a_100011215336_100000045678 [0,2,0,0,0,0|1,0,0]=3 29065 B18R2.65882 Clc1ncccc1COCc2cccc(n2)Br 34a_100000694195_100000045678 [0,2,0,0,0,0|2,0,0]=4 29066 B18R2.65882 Clc1ncccc1COCc2cccc(n2)Br 34a_100000748726_100009889011 [0,2,0,0,0,0|2,0,0]=4 29067 B18R2.65882 Clc1ncccc1COCc2cccc(n2)Br 7a_100000748726_100009889011 [0,2,0,0,0,0|2,0,0]=4 29068 B18R2.65882 Clc1ncccc1COCc2ccnc(c2)Br 34a_100000748726_100010243470 [0,2,0,0,0,0|2,0,0]=4 29069 B18R2.65882 Clc1ncccc1COCc2ccnc(c2)Br 34a_100009814636_100000045678 [0,2,0,0,0,0|2,0,0]=4 29070 B18R2.65882 Clc1ncccc1COCc2ccnc(c2)Br 7a_100000748726_100010254460 [0,2,0,0,0,0|2,0,0]=4 29071 B18R2.65882 Clc1ncccc1COCc2ccnc(c2)Br 7a_100009814636_100000045678 [0,2,0,0,0,0|2,0,0]=4 29072 B18R2.65882 Clc1ncccc1COCc2cncc(c2)Br 34a_100000748726_100000738771 [0,2,0,0,0,0|2,0,0]=4 29073 B18R2.65882 Clc1ncccc1COCc2cncc(c2)Br 34a_100011259137_100000045678 [0,2,0,0,0,0|2,0,0]=4 29074 B18R2.65882 Clc1ncccc1COCc2cncc(c2)Br 7a_100000748726_100000738771 [0,2,0,0,0,0|2,0,0]=4 29075 B18R2.65882 Clc1ncccc1COCc2cncc(c2)Br 7a_100011259137_100000045678 [0,2,0,0,0,0|2,0,0]=4 29076 B18R2.65882 Clc1ncccc1CSCc2cccc(c2)Br 62a_100000045678_100000211773 [0,2,0,0,0,0|1,1,0]=4 29077 B18R2.65882 Clc1ncccc1CSCc2cccc(c2)Br 62a_100000211773_100000045678 [0,2,0,0,0,0|1,1,0]=4 29078 B18R2.65882 Clc1ncccc1CSCc2cccc(c2)I 62a_100000045678_100011218688 [0,2,0,0,0,0|1,1,0]=4 29079 B18R2.65882 Clc1ncccc1CSCc2cccc(c2)I 62a_100011218688_100000045678 [0,2,0,0,0,0|1,1,0]=4 29080 B18R2.65882 Clc1nccnc1COCc2cccc(c2)Br 34a_100000057004_100000698116 [0,2,0,0,0,0|2,0,0]=4 29081 B18R2.65882 Clc1nccnc1COCc2cccc(c2)I 34a_100000057004_100011218688 [0,2,0,0,0,0|2,0,0]=4 29082 B18R2.65882 Fc1cc(ccn1)CNCc2ccccc2Br 2230a_100015188774_100000184730 [0,2,0,0,0,0|2,0,0]=4 29083 B18R2.65882 Fc1cc(ccn1)CNCc2ccccc2Br 270004a_100000689332_100000068331 [0,2,0,0,0,0|2,0,0]=4 29084 B18R2.65882 Fc1cc(ccn1)CNCc2ccccc2Br 270004a_100015188774_100000211189 [0,2,0,0,0,0|2,0,0]=4 29085 B18R2.65882 Fc1cc(ccn1)CNCc2ccccc2Br 34a_100015188774_100000184730 [0,2,0,0,0,0|2,0,0]=4 29086 B18R2.65882 Fc1cc(ccn1)CNCc2ccccc2Cl 2230a_100015188774_100000187162 [0,2,0,0,0,0|2,0,0]=4 29087 B18R2.65882 Fc1cc(ccn1)CNCc2ccccc2Cl 270004a_100000174879_100000068331 [0,2,0,0,0,0|2,0,0]=4 29088 B18R2.65882 Fc1cc(ccn1)CNCc2ccccc2Cl 270004a_100015188774_100000210073 [0,2,0,0,0,0|2,0,0]=4 29089 B18R2.65882 Fc1cc(ccn1)CNCc2ccccc2Cl 34a_100015188774_100000187162 [0,2,0,0,0,0|2,0,0]=4 29090 B18R2.65882 Fc1cc(ccn1)CNCc2ccccc2F 2230a_100015188774_100000211605 [0,2,0,0,0,0|2,0,0]=4 29091 B18R2.65882 Fc1cc(ccn1)CNCc2ccccc2F 270004a_100000174869_100000068331 [0,2,0,0,0,0|2,0,0]=4 29092 B18R2.65882 Fc1cc(ccn1)CNCc2ccccc2F 270004a_100015188774_100000210811 [0,2,0,0,0,0|2,0,0]=4 29093 B18R2.65882 Fc1cc(ccn1)CNCc2ccccc2F 34a_100015188774_100000211605 [0,2,0,0,0,0|2,0,0]=4 29094 B18R2.65882 Fc1cc(ccn1)CNCc2ccccc2I 2230a_100015188774_100011215278 [0,2,0,0,0,0|2,0,0]=4 29095 B18R2.65882 Fc1cc(ccn1)CNCc2ccccc2I 270004a_100015188774_100000010305 [0,2,0,0,0,0|2,0,0]=4 29096 B18R2.65882 Fc1cc(ccn1)CNCc2ccccc2I 270004a_100015347259_100000068331 [0,2,0,0,0,0|2,0,0]=4 29097 B18R2.65882 Fc1cc(ccn1)CNCc2ccccc2I 34a_100015188774_100011215278 [0,2,0,0,0,0|2,0,0]=4 29098 B18R2.65882 Fc1cc(ccn1)COCc2ccccc2Br 34a_100000082451_100000184730 [0,2,0,0,0,0|1,0,0]=3 29099 B18R2.65882 Fc1cc(ccn1)COCc2ccccc2Cl 34a_100000082451_100000187162 [0,2,0,0,0,0|1,0,0]=3 29100 B18R2.65882 Fc1cc(ccn1)COCc2ccccc2F 34a_100000082451_100000211605 [0,2,0,0,0,0|1,0,0]=3 29101 B18R2.65882 Fc1cc(ccn1)COCc2ccccc2I 34a_100000082451_100011215278 [0,2,0,0,0,0|1,0,0]=3 29102 B18R2.65882 Fc1cc(ccn1)COCc2cccnc2Br 34a_100000082451_100010140945 [0,2,0,0,0,0|2,0,0]=4 29103 B18R2.65882 Fc1cc(ccn1)COCc2cccnc2Cl 34a_100000082451_100000045678 [0,2,0,0,0,0|2,0,0]=4 29104 B18R2.65882 Fc1cc(ccn1)COCc2cccnc2F 34a_100000082451_100000099810 [0,2,0,0,0,0|2,0,0]=4 29105 B18R2.65882 Fc1cc(ccn1)COCc2ncccc2Br 34a_100000082451_100025702911 [0,2,0,0,0,0|2,0,0]=4 29106 B18R2.65882 Fc1cc(ccn1)COCc2ncccc2F 34a_100000082451_100000104219 [0,2,0,0,0,0|2,0,0]=4 29107 B18R2.65882 Fc1cccc(c1)CCNc2ccccc2Br 34a_100000210017_100011217235 [0,2,0,0,0,0|2,0,0]=4 29108 B18R2.65882 Fc1cccc(c1)CCNc2ccccc2Cl 34a_100000185783_100011217235 [0,2,0,0,0,0|2,0,0]=4 29109 B18R2.65882 Fc1cccc(c1)CCNc2ccccc2F 34a_100000210422_100011217235 [0,2,0,0,0,0|2,0,0]=4 29110 B18R2.65882 Fc1cccc(c1)CCNc2ccccc2I 34a_100000210053_100011217235 [0,2,0,0,0,0|2,0,0]=4 29111 B18R2.65882 Fc1cccc(c1)CCOc2ccccc2Br 34a_100000181306_100011217235 [0,2,0,0,0,0|2,0,0]=4 29112 B18R2.65882 Fc1cccc(c1)CCOc2ccccc2Br 7a_100000181306_100011217235 [0,2,0,0,0,0|2,0,0]=4 29113 B18R2.65882 Fc1cccc(c1)CCOc2ccccc2Cl 34a_100000210172_100011217235 [0,2,0,0,0,0|2,0,0]=4 29114 B18R2.65882 Fc1cccc(c1)CCOc2ccccc2Cl 7a_100000210172_100011217235 [0,2,0,0,0,0|2,0,0]=4 29115 B18R2.65882 Fc1cccc(c1)CCOc2ccccc2F 34a_100000210171_100011217235 [0,2,0,0,0,0|2,0,0]=4 29116 B18R2.65882 Fc1cccc(c1)CCOc2ccccc2F 7a_100000210171_100011217235 [0,2,0,0,0,0|2,0,0]=4 29117 B18R2.65882 Fc1cccc(c1)CCOc2ccccc2I 34a_100000739446_100011217235 [0,2,0,0,0,0|2,0,0]=4 29118 B18R2.65882 Fc1cccc(c1)CCOc2ccccc2I 7a_100000739446_100011217235 [0,2,0,0,0,0|2,0,0]=4 29119 B18R2.65882 Fc1cccc(c1)CCSc2ccccc2Br 62a_100000695589_100011217235 [0,2,0,0,0,0|2,0,0]=4 29120 B18R2.65882 Fc1cccc(c1)CCSc2ccccc2Br 62a_100011217235_100000695589 [0,2,0,0,0,0|2,0,0]=4 29121 B18R2.65882 Fc1cccc(c1)CCSc2ccccc2Cl 62a_100000764095_100011217235 [0,2,0,0,0,0|2,0,0]=4 29122 B18R2.65882 Fc1cccc(c1)CCSc2ccccc2Cl 62a_100011217235_100000764095 [0,2,0,0,0,0|2,0,0]=4 29123 B18R2.65882 Fc1cccc(c1)CCSc2ccccc2F 62a_100011215700_100011217235 [0,2,0,0,0,0|2,0,0]=4 29124 B18R2.65882 Fc1cccc(c1)CCSc2ccccc2F 62a_100011217235_100011215700 [0,2,0,0,0,0|2,0,0]=4 29125 B18R2.65882 Fc1cccc(c1)CNCc2ccccc2Br 207a_100000174948_100000211189 [0,2,0,0,0,0|1,0,0]=3 29126 B18R2.65882 Fc1cccc(c1)CNCc2ccccc2Br 207a_100000689332_100000210812 [0,2,0,0,0,0|1,0,0]=3 29127 B18R2.65882 Fc1cccc(c1)CNCc2ccccc2Br 2230a_100000174948_100000184730 [0,2,0,0,0,0|1,0,0]=3 29128 B18R2.65882 Fc1cccc(c1)CNCc2ccccc2Br 2230a_100000689332_100000230114 [0,2,0,0,0,0|1,0,0]=3 29129 B18R2.65882 Fc1cccc(c1)CNCc2ccccc2Br 270004a_100000174948_100000211189 [0,2,0,0,0,0|1,0,0]=3 29130 B18R2.65882 Fc1cccc(c1)CNCc2ccccc2Br 270004a_100000689332_100000210812 [0,2,0,0,0,0|1,0,0]=3 29131 B18R2.65882 Fc1cccc(c1)CNCc2ccccc2Br 34a_100000174948_100000184730 [0,2,0,0,0,0|1,0,0]=3 29132 B18R2.65882 Fc1cccc(c1)CNCc2ccccc2Br 34a_100000689332_100000187166 [0,2,0,0,0,0|1,0,0]=3 29133 B18R2.65882 Fc1cccc(c1)CNCc2ccccc2Cl 207a_100000174879_100000210812 [0,2,0,0,0,0|1,0,0]=3 29134 B18R2.65882 Fc1cccc(c1)CNCc2ccccc2Cl 207a_100000174948_100000210073 [0,2,0,0,0,0|1,0,0]=3 29135 B18R2.65882 Fc1cccc(c1)CNCc2ccccc2Cl 2230a_100000174879_100000230114 [0,2,0,0,0,0|1,0,0]=3 29136 B18R2.65882 Fc1cccc(c1)CNCc2ccccc2Cl 2230a_100000174948_100000187162 [0,2,0,0,0,0|1,0,0]=3 29137 B18R2.65882 Fc1cccc(c1)CNCc2ccccc2Cl 270004a_100000174879_100000210812 [0,2,0,0,0,0|1,0,0]=3 29138 B18R2.65882 Fc1cccc(c1)CNCc2ccccc2Cl 270004a_100000174948_100000210073 [0,2,0,0,0,0|1,0,0]=3 29139 B18R2.65882 Fc1cccc(c1)CNCc2ccccc2Cl 34a_100000174879_100000187166 [0,2,0,0,0,0|1,0,0]=3 29140 B18R2.65882 Fc1cccc(c1)CNCc2ccccc2Cl 34a_100000174948_100000187162 [0,2,0,0,0,0|1,0,0]=3 29141 B18R2.65882 Fc1cccc(c1)CNCc2ccccc2F 207a_100000174869_100000210812 [0,2,0,0,0,0|1,0,0]=3 29142 B18R2.65882 Fc1cccc(c1)CNCc2ccccc2F 207a_100000174948_100000210811 [0,2,0,0,0,0|1,0,0]=3 29143 B18R2.65882 Fc1cccc(c1)CNCc2ccccc2F 2230a_100000174948_100000211605 [0,2,0,0,0,0|1,0,0]=3 29144 B18R2.65882 Fc1cccc(c1)CNCc2ccccc2F 270004a_100000174869_100000210812 [0,2,0,0,0,0|1,0,0]=3 29145 B18R2.65882 Fc1cccc(c1)CNCc2ccccc2F 270004a_100000174948_100000210811 [0,2,0,0,0,0|1,0,0]=3 29146 B18R2.65882 Fc1cccc(c1)CNCc2ccccc2F 34a_100000174869_100000187166 [0,2,0,0,0,0|1,0,0]=3 29147 B18R2.65882 Fc1cccc(c1)CNCc2ccccc2F 34a_100000174948_100000211605 [0,2,0,0,0,0|1,0,0]=3 29148 B18R2.65882 Fc1cccc(c1)CNCc2ccccc2I 207a_100000174948_100000010305 [0,2,0,0,0,0|1,0,0]=3 29149 B18R2.65882 Fc1cccc(c1)CNCc2ccccc2I 207a_100015347259_100000210812 [0,2,0,0,0,0|1,0,0]=3 29150 B18R2.65882 Fc1cccc(c1)CNCc2ccccc2I 2230a_100000174948_100011215278 [0,2,0,0,0,0|1,0,0]=3 29151 B18R2.65882 Fc1cccc(c1)CNCc2ccccc2I 270004a_100000174948_100000010305 [0,2,0,0,0,0|1,0,0]=3 29152 B18R2.65882 Fc1cccc(c1)CNCc2ccccc2I 270004a_100015347259_100000210812 [0,2,0,0,0,0|1,0,0]=3 29153 B18R2.65882 Fc1cccc(c1)CNCc2ccccc2I 34a_100000174948_100011215278 [0,2,0,0,0,0|1,0,0]=3 29154 B18R2.65882 Fc1cccc(c1)CNCc2cccnc2Br 2230a_100000174948_100010140945 [0,2,0,0,0,0|2,0,0]=4 29155 B18R2.65882 Fc1cccc(c1)CNCc2cccnc2Br 2230a_100009818023_100000230114 [0,2,0,0,0,0|2,0,0]=4 29156 B18R2.65882 Fc1cccc(c1)CNCc2cccnc2Br 270004a_100009818023_100000210812 [0,2,0,0,0,0|2,0,0]=4 29157 B18R2.65882 Fc1cccc(c1)CNCc2cccnc2Br 34a_100000174948_100010140945 [0,2,0,0,0,0|2,0,0]=4 29158 B18R2.65882 Fc1cccc(c1)CNCc2cccnc2Br 34a_100009818023_100000187166 [0,2,0,0,0,0|2,0,0]=4 29159 B18R2.65882 Fc1cccc(c1)CNCc2cccnc2Cl 207a_100015189234_100000210812 [0,2,0,0,0,0|2,0,0]=4 29160 B18R2.65882 Fc1cccc(c1)CNCc2cccnc2Cl 2230a_100000174948_100000045678 [0,2,0,0,0,0|2,0,0]=4 29161 B18R2.65882 Fc1cccc(c1)CNCc2cccnc2Cl 2230a_100015189234_100000230114 [0,2,0,0,0,0|2,0,0]=4 29162 B18R2.65882 Fc1cccc(c1)CNCc2cccnc2Cl 34a_100000174948_100000045678 [0,2,0,0,0,0|2,0,0]=4 29163 B18R2.65882 Fc1cccc(c1)CNCc2cccnc2Cl 34a_100015189234_100000187166 [0,2,0,0,0,0|2,0,0]=4 29164 B18R2.65882 Fc1cccc(c1)CNCc2cccnc2F 2230a_100000174948_100000099810 [0,2,0,0,0,0|2,0,0]=4 29165 B18R2.65882 Fc1cccc(c1)CNCc2cccnc2F 270004a_100000724633_100000210812 [0,2,0,0,0,0|2,0,0]=4 29166 B18R2.65882 Fc1cccc(c1)CNCc2cccnc2F 34a_100000174948_100000099810 [0,2,0,0,0,0|2,0,0]=4 29167 B18R2.65882 Fc1cccc(c1)CNCc2cccnc2F 34a_100000724633_100000187166 [0,2,0,0,0,0|2,0,0]=4 29168 B18R2.65882 Fc1cccc(c1)CNCc2ccncc2Br 207a_100020640021_100000210812 [0,2,0,0,0,0|2,0,0]=4 29169 B18R2.65882 Fc1cccc(c1)CNCc2ccncc2Br 270004a_100000174948_100000755692 [0,2,0,0,0,0|2,0,0]=4 29170 B18R2.65882 Fc1cccc(c1)CNCc2ccncc2Br 270004a_100020640021_100000210812 [0,2,0,0,0,0|2,0,0]=4 29171 B18R2.65882 Fc1cccc(c1)CNCc2ccncc2Cl 207a_100000174948_100011934409 [0,2,0,0,0,0|2,0,0]=4 29172 B18R2.65882 Fc1cccc(c1)CNCc2ccncc2Cl 2230a_100000174948_100000763264 [0,2,0,0,0,0|2,0,0]=4 29173 B18R2.65882 Fc1cccc(c1)CNCc2ccncc2Cl 270004a_100000174948_100011934409 [0,2,0,0,0,0|2,0,0]=4 29174 B18R2.65882 Fc1cccc(c1)CNCc2ccncc2F 207a_100011935246_100000210812 [0,2,0,0,0,0|2,0,0]=4 29175 B18R2.65882 Fc1cccc(c1)CNCc2ccncc2F 270004a_100011935246_100000210812 [0,2,0,0,0,0|2,0,0]=4 29176 B18R2.65882 Fc1cccc(c1)CNCc2ccncc2F 34a_100011935246_100000187166 [0,2,0,0,0,0|2,0,0]=4 29177 B18R2.65882 Fc1cccc(c1)CNCc2cnccc2Br 270004a_100000174948_100009816821 [0,2,0,0,0,0|2,0,0]=4 29178 B18R2.65882 Fc1cccc(c1)CNCc2cnccc2Cl 270004a_100000174948_100000050567 [0,2,0,0,0,0|2,0,0]=4 29179 B18R2.65882 Fc1cccc(c1)CNCc2ncccc2Br 207a_100000174948_100011934733 [0,2,0,0,0,0|2,0,0]=4 29180 B18R2.65882 Fc1cccc(c1)CNCc2ncccc2Br 2230a_100000174948_100025702911 [0,2,0,0,0,0|2,0,0]=4 29181 B18R2.65882 Fc1cccc(c1)CNCc2ncccc2Br 270004a_100000174948_100011934733 [0,2,0,0,0,0|2,0,0]=4 29182 B18R2.65882 Fc1cccc(c1)CNCc2ncccc2Br 270004a_100020591323_100000210812 [0,2,0,0,0,0|2,0,0]=4 29183 B18R2.65882 Fc1cccc(c1)CNCc2ncccc2Br 34a_100000174948_100025702911 [0,2,0,0,0,0|2,0,0]=4 29184 B18R2.65882 Fc1cccc(c1)CNCc2ncccc2Cl 207a_100000174948_100012001307 [0,2,0,0,0,0|2,0,0]=4 29185 B18R2.65882 Fc1cccc(c1)CNCc2ncccc2Cl 2230a_100000174948_100000099807 [0,2,0,0,0,0|2,0,0]=4 29186 B18R2.65882 Fc1cccc(c1)CNCc2ncccc2Cl 2230a_100015189233_100000230114 [0,2,0,0,0,0|2,0,0]=4 29187 B18R2.65882 Fc1cccc(c1)CNCc2ncccc2Cl 270004a_100000174948_100012001307 [0,2,0,0,0,0|2,0,0]=4 29188 B18R2.65882 Fc1cccc(c1)CNCc2ncccc2Cl 270004a_100015189233_100000210812 [0,2,0,0,0,0|2,0,0]=4 29189 B18R2.65882 Fc1cccc(c1)CNCc2ncccc2F 207a_100000174948_100011934734 [0,2,0,0,0,0|2,0,0]=4 29190 B18R2.65882 Fc1cccc(c1)CNCc2ncccc2F 2230a_100000174948_100000104219 [0,2,0,0,0,0|2,0,0]=4 29191 B18R2.65882 Fc1cccc(c1)CNCc2ncccc2F 270004a_100000174948_100011934734 [0,2,0,0,0,0|2,0,0]=4 29192 B18R2.65882 Fc1cccc(c1)CNCc2ncccc2F 270004a_100000690088_100000210812 [0,2,0,0,0,0|2,0,0]=4 29193 B18R2.65882 Fc1cccc(c1)CNCc2ncccc2F 34a_100000174948_100000104219 [0,2,0,0,0,0|2,0,0]=4 29194 B18R2.65882 Fc1cccc(c1)CNCc2ncccc2F 34a_100000690088_100000187166 [0,2,0,0,0,0|2,0,0]=4 29195 B18R2.65882 Fc1cccc(c1)COCc2ccccc2Br 34a_100000210976_100000184730 [0,2,0,0,0,0|0,0,0]=2 29196 B18R2.65882 Fc1cccc(c1)COCc2ccccc2Br 34a_100000756307_100000187166 [0,2,0,0,0,0|0,0,0]=2 29197 B18R2.65882 Fc1cccc(c1)COCc2ccccc2Br 7a_100000210976_100000184730 [0,2,0,0,0,0|0,0,0]=2 29198 B18R2.65882 Fc1cccc(c1)COCc2ccccc2Br 7a_100000756307_100000230114 [0,2,0,0,0,0|0,0,0]=2 29199 B18R2.65882 Fc1cccc(c1)COCc2ccccc2Cl 34a_100000210847_100000187166 [0,2,0,0,0,0|0,0,0]=2 29200 B18R2.65882 Fc1cccc(c1)COCc2ccccc2Cl 34a_100000210976_100000187162 [0,2,0,0,0,0|0,0,0]=2 29201 B18R2.65882 Fc1cccc(c1)COCc2ccccc2Cl 7a_100000210847_100000230114 [0,2,0,0,0,0|0,0,0]=2 29202 B18R2.65882 Fc1cccc(c1)COCc2ccccc2Cl 7a_100000210976_100000187162 [0,2,0,0,0,0|0,0,0]=2 29203 B18R2.65882 Fc1cccc(c1)COCc2ccccc2F 34a_100000210976_100000211605 [0,2,0,0,0,0|0,0,0]=2 29204 B18R2.65882 Fc1cccc(c1)COCc2ccccc2F 34a_100000211962_100000187166 [0,2,0,0,0,0|0,0,0]=2 29205 B18R2.65882 Fc1cccc(c1)COCc2ccccc2F 7a_100000210976_100000211605 [0,2,0,0,0,0|0,0,0]=2 29206 B18R2.65882 Fc1cccc(c1)COCc2ccccc2F 7a_100000211962_100000230114 [0,2,0,0,0,0|0,0,0]=2 29207 B18R2.65882 Fc1cccc(c1)COCc2ccccc2I 34a_100000187465_100000187166 [0,2,0,0,0,0|0,0,0]=2 29208 B18R2.65882 Fc1cccc(c1)COCc2ccccc2I 34a_100000210976_100011215278 [0,2,0,0,0,0|0,0,0]=2 29209 B18R2.65882 Fc1cccc(c1)COCc2ccccc2I 7a_100000187465_100000230114 [0,2,0,0,0,0|0,0,0]=2 29210 B18R2.65882 Fc1cccc(c1)COCc2ccccc2I 7a_100000210976_100011215278 [0,2,0,0,0,0|0,0,0]=2 29211 B18R2.65882 Fc1cccc(c1)COCc2cccnc2Br 34a_100000210976_100010140945 [0,2,0,0,0,0|1,0,0]=3 29212 B18R2.65882 Fc1cccc(c1)COCc2cccnc2Br 34a_100000719692_100000187166 [0,2,0,0,0,0|1,0,0]=3 29213 B18R2.65882 Fc1cccc(c1)COCc2cccnc2Br 7a_100000210976_100010140945 [0,2,0,0,0,0|1,0,0]=3 29214 B18R2.65882 Fc1cccc(c1)COCc2cccnc2Br 7a_100000719692_100000230114 [0,2,0,0,0,0|1,0,0]=3 29215 B18R2.65882 Fc1cccc(c1)COCc2cccnc2Cl 34a_100000210976_100000045678 [0,2,0,0,0,0|1,0,0]=3 29216 B18R2.65882 Fc1cccc(c1)COCc2cccnc2Cl 34a_100000748726_100000187166 [0,2,0,0,0,0|1,0,0]=3 29217 B18R2.65882 Fc1cccc(c1)COCc2cccnc2Cl 7a_100000210976_100000045678 [0,2,0,0,0,0|1,0,0]=3 29218 B18R2.65882 Fc1cccc(c1)COCc2cccnc2Cl 7a_100000748726_100000230114 [0,2,0,0,0,0|1,0,0]=3 29219 B18R2.65882 Fc1cccc(c1)COCc2cccnc2F 34a_100000079888_100000187166 [0,2,0,0,0,0|1,0,0]=3 29220 B18R2.65882 Fc1cccc(c1)COCc2cccnc2F 34a_100000210976_100000099810 [0,2,0,0,0,0|1,0,0]=3 29221 B18R2.65882 Fc1cccc(c1)COCc2cccnc2F 7a_100000079888_100000230114 [0,2,0,0,0,0|1,0,0]=3 29222 B18R2.65882 Fc1cccc(c1)COCc2cccnc2F 7a_100000210976_100000099810 [0,2,0,0,0,0|1,0,0]=3 29223 B18R2.65882 Fc1cccc(c1)COCc2ccncc2Cl 7a_100000210976_100000763264 [0,2,0,0,0,0|1,0,0]=3 29224 B18R2.65882 Fc1cccc(c1)COCc2ccncc2F 34a_100012172863_100000187166 [0,2,0,0,0,0|1,0,0]=3 29225 B18R2.65882 Fc1cccc(c1)COCc2cnccc2Cl 34a_100000117392_100000187166 [0,2,0,0,0,0|1,0,0]=3 29226 B18R2.65882 Fc1cccc(c1)COCc2ncccc2Br 34a_100000210976_100025702911 [0,2,0,0,0,0|1,0,0]=3 29227 B18R2.65882 Fc1cccc(c1)COCc2ncccc2Br 34a_100011996772_100000187166 [0,2,0,0,0,0|1,0,0]=3 29228 B18R2.65882 Fc1cccc(c1)COCc2ncccc2Br 7a_100000210976_100025702911 [0,2,0,0,0,0|1,0,0]=3 29229 B18R2.65882 Fc1cccc(c1)COCc2ncccc2Cl 34a_100012002383_100000187166 [0,2,0,0,0,0|1,0,0]=3 29230 B18R2.65882 Fc1cccc(c1)COCc2ncccc2Cl 7a_100000210976_100000099807 [0,2,0,0,0,0|1,0,0]=3 29231 B18R2.65882 Fc1cccc(c1)COCc2ncccc2F 34a_100000210976_100000104219 [0,2,0,0,0,0|1,0,0]=3 29232 B18R2.65882 Fc1cccc(c1)COCc2ncccc2F 34a_100011934865_100000187166 [0,2,0,0,0,0|1,0,0]=3 29233 B18R2.65882 Fc1cccc(c1)COCc2ncccc2F 7a_100000210976_100000104219 [0,2,0,0,0,0|1,0,0]=3 29234 B18R2.65882 Fc1cccc(c1)COCc2nccnc2Cl 34a_100000057004_100000187166 [0,2,0,0,0,0|2,0,0]=4 29235 B18R2.65882 Fc1cccc(c1)CSCc2ccccc2Br 62a_100000184730_100000230114 [0,2,0,0,0,0|0,1,0]=3 29236 B18R2.65882 Fc1cccc(c1)CSCc2ccccc2Br 62a_100000230114_100000184730 [0,2,0,0,0,0|0,1,0]=3 29237 B18R2.65882 Fc1cccc(c1)CSCc2ccccc2Cl 62a_100000187162_100000230114 [0,2,0,0,0,0|0,1,0]=3 29238 B18R2.65882 Fc1cccc(c1)CSCc2ccccc2Cl 62a_100000230114_100000187162 [0,2,0,0,0,0|0,1,0]=3 29239 B18R2.65882 Fc1cccc(c1)CSCc2ccccc2F 62a_100000211605_100000230114 [0,2,0,0,0,0|0,1,0]=3 29240 B18R2.65882 Fc1cccc(c1)CSCc2ccccc2F 62a_100000230114_100000211605 [0,2,0,0,0,0|0,1,0]=3 29241 B18R2.65882 Fc1cccc(c1)CSCc2ccccc2I 62a_100000230114_100011216222 [0,2,0,0,0,0|0,1,0]=3 29242 B18R2.65882 Fc1cccc(c1)CSCc2ccccc2I 62a_100011216222_100000230114 [0,2,0,0,0,0|0,1,0]=3 29243 B18R2.65882 Fc1cccc(c1)CSCc2cccnc2Br 62a_100000230114_100010140945 [0,2,0,0,0,0|1,1,0]=4 29244 B18R2.65882 Fc1cccc(c1)CSCc2cccnc2Br 62a_100010140945_100000230114 [0,2,0,0,0,0|1,1,0]=4 29245 B18R2.65882 Fc1cccc(c1)CSCc2cccnc2Cl 62a_100000045678_100000230114 [0,2,0,0,0,0|1,1,0]=4 29246 B18R2.65882 Fc1cccc(c1)CSCc2cccnc2Cl 62a_100000230114_100000045678 [0,2,0,0,0,0|1,1,0]=4 29247 B18R2.65882 Fc1cccc(c1)CSCc2cccnc2F 62a_100000099810_100000230114 [0,2,0,0,0,0|1,1,0]=4 29248 B18R2.65882 Fc1cccc(c1)CSCc2cccnc2F 62a_100000230114_100000099810 [0,2,0,0,0,0|1,1,0]=4 29249 B18R2.65882 Fc1cccc(c1)CSCc2ccncc2Cl 62a_100000230114_100000763264 [0,2,0,0,0,0|1,1,0]=4 29250 B18R2.65882 Fc1cccc(c1)CSCc2ccncc2Cl 62a_100000763264_100000230114 [0,2,0,0,0,0|1,1,0]=4 29251 B18R2.65882 Fc1cccc(c1)CSCc2ncccc2Br 62a_100000230114_100025702911 [0,2,0,0,0,0|1,1,0]=4 29252 B18R2.65882 Fc1cccc(c1)CSCc2ncccc2Br 62a_100025702911_100000230114 [0,2,0,0,0,0|1,1,0]=4 29253 B18R2.65882 Fc1cccc(c1)CSCc2ncccc2Cl 62a_100000099807_100000230114 [0,2,0,0,0,0|1,1,0]=4 29254 B18R2.65882 Fc1cccc(c1)CSCc2ncccc2Cl 62a_100000230114_100000099807 [0,2,0,0,0,0|1,1,0]=4 29255 B18R2.65882 Fc1cccc(c1)CSCc2ncccc2F 62a_100000104219_100000230114 [0,2,0,0,0,0|1,1,0]=4 29256 B18R2.65882 Fc1cccc(c1)CSCc2ncccc2F 62a_100000230114_100000104219 [0,2,0,0,0,0|1,1,0]=4 29257 B18R2.65882 Fc1cccc(c1)NCCc2ccccc2Br 34a_100000210047_100012161201 [0,2,0,0,0,0|2,0,0]=4 29258 B18R2.65882 Fc1cccc(c1)NCCc2ccccc2Cl 34a_100000210047_100011713703 [0,2,0,0,0,0|2,0,0]=4 29259 B18R2.65882 Fc1cccc(c1)NCCc2ccccc2F 34a_100000210047_100000720011 [0,2,0,0,0,0|2,0,0]=4 29260 B18R2.65882 Fc1cccc(c1)OCCc2ccccc2Br 34a_100000210426_100012161201 [0,2,0,0,0,0|2,0,0]=4 29261 B18R2.65882 Fc1cccc(c1)OCCc2ccccc2Br 7a_100000210426_100012161201 [0,2,0,0,0,0|2,0,0]=4 29262 B18R2.65882 Fc1cccc(c1)OCCc2ccccc2Cl 34a_100000210426_100011713703 [0,2,0,0,0,0|2,0,0]=4 29263 B18R2.65882 Fc1cccc(c1)OCCc2ccccc2Cl 7a_100000210426_100011713703 [0,2,0,0,0,0|2,0,0]=4 29264 B18R2.65882 Fc1cccc(c1)OCCc2ccccc2F 34a_100000210426_100000720011 [0,2,0,0,0,0|2,0,0]=4 29265 B18R2.65882 Fc1cccc(c1)OCCc2ccccc2F 7a_100000210426_100000720011 [0,2,0,0,0,0|2,0,0]=4 29266 B18R2.65882 Fc1cccc(c1)SCCc2ccccc2Br 62a_100000685547_100012161201 [0,2,0,0,0,0|2,0,0]=4 29267 B18R2.65882 Fc1cccc(c1)SCCc2ccccc2Br 62a_100012161201_100000685547 [0,2,0,0,0,0|2,0,0]=4 29268 B18R2.65882 Fc1cccc(c1)SCCc2ccccc2Cl 62a_100000685547_100011713703 [0,2,0,0,0,0|2,0,0]=4 29269 B18R2.65882 Fc1cccc(c1)SCCc2ccccc2Cl 62a_100011713703_100000685547 [0,2,0,0,0,0|2,0,0]=4 29270 B18R2.65882 Fc1cccc(c1)SCCc2ccccc2F 62a_100000685547_100011713696 [0,2,0,0,0,0|2,0,0]=4 29271 B18R2.65882 Fc1cccc(c1)SCCc2ccccc2F 62a_100011713696_100000685547 [0,2,0,0,0,0|2,0,0]=4 29272 B18R2.65882 Fc1cccc(n1)CNCc2ccccc2Br 2230a_100000689332_100009819644 [0,2,0,0,0,0|2,0,0]=4 29273 B18R2.65882 Fc1cccc(n1)CNCc2ccccc2Br 2230a_100015188798_100000184730 [0,2,0,0,0,0|2,0,0]=4 29274 B18R2.65882 Fc1cccc(n1)CNCc2ccccc2Br 270004a_100000689332_100000050434 [0,2,0,0,0,0|2,0,0]=4 29275 B18R2.65882 Fc1cccc(n1)CNCc2ccccc2Br 34a_100000689332_100009819644 [0,2,0,0,0,0|2,0,0]=4 29276 B18R2.65882 Fc1cccc(n1)CNCc2ccccc2Br 34a_100015188798_100000184730 [0,2,0,0,0,0|2,0,0]=4 29277 B18R2.65882 Fc1cccc(n1)CNCc2ccccc2Cl 2230a_100000174879_100009819644 [0,2,0,0,0,0|2,0,0]=4 29278 B18R2.65882 Fc1cccc(n1)CNCc2ccccc2Cl 2230a_100015188798_100000187162 [0,2,0,0,0,0|2,0,0]=4 29279 B18R2.65882 Fc1cccc(n1)CNCc2ccccc2Cl 270004a_100000174879_100000050434 [0,2,0,0,0,0|2,0,0]=4 29280 B18R2.65882 Fc1cccc(n1)CNCc2ccccc2Cl 34a_100000174879_100009819644 [0,2,0,0,0,0|2,0,0]=4 29281 B18R2.65882 Fc1cccc(n1)CNCc2ccccc2Cl 34a_100015188798_100000187162 [0,2,0,0,0,0|2,0,0]=4 29282 B18R2.65882 Fc1cccc(n1)CNCc2ccccc2F 2230a_100015188798_100000211605 [0,2,0,0,0,0|2,0,0]=4 29283 B18R2.65882 Fc1cccc(n1)CNCc2ccccc2F 270004a_100000174869_100000050434 [0,2,0,0,0,0|2,0,0]=4 29284 B18R2.65882 Fc1cccc(n1)CNCc2ccccc2F 34a_100000174869_100009819644 [0,2,0,0,0,0|2,0,0]=4 29285 B18R2.65882 Fc1cccc(n1)CNCc2ccccc2F 34a_100015188798_100000211605 [0,2,0,0,0,0|2,0,0]=4 29286 B18R2.65882 Fc1cccc(n1)CNCc2ccccc2I 2230a_100015188798_100011215278 [0,2,0,0,0,0|2,0,0]=4 29287 B18R2.65882 Fc1cccc(n1)CNCc2ccccc2I 270004a_100015347259_100000050434 [0,2,0,0,0,0|2,0,0]=4 29288 B18R2.65882 Fc1cccc(n1)CNCc2ccccc2I 34a_100015188798_100011215278 [0,2,0,0,0,0|2,0,0]=4 29289 B18R2.65882 Fc1cccc(n1)COCc2ccccc2Br 34a_100000086748_100000184730 [0,2,0,0,0,0|1,0,0]=3 29290 B18R2.65882 Fc1cccc(n1)COCc2ccccc2Br 34a_100000756307_100009819644 [0,2,0,0,0,0|1,0,0]=3 29291 B18R2.65882 Fc1cccc(n1)COCc2ccccc2Br 7a_100000756307_100009819644 [0,2,0,0,0,0|1,0,0]=3 29292 B18R2.65882 Fc1cccc(n1)COCc2ccccc2Cl 34a_100000086748_100000187162 [0,2,0,0,0,0|1,0,0]=3 29293 B18R2.65882 Fc1cccc(n1)COCc2ccccc2Cl 34a_100000210847_100009819644 [0,2,0,0,0,0|1,0,0]=3 29294 B18R2.65882 Fc1cccc(n1)COCc2ccccc2Cl 7a_100000210847_100009819644 [0,2,0,0,0,0|1,0,0]=3 29295 B18R2.65882 Fc1cccc(n1)COCc2ccccc2F 34a_100000086748_100000211605 [0,2,0,0,0,0|1,0,0]=3 29296 B18R2.65882 Fc1cccc(n1)COCc2ccccc2F 34a_100000211962_100009819644 [0,2,0,0,0,0|1,0,0]=3 29297 B18R2.65882 Fc1cccc(n1)COCc2ccccc2F 7a_100000211962_100009819644 [0,2,0,0,0,0|1,0,0]=3 29298 B18R2.65882 Fc1cccc(n1)COCc2ccccc2I 34a_100000086748_100011215278 [0,2,0,0,0,0|1,0,0]=3 29299 B18R2.65882 Fc1cccc(n1)COCc2ccccc2I 34a_100000187465_100009819644 [0,2,0,0,0,0|1,0,0]=3 29300 B18R2.65882 Fc1cccc(n1)COCc2ccccc2I 7a_100000187465_100009819644 [0,2,0,0,0,0|1,0,0]=3 29301 B18R2.65882 Fc1cccc(n1)COCc2cccnc2Br 34a_100000086748_100010140945 [0,2,0,0,0,0|2,0,0]=4 29302 B18R2.65882 Fc1cccc(n1)COCc2cccnc2Br 34a_100000719692_100009819644 [0,2,0,0,0,0|2,0,0]=4 29303 B18R2.65882 Fc1cccc(n1)COCc2cccnc2Br 7a_100000719692_100009819644 [0,2,0,0,0,0|2,0,0]=4 29304 B18R2.65882 Fc1cccc(n1)COCc2cccnc2Cl 34a_100000086748_100000045678 [0,2,0,0,0,0|2,0,0]=4 29305 B18R2.65882 Fc1cccc(n1)COCc2cccnc2Cl 34a_100000748726_100009819644 [0,2,0,0,0,0|2,0,0]=4 29306 B18R2.65882 Fc1cccc(n1)COCc2cccnc2Cl 7a_100000748726_100009819644 [0,2,0,0,0,0|2,0,0]=4 29307 B18R2.65882 Fc1cccc(n1)COCc2cccnc2F 34a_100000079888_100009819644 [0,2,0,0,0,0|2,0,0]=4 29308 B18R2.65882 Fc1cccc(n1)COCc2cccnc2F 34a_100000086748_100000099810 [0,2,0,0,0,0|2,0,0]=4 29309 B18R2.65882 Fc1cccc(n1)COCc2cccnc2F 7a_100000079888_100009819644 [0,2,0,0,0,0|2,0,0]=4 29310 B18R2.65882 Fc1cccc(n1)COCc2ccncc2F 34a_100012172863_100009819644 [0,2,0,0,0,0|2,0,0]=4 29311 B18R2.65882 Fc1cccc(n1)COCc2cnccc2Cl 34a_100000117392_100009819644 [0,2,0,0,0,0|2,0,0]=4 29312 B18R2.65882 Fc1cccc(n1)COCc2ncccc2Br 34a_100000086748_100025702911 [0,2,0,0,0,0|2,0,0]=4 29313 B18R2.65882 Fc1cccc(n1)COCc2ncccc2Br 34a_100011996772_100009819644 [0,2,0,0,0,0|2,0,0]=4 29314 B18R2.65882 Fc1cccc(n1)COCc2ncccc2Cl 34a_100012002383_100009819644 [0,2,0,0,0,0|2,0,0]=4 29315 B18R2.65882 Fc1cccc(n1)COCc2ncccc2F 34a_100000086748_100000104219 [0,2,0,0,0,0|2,0,0]=4 29316 B18R2.65882 Fc1cccc(n1)COCc2ncccc2F 34a_100011934865_100009819644 [0,2,0,0,0,0|2,0,0]=4 29317 B18R2.65882 Fc1cccc(n1)CSCc2ccccc2Br 62a_100000184730_100009819644 [0,2,0,0,0,0|1,1,0]=4 29318 B18R2.65882 Fc1cccc(n1)CSCc2ccccc2Br 62a_100009819644_100000184730 [0,2,0,0,0,0|1,1,0]=4 29319 B18R2.65882 Fc1cccc(n1)CSCc2ccccc2Cl 62a_100000187162_100009819644 [0,2,0,0,0,0|1,1,0]=4 29320 B18R2.65882 Fc1cccc(n1)CSCc2ccccc2Cl 62a_100009819644_100000187162 [0,2,0,0,0,0|1,1,0]=4 29321 B18R2.65882 Fc1cccc(n1)CSCc2ccccc2F 62a_100000211605_100009819644 [0,2,0,0,0,0|1,1,0]=4 29322 B18R2.65882 Fc1cccc(n1)CSCc2ccccc2F 62a_100009819644_100000211605 [0,2,0,0,0,0|1,1,0]=4 29323 B18R2.65882 Fc1cccc(n1)CSCc2ccccc2I 62a_100009819644_100011216222 [0,2,0,0,0,0|1,1,0]=4 29324 B18R2.65882 Fc1cccc(n1)CSCc2ccccc2I 62a_100011216222_100009819644 [0,2,0,0,0,0|1,1,0]=4 29325 B18R2.65882 Fc1ccccc1CCNc2cccc(c2)Br 34a_100000210019_100000720011 [0,2,0,0,0,0|2,0,0]=4 29326 B18R2.65882 Fc1ccccc1CCNc2cccc(c2)Cl 34a_100000185859_100000720011 [0,2,0,0,0,0|2,0,0]=4 29327 B18R2.65882 Fc1ccccc1CCNc2cccc(c2)I 34a_100000211102_100000720011 [0,2,0,0,0,0|2,0,0]=4 29328 B18R2.65882 Fc1ccccc1CCOc2cccc(c2)Br 34a_100000210342_100000720011 [0,2,0,0,0,0|2,0,0]=4 29329 B18R2.65882 Fc1ccccc1CCOc2cccc(c2)Br 7a_100000210342_100000720011 [0,2,0,0,0,0|2,0,0]=4 29330 B18R2.65882 Fc1ccccc1CCOc2cccc(c2)Cl 34a_100000210295_100000720011 [0,2,0,0,0,0|2,0,0]=4 29331 B18R2.65882 Fc1ccccc1CCOc2cccc(c2)Cl 7a_100000210295_100000720011 [0,2,0,0,0,0|2,0,0]=4 29332 B18R2.65882 Fc1ccccc1CCOc2cccc(c2)I 34a_100000211634_100000720011 [0,2,0,0,0,0|2,0,0]=4 29333 B18R2.65882 Fc1ccccc1CCOc2cccc(c2)I 7a_100000211634_100000720011 [0,2,0,0,0,0|2,0,0]=4 29334 B18R2.65882 Fc1ccccc1CCSc2cccc(c2)Br 62a_100000691529_100011713696 [0,2,0,0,0,0|2,0,0]=4 29335 B18R2.65882 Fc1ccccc1CCSc2cccc(c2)Br 62a_100011713696_100000691529 [0,2,0,0,0,0|2,0,0]=4 29336 B18R2.65882 Fc1ccccc1CCSc2cccc(c2)Cl 62a_100000699651_100011713696 [0,2,0,0,0,0|2,0,0]=4 29337 B18R2.65882 Fc1ccccc1CCSc2cccc(c2)Cl 62a_100011713696_100000699651 [0,2,0,0,0,0|2,0,0]=4 29338 B18R2.65882 Fc1ccccc1CCSc2cccc(c2)[S] 62a_100011713696_114929384022 [0,2,0,0,0,0|2,0,0]=4 29339 B18R2.65882 Fc1ccccc1CCSc2cccc(c2)[S] 62a_114929384022_100011713696 [0,2,0,0,0,0|2,0,0]=4 29340 B18R2.65882 Fc1ccccc1CNCc2cc(ccn2)Br 270004a_100000174869_100009818557 [0,2,0,0,0,0|2,0,0]=4 29341 B18R2.65882 Fc1ccccc1CNCc2cc(ccn2)Br 34a_100000174869_100010173614 [0,2,0,0,0,0|2,0,0]=4 29342 B18R2.65882 Fc1ccccc1CNCc2cc(ccn2)Cl 270004a_100000174869_100011998288 [0,2,0,0,0,0|2,0,0]=4 29343 B18R2.65882 Fc1ccccc1CNCc2cc(ccn2)Cl 34a_100000174869_100016988179 [0,2,0,0,0,0|2,0,0]=4 29344 B18R2.65882 Fc1ccccc1CNCc2cccc(c2)Br 207a_100000174869_100000210085 [0,2,0,0,0,0|1,0,0]=3 29345 B18R2.65882 Fc1ccccc1CNCc2cccc(c2)Br 207a_100000174977_100000210811 [0,2,0,0,0,0|1,0,0]=3 29346 B18R2.65882 Fc1ccccc1CNCc2cccc(c2)Br 2230a_100000174977_100000211605 [0,2,0,0,0,0|1,0,0]=3 29347 B18R2.65882 Fc1ccccc1CNCc2cccc(c2)Br 270004a_100000174869_100000210085 [0,2,0,0,0,0|1,0,0]=3 29348 B18R2.65882 Fc1ccccc1CNCc2cccc(c2)Br 270004a_100000174977_100000210811 [0,2,0,0,0,0|1,0,0]=3 29349 B18R2.65882 Fc1ccccc1CNCc2cccc(c2)Br 34a_100000174869_100000698116 [0,2,0,0,0,0|1,0,0]=3 29350 B18R2.65882 Fc1ccccc1CNCc2cccc(c2)Br 34a_100000174977_100000211605 [0,2,0,0,0,0|1,0,0]=3 29351 B18R2.65882 Fc1ccccc1CNCc2cccc(c2)Cl 207a_100000174869_100000210801 [0,2,0,0,0,0|1,0,0]=3 29352 B18R2.65882 Fc1ccccc1CNCc2cccc(c2)Cl 207a_100000174878_100000210811 [0,2,0,0,0,0|1,0,0]=3 29353 B18R2.65882 Fc1ccccc1CNCc2cccc(c2)Cl 2230a_100000174878_100000211605 [0,2,0,0,0,0|1,0,0]=3 29354 B18R2.65882 Fc1ccccc1CNCc2cccc(c2)Cl 270004a_100000174869_100000210801 [0,2,0,0,0,0|1,0,0]=3 29355 B18R2.65882 Fc1ccccc1CNCc2cccc(c2)Cl 270004a_100000174878_100000210811 [0,2,0,0,0,0|1,0,0]=3 29356 B18R2.65882 Fc1ccccc1CNCc2cccc(c2)Cl 34a_100000174869_100000187163 [0,2,0,0,0,0|1,0,0]=3 29357 B18R2.65882 Fc1ccccc1CNCc2cccc(c2)Cl 34a_100000174878_100000211605 [0,2,0,0,0,0|1,0,0]=3 29358 B18R2.65882 Fc1ccccc1CNCc2cccc(c2)I 207a_100000106179_100000210811 [0,2,0,0,0,0|1,0,0]=3 29359 B18R2.65882 Fc1ccccc1CNCc2cccc(c2)I 207a_100000174869_100000014684 [0,2,0,0,0,0|1,0,0]=3 29360 B18R2.65882 Fc1ccccc1CNCc2cccc(c2)I 2230a_100000106179_100000211605 [0,2,0,0,0,0|1,0,0]=3 29361 B18R2.65882 Fc1ccccc1CNCc2cccc(c2)I 270004a_100000106179_100000210811 [0,2,0,0,0,0|1,0,0]=3 29362 B18R2.65882 Fc1ccccc1CNCc2cccc(c2)I 270004a_100000174869_100000014684 [0,2,0,0,0,0|1,0,0]=3 29363 B18R2.65882 Fc1ccccc1CNCc2cccc(c2)I 34a_100000106179_100000211605 [0,2,0,0,0,0|1,0,0]=3 29364 B18R2.65882 Fc1ccccc1CNCc2cccc(c2)I 34a_100000174869_100011218688 [0,2,0,0,0,0|1,0,0]=3 29365 B18R2.65882 Fc1ccccc1CNCc2cccc(n2)Br 2230a_100016987751_100000211605 [0,2,0,0,0,0|2,0,0]=4 29366 B18R2.65882 Fc1ccccc1CNCc2cccc(n2)Br 270004a_100000174869_100000688028 [0,2,0,0,0,0|2,0,0]=4 29367 B18R2.65882 Fc1ccccc1CNCc2cccc(n2)Br 34a_100000174869_100009889011 [0,2,0,0,0,0|2,0,0]=4 29368 B18R2.65882 Fc1ccccc1CNCc2cccc(n2)Cl 2230a_100016990191_100000211605 [0,2,0,0,0,0|2,0,0]=4 29369 B18R2.65882 Fc1ccccc1CNCc2cccc(n2)Cl 270004a_100000174869_100011361687 [0,2,0,0,0,0|2,0,0]=4 29370 B18R2.65882 Fc1ccccc1CNCc2cccc(n2)Cl 34a_100000174869_100000086093 [0,2,0,0,0,0|2,0,0]=4 29371 B18R2.65882 Fc1ccccc1CNCc2ccnc(c2)Br 2230a_100025757509_100000211605 [0,2,0,0,0,0|2,0,0]=4 29372 B18R2.65882 Fc1ccccc1CNCc2ccnc(c2)Br 270004a_100000174869_100009814634 [0,2,0,0,0,0|2,0,0]=4 29373 B18R2.65882 Fc1ccccc1CNCc2ccnc(c2)Br 270004a_100025757509_100000210811 [0,2,0,0,0,0|2,0,0]=4 29374 B18R2.65882 Fc1ccccc1CNCc2ccnc(c2)Br 34a_100000174869_100010243470 [0,2,0,0,0,0|2,0,0]=4 29375 B18R2.65882 Fc1ccccc1CNCc2ccnc(c2)Br 34a_100025757509_100000211605 [0,2,0,0,0,0|2,0,0]=4 29376 B18R2.65882 Fc1ccccc1CNCc2ccnc(c2)Cl 2230a_100015205668_100000211605 [0,2,0,0,0,0|2,0,0]=4 29377 B18R2.65882 Fc1ccccc1CNCc2ccnc(c2)Cl 270004a_100000174869_100011290808 [0,2,0,0,0,0|2,0,0]=4 29378 B18R2.65882 Fc1ccccc1CNCc2ccnc(c2)Cl 270004a_100015205668_100000210811 [0,2,0,0,0,0|2,0,0]=4 29379 B18R2.65882 Fc1ccccc1CNCc2ccnc(c2)Cl 34a_100000174869_100000764220 [0,2,0,0,0,0|2,0,0]=4 29380 B18R2.65882 Fc1ccccc1CNCc2ccnc(c2)Cl 34a_100015205668_100000211605 [0,2,0,0,0,0|2,0,0]=4 29381 B18R2.65882 Fc1ccccc1CNCc2cncc(c2)Br 207a_100000174869_100000687066 [0,2,0,0,0,0|2,0,0]=4 29382 B18R2.65882 Fc1ccccc1CNCc2cncc(c2)Br 207a_100011249555_100000210811 [0,2,0,0,0,0|2,0,0]=4 29383 B18R2.65882 Fc1ccccc1CNCc2cncc(c2)Br 270004a_100000174869_100000687066 [0,2,0,0,0,0|2,0,0]=4 29384 B18R2.65882 Fc1ccccc1CNCc2cncc(c2)Br 270004a_100011249555_100000210811 [0,2,0,0,0,0|2,0,0]=4 29385 B18R2.65882 Fc1ccccc1CNCc2cncc(c2)Br 34a_100000174869_100000738771 [0,2,0,0,0,0|2,0,0]=4 29386 B18R2.65882 Fc1ccccc1CNCc2cncc(c2)Cl 207a_100000174869_100000088910 [0,2,0,0,0,0|2,0,0]=4 29387 B18R2.65882 Fc1ccccc1CNCc2cncc(c2)Cl 207a_200020614424_100000210811 [0,2,0,0,0,0|2,0,0]=4 29388 B18R2.65882 Fc1ccccc1CNCc2cncc(c2)Cl 2230a_200020614424_100000211605 [0,2,0,0,0,0|2,0,0]=4 29389 B18R2.65882 Fc1ccccc1CNCc2cncc(c2)Cl 270004a_100000174869_100000088910 [0,2,0,0,0,0|2,0,0]=4 29390 B18R2.65882 Fc1ccccc1CNCc2cncc(c2)Cl 270004a_200020614424_100000210811 [0,2,0,0,0,0|2,0,0]=4 29391 B18R2.65882 Fc1ccccc1CNCc2cncc(c2)Cl 34a_100000174869_100016992070 [0,2,0,0,0,0|2,0,0]=4 29392 B18R2.65882 Fc1ccccc1COCc2cc(ccn2)Br 34a_100000211962_100010173614 [0,2,0,0,0,0|1,0,0]=3 29393 B18R2.65882 Fc1ccccc1COCc2cc(ccn2)Br 7a_100000211962_100010173614 [0,2,0,0,0,0|1,0,0]=3 29394 B18R2.65882 Fc1ccccc1COCc2cc(ccn2)Cl 34a_100000211962_100016988179 [0,2,0,0,0,0|1,0,0]=3 29395 B18R2.65882 Fc1ccccc1COCc2cc(ccn2)Cl 34a_100000748867_100000211605 [0,2,0,0,0,0|1,0,0]=3 29396 B18R2.65882 Fc1ccccc1COCc2cc(ccn2)Cl 7a_100000211962_100016988179 [0,2,0,0,0,0|1,0,0]=3 29397 B18R2.65882 Fc1ccccc1COCc2cccc(c2)Br 34a_100000211962_100000698116 [0,2,0,0,0,0|0,0,0]=2 29398 B18R2.65882 Fc1ccccc1COCc2cccc(c2)Br 34a_100000687537_100000211605 [0,2,0,0,0,0|0,0,0]=2 29399 B18R2.65882 Fc1ccccc1COCc2cccc(c2)Br 7a_100000211962_100000211773 [0,2,0,0,0,0|0,0,0]=2 29400 B18R2.65882 Fc1ccccc1COCc2cccc(c2)Br 7a_100000687537_100000211605 [0,2,0,0,0,0|0,0,0]=2 29401 B18R2.65882 Fc1ccccc1COCc2cccc(c2)Cl 34a_100000211962_100000187163 [0,2,0,0,0,0|0,0,0]=2 29402 B18R2.65882 Fc1ccccc1COCc2cccc(c2)Cl 34a_100000241301_100000211605 [0,2,0,0,0,0|0,0,0]=2 29403 B18R2.65882 Fc1ccccc1COCc2cccc(c2)Cl 7a_100000211962_100000187163 [0,2,0,0,0,0|0,0,0]=2 29404 B18R2.65882 Fc1ccccc1COCc2cccc(c2)Cl 7a_100000241301_100000211605 [0,2,0,0,0,0|0,0,0]=2 29405 B18R2.65882 Fc1ccccc1COCc2cccc(c2)I 34a_100000211962_100011218688 [0,2,0,0,0,0|0,0,0]=2 29406 B18R2.65882 Fc1ccccc1COCc2cccc(c2)I 34a_100011215336_100000211605 [0,2,0,0,0,0|0,0,0]=2 29407 B18R2.65882 Fc1ccccc1COCc2cccc(c2)I 7a_100000211962_100011218688 [0,2,0,0,0,0|0,0,0]=2 29408 B18R2.65882 Fc1ccccc1COCc2cccc(c2)I 7a_100011215336_100000211605 [0,2,0,0,0,0|0,0,0]=2 29409 B18R2.65882 Fc1ccccc1COCc2cccc(n2)Br 34a_100000211962_100009889011 [0,2,0,0,0,0|1,0,0]=3 29410 B18R2.65882 Fc1ccccc1COCc2cccc(n2)Br 34a_100000694195_100000211605 [0,2,0,0,0,0|1,0,0]=3 29411 B18R2.65882 Fc1ccccc1COCc2cccc(n2)Br 7a_100000211962_100009889011 [0,2,0,0,0,0|1,0,0]=3 29412 B18R2.65882 Fc1ccccc1COCc2cccc(n2)Cl 34a_100000211962_100000086093 [0,2,0,0,0,0|1,0,0]=3 29413 B18R2.65882 Fc1ccccc1COCc2cccc(n2)Cl 34a_100011998359_100000211605 [0,2,0,0,0,0|1,0,0]=3 29414 B18R2.65882 Fc1ccccc1COCc2cccc(n2)Cl 7a_100000211962_100000086093 [0,2,0,0,0,0|1,0,0]=3 29415 B18R2.65882 Fc1ccccc1COCc2ccnc(c2)Br 34a_100000211962_100010243470 [0,2,0,0,0,0|1,0,0]=3 29416 B18R2.65882 Fc1ccccc1COCc2ccnc(c2)Br 34a_100009814636_100000211605 [0,2,0,0,0,0|1,0,0]=3 29417 B18R2.65882 Fc1ccccc1COCc2ccnc(c2)Br 7a_100000211962_100010254460 [0,2,0,0,0,0|1,0,0]=3 29418 B18R2.65882 Fc1ccccc1COCc2ccnc(c2)Br 7a_100009814636_100000211605 [0,2,0,0,0,0|1,0,0]=3 29419 B18R2.65882 Fc1ccccc1COCc2ccnc(c2)Cl 34a_100000211962_100000764220 [0,2,0,0,0,0|1,0,0]=3 29420 B18R2.65882 Fc1ccccc1COCc2ccnc(c2)Cl 34a_100000748751_100000211605 [0,2,0,0,0,0|1,0,0]=3 29421 B18R2.65882 Fc1ccccc1COCc2ccnc(c2)Cl 7a_100000211962_100000764220 [0,2,0,0,0,0|1,0,0]=3 29422 B18R2.65882 Fc1ccccc1COCc2ccnc(n2)Cl 34a_100000211962_100000099655 [0,2,0,0,0,0|2,0,0]=4 29423 B18R2.65882 Fc1ccccc1COCc2ccnc(n2)Cl 7a_100000211962_100000099655 [0,2,0,0,0,0|2,0,0]=4 29424 B18R2.65882 Fc1ccccc1COCc2cncc(c2)Br 34a_100000211962_100000738771 [0,2,0,0,0,0|1,0,0]=3 29425 B18R2.65882 Fc1ccccc1COCc2cncc(c2)Br 34a_100011259137_100000211605 [0,2,0,0,0,0|1,0,0]=3 29426 B18R2.65882 Fc1ccccc1COCc2cncc(c2)Br 7a_100000211962_100000738771 [0,2,0,0,0,0|1,0,0]=3 29427 B18R2.65882 Fc1ccccc1COCc2cncc(c2)Br 7a_100011259137_100000211605 [0,2,0,0,0,0|1,0,0]=3 29428 B18R2.65882 Fc1ccccc1COCc2cncc(c2)Cl 34a_100000092867_100000211605 [0,2,0,0,0,0|1,0,0]=3 29429 B18R2.65882 Fc1ccccc1COCc2cncc(c2)Cl 34a_100000211962_100016992070 [0,2,0,0,0,0|1,0,0]=3 29430 B18R2.65882 Fc1ccccc1COCc2cncc(c2)Cl 7a_100000092867_100000211605 [0,2,0,0,0,0|1,0,0]=3 29431 B18R2.65882 Fc1ccccc1COCc2cncc(c2)Cl 7a_100000211962_100016992070 [0,2,0,0,0,0|1,0,0]=3 29432 B18R2.65882 Fc1ccccc1CSCc2cc(ccn2)Br 62a_100000211605_100010173614 [0,2,0,0,0,0|1,1,0]=4 29433 B18R2.65882 Fc1ccccc1CSCc2cc(ccn2)Br 62a_100010173614_100000211605 [0,2,0,0,0,0|1,1,0]=4 29434 B18R2.65882 Fc1ccccc1CSCc2cc(ccn2)Cl 62a_100000211605_100016988179 [0,2,0,0,0,0|1,1,0]=4 29435 B18R2.65882 Fc1ccccc1CSCc2cc(ccn2)Cl 62a_100016988179_100000211605 [0,2,0,0,0,0|1,1,0]=4 29436 B18R2.65882 Fc1ccccc1CSCc2cccc(c2)Br 62a_100000211605_100000211773 [0,2,0,0,0,0|0,1,0]=3 29437 B18R2.65882 Fc1ccccc1CSCc2cccc(c2)Br 62a_100000211773_100000211605 [0,2,0,0,0,0|0,1,0]=3 29438 B18R2.65882 Fc1ccccc1CSCc2cccc(c2)Cl 62a_100000187163_100000211605 [0,2,0,0,0,0|0,1,0]=3 29439 B18R2.65882 Fc1ccccc1CSCc2cccc(c2)Cl 62a_100000211605_100000187163 [0,2,0,0,0,0|0,1,0]=3 29440 B18R2.65882 Fc1ccccc1CSCc2cccc(c2)I 62a_100000211605_100011218688 [0,2,0,0,0,0|0,1,0]=3 29441 B18R2.65882 Fc1ccccc1CSCc2cccc(c2)I 62a_100011218688_100000211605 [0,2,0,0,0,0|0,1,0]=3 29442 B18R2.65882 Fc1ccccc1CSCc2cccc(n2)Br 62a_100000211605_100009889011 [0,2,0,0,0,0|1,1,0]=4 29443 B18R2.65882 Fc1ccccc1CSCc2cccc(n2)Br 62a_100009889011_100000211605 [0,2,0,0,0,0|1,1,0]=4 29444 B18R2.65882 Fc1ccccc1CSCc2cccc(n2)Cl 62a_100000086093_100000211605 [0,2,0,0,0,0|1,1,0]=4 29445 B18R2.65882 Fc1ccccc1CSCc2cccc(n2)Cl 62a_100000211605_100000086093 [0,2,0,0,0,0|1,1,0]=4 29446 B18R2.65882 Fc1ccccc1CSCc2ccnc(c2)Br 62a_100000211605_100010243470 [0,2,0,0,0,0|1,1,0]=4 29447 B18R2.65882 Fc1ccccc1CSCc2ccnc(c2)Br 62a_100010254460_100000211605 [0,2,0,0,0,0|1,1,0]=4 29448 B18R2.65882 Fc1ccccc1CSCc2ccnc(c2)Cl 62a_100000211605_100000764220 [0,2,0,0,0,0|1,1,0]=4 29449 B18R2.65882 Fc1ccccc1CSCc2ccnc(c2)Cl 62a_100000764220_100000211605 [0,2,0,0,0,0|1,1,0]=4 29450 B18R2.65882 Fc1ccccc1CSCc2cncc(c2)Br 62a_100000211605_100000738771 [0,2,0,0,0,0|1,1,0]=4 29451 B18R2.65882 Fc1ccccc1CSCc2cncc(c2)Br 62a_100000738771_100000211605 [0,2,0,0,0,0|1,1,0]=4 29452 B18R2.65882 Fc1ccccc1CSCc2cncc(c2)Cl 62a_100000211605_100016992070 [0,2,0,0,0,0|1,1,0]=4 29453 B18R2.65882 Fc1ccccc1CSCc2cncc(c2)Cl 62a_100016992070_100000211605 [0,2,0,0,0,0|1,1,0]=4 29454 B18R2.65882 Fc1ccccc1NCCc2cccc(c2)Br 34a_100000210422_100011740638 [0,2,0,0,0,0|2,0,0]=4 29455 B18R2.65882 Fc1ccccc1NCCc2cccc(c2)Cl 34a_100000210422_100011713710 [0,2,0,0,0,0|2,0,0]=4 29456 B18R2.65882 Fc1ccccc1OCCc2cccc(c2)Br 34a_100000210171_100011740638 [0,2,0,0,0,0|2,0,0]=4 29457 B18R2.65882 Fc1ccccc1OCCc2cccc(c2)Br 7a_100000210171_100011740638 [0,2,0,0,0,0|2,0,0]=4 29458 B18R2.65882 Fc1ccccc1OCCc2cccc(c2)Cl 34a_100000210171_100011713710 [0,2,0,0,0,0|2,0,0]=4 29459 B18R2.65882 Fc1ccccc1OCCc2cccc(c2)Cl 7a_100000210171_100011713710 [0,2,0,0,0,0|2,0,0]=4 29460 B18R2.65882 Fc1ccccc1SCCc2cccc(c2)Br 62a_100011215700_100011740638 [0,2,0,0,0,0|2,0,0]=4 29461 B18R2.65882 Fc1ccccc1SCCc2cccc(c2)Br 62a_100011740638_100011215700 [0,2,0,0,0,0|2,0,0]=4 29462 B18R2.65882 Fc1ccccc1SCCc2cccc(c2)Cl 62a_100011215700_100011713710 [0,2,0,0,0,0|2,0,0]=4 29463 B18R2.65882 Fc1ccccc1SCCc2cccc(c2)Cl 62a_100011713710_100011215700 [0,2,0,0,0,0|2,0,0]=4 29464 B18R2.65882 Fc1cccnc1CNCc2cccc(c2)Br 207a_100000174977_100011934734 [0,2,0,0,0,0|2,0,0]=4 29465 B18R2.65882 Fc1cccnc1CNCc2cccc(c2)Br 2230a_100000174977_100000104219 [0,2,0,0,0,0|2,0,0]=4 29466 B18R2.65882 Fc1cccnc1CNCc2cccc(c2)Br 270004a_100000174977_100011934734 [0,2,0,0,0,0|2,0,0]=4 29467 B18R2.65882 Fc1cccnc1CNCc2cccc(c2)Br 270004a_100000690088_100000210085 [0,2,0,0,0,0|2,0,0]=4 29468 B18R2.65882 Fc1cccnc1CNCc2cccc(c2)Br 34a_100000174977_100000104219 [0,2,0,0,0,0|2,0,0]=4 29469 B18R2.65882 Fc1cccnc1CNCc2cccc(c2)Br 34a_100000690088_100000698116 [0,2,0,0,0,0|2,0,0]=4 29470 B18R2.65882 Fc1cccnc1CNCc2cccc(c2)Cl 207a_100000174878_100011934734 [0,2,0,0,0,0|2,0,0]=4 29471 B18R2.65882 Fc1cccnc1CNCc2cccc(c2)Cl 2230a_100000174878_100000104219 [0,2,0,0,0,0|2,0,0]=4 29472 B18R2.65882 Fc1cccnc1CNCc2cccc(c2)Cl 270004a_100000174878_100011934734 [0,2,0,0,0,0|2,0,0]=4 29473 B18R2.65882 Fc1cccnc1CNCc2cccc(c2)Cl 270004a_100000690088_100000210801 [0,2,0,0,0,0|2,0,0]=4 29474 B18R2.65882 Fc1cccnc1CNCc2cccc(c2)Cl 34a_100000174878_100000104219 [0,2,0,0,0,0|2,0,0]=4 29475 B18R2.65882 Fc1cccnc1CNCc2cccc(c2)Cl 34a_100000690088_100000187163 [0,2,0,0,0,0|2,0,0]=4 29476 B18R2.65882 Fc1cccnc1CNCc2cccc(c2)I 207a_100000106179_100011934734 [0,2,0,0,0,0|2,0,0]=4 29477 B18R2.65882 Fc1cccnc1CNCc2cccc(c2)I 2230a_100000106179_100000104219 [0,2,0,0,0,0|2,0,0]=4 29478 B18R2.65882 Fc1cccnc1CNCc2cccc(c2)I 270004a_100000106179_100011934734 [0,2,0,0,0,0|2,0,0]=4 29479 B18R2.65882 Fc1cccnc1CNCc2cccc(c2)I 270004a_100000690088_100000014684 [0,2,0,0,0,0|2,0,0]=4 29480 B18R2.65882 Fc1cccnc1CNCc2cccc(c2)I 34a_100000106179_100000104219 [0,2,0,0,0,0|2,0,0]=4 29481 B18R2.65882 Fc1cccnc1CNCc2cccc(c2)I 34a_100000690088_100011218688 [0,2,0,0,0,0|2,0,0]=4 29482 B18R2.65882 Fc1cccnc1COCc2cc(ccn2)Br 34a_100011934865_100010173614 [0,2,0,0,0,0|2,0,0]=4 29483 B18R2.65882 Fc1cccnc1COCc2cc(ccn2)Cl 34a_100000748867_100000104219 [0,2,0,0,0,0|2,0,0]=4 29484 B18R2.65882 Fc1cccnc1COCc2cc(ccn2)Cl 34a_100011934865_100016988179 [0,2,0,0,0,0|2,0,0]=4 29485 B18R2.65882 Fc1cccnc1COCc2cccc(c2)Br 34a_100000687537_100000104219 [0,2,0,0,0,0|1,0,0]=3 29486 B18R2.65882 Fc1cccnc1COCc2cccc(c2)Br 34a_100011934865_100000698116 [0,2,0,0,0,0|1,0,0]=3 29487 B18R2.65882 Fc1cccnc1COCc2cccc(c2)Br 7a_100000687537_100000104219 [0,2,0,0,0,0|1,0,0]=3 29488 B18R2.65882 Fc1cccnc1COCc2cccc(c2)Cl 34a_100000241301_100000104219 [0,2,0,0,0,0|1,0,0]=3 29489 B18R2.65882 Fc1cccnc1COCc2cccc(c2)Cl 34a_100011934865_100000187163 [0,2,0,0,0,0|1,0,0]=3 29490 B18R2.65882 Fc1cccnc1COCc2cccc(c2)Cl 7a_100000241301_100000104219 [0,2,0,0,0,0|1,0,0]=3 29491 B18R2.65882 Fc1cccnc1COCc2cccc(c2)I 34a_100011215336_100000104219 [0,2,0,0,0,0|1,0,0]=3 29492 B18R2.65882 Fc1cccnc1COCc2cccc(c2)I 34a_100011934865_100011218688 [0,2,0,0,0,0|1,0,0]=3 29493 B18R2.65882 Fc1cccnc1COCc2cccc(c2)I 7a_100011215336_100000104219 [0,2,0,0,0,0|1,0,0]=3 29494 B18R2.65882 Fc1cccnc1COCc2cccc(n2)Br 34a_100000694195_100000104219 [0,2,0,0,0,0|2,0,0]=4 29495 B18R2.65882 Fc1cccnc1COCc2cccc(n2)Br 34a_100011934865_100009889011 [0,2,0,0,0,0|2,0,0]=4 29496 B18R2.65882 Fc1cccnc1COCc2cccc(n2)Cl 34a_100011934865_100000086093 [0,2,0,0,0,0|2,0,0]=4 29497 B18R2.65882 Fc1cccnc1COCc2cccc(n2)Cl 34a_100011998359_100000104219 [0,2,0,0,0,0|2,0,0]=4 29498 B18R2.65882 Fc1cccnc1COCc2ccnc(c2)Br 34a_100009814636_100000104219 [0,2,0,0,0,0|2,0,0]=4 29499 B18R2.65882 Fc1cccnc1COCc2ccnc(c2)Br 34a_100011934865_100010243470 [0,2,0,0,0,0|2,0,0]=4 29500 B18R2.65882 Fc1cccnc1COCc2ccnc(c2)Br 7a_100009814636_100000104219 [0,2,0,0,0,0|2,0,0]=4 29501 B18R2.65882 Fc1cccnc1COCc2ccnc(c2)Cl 34a_100000748751_100000104219 [0,2,0,0,0,0|2,0,0]=4 29502 B18R2.65882 Fc1cccnc1COCc2ccnc(c2)Cl 34a_100011934865_100000764220 [0,2,0,0,0,0|2,0,0]=4 29503 B18R2.65882 Fc1cccnc1COCc2cncc(c2)Br 34a_100011259137_100000104219 [0,2,0,0,0,0|2,0,0]=4 29504 B18R2.65882 Fc1cccnc1COCc2cncc(c2)Br 34a_100011934865_100000738771 [0,2,0,0,0,0|2,0,0]=4 29505 B18R2.65882 Fc1cccnc1COCc2cncc(c2)Br 7a_100011259137_100000104219 [0,2,0,0,0,0|2,0,0]=4 29506 B18R2.65882 Fc1cccnc1COCc2cncc(c2)Cl 34a_100000092867_100000104219 [0,2,0,0,0,0|2,0,0]=4 29507 B18R2.65882 Fc1cccnc1COCc2cncc(c2)Cl 34a_100011934865_100016992070 [0,2,0,0,0,0|2,0,0]=4 29508 B18R2.65882 Fc1cccnc1COCc2cncc(c2)Cl 7a_100000092867_100000104219 [0,2,0,0,0,0|2,0,0]=4 29509 B18R2.65882 Fc1cccnc1CSCc2cccc(c2)Br 62a_100000104219_100000211773 [0,2,0,0,0,0|1,1,0]=4 29510 B18R2.65882 Fc1cccnc1CSCc2cccc(c2)Br 62a_100000211773_100000104219 [0,2,0,0,0,0|1,1,0]=4 29511 B18R2.65882 Fc1cccnc1CSCc2cccc(c2)Cl 62a_100000104219_100000187163 [0,2,0,0,0,0|1,1,0]=4 29512 B18R2.65882 Fc1cccnc1CSCc2cccc(c2)Cl 62a_100000187163_100000104219 [0,2,0,0,0,0|1,1,0]=4 29513 B18R2.65882 Fc1cccnc1CSCc2cccc(c2)I 62a_100000104219_100011218688 [0,2,0,0,0,0|1,1,0]=4 29514 B18R2.65882 Fc1cccnc1CSCc2cccc(c2)I 62a_100011218688_100000104219 [0,2,0,0,0,0|1,1,0]=4 29515 B18R2.65882 Fc1cncc(c1)CNCc2ccccc2Br 207a_100000689332_100011361476 [0,2,0,0,0,0|2,0,0]=4 29516 B18R2.65882 Fc1cncc(c1)CNCc2ccccc2Br 207a_100011962886_100000211189 [0,2,0,0,0,0|2,0,0]=4 29517 B18R2.65882 Fc1cncc(c1)CNCc2ccccc2Br 2230a_100000689332_100000725299 [0,2,0,0,0,0|2,0,0]=4 29518 B18R2.65882 Fc1cncc(c1)CNCc2ccccc2Br 2230a_100011962886_100000184730 [0,2,0,0,0,0|2,0,0]=4 29519 B18R2.65882 Fc1cncc(c1)CNCc2ccccc2Br 270004a_100000689332_100011361476 [0,2,0,0,0,0|2,0,0]=4 29520 B18R2.65882 Fc1cncc(c1)CNCc2ccccc2Br 270004a_100011962886_100000211189 [0,2,0,0,0,0|2,0,0]=4 29521 B18R2.65882 Fc1cncc(c1)CNCc2ccccc2Br 34a_100000689332_100000725299 [0,2,0,0,0,0|2,0,0]=4 29522 B18R2.65882 Fc1cncc(c1)CNCc2ccccc2Br 34a_100011962886_100000184730 [0,2,0,0,0,0|2,0,0]=4 29523 B18R2.65882 Fc1cncc(c1)CNCc2ccccc2Cl 207a_100000174879_100011361476 [0,2,0,0,0,0|2,0,0]=4 29524 B18R2.65882 Fc1cncc(c1)CNCc2ccccc2Cl 207a_100011962886_100000210073 [0,2,0,0,0,0|2,0,0]=4 29525 B18R2.65882 Fc1cncc(c1)CNCc2ccccc2Cl 2230a_100000174879_100000725299 [0,2,0,0,0,0|2,0,0]=4 29526 B18R2.65882 Fc1cncc(c1)CNCc2ccccc2Cl 2230a_100011962886_100000187162 [0,2,0,0,0,0|2,0,0]=4 29527 B18R2.65882 Fc1cncc(c1)CNCc2ccccc2Cl 270004a_100000174879_100011361476 [0,2,0,0,0,0|2,0,0]=4 29528 B18R2.65882 Fc1cncc(c1)CNCc2ccccc2Cl 270004a_100011962886_100000210073 [0,2,0,0,0,0|2,0,0]=4 29529 B18R2.65882 Fc1cncc(c1)CNCc2ccccc2Cl 34a_100000174879_100000725299 [0,2,0,0,0,0|2,0,0]=4 29530 B18R2.65882 Fc1cncc(c1)CNCc2ccccc2Cl 34a_100011962886_100000187162 [0,2,0,0,0,0|2,0,0]=4 29531 B18R2.65882 Fc1cncc(c1)CNCc2ccccc2F 207a_100000174869_100011361476 [0,2,0,0,0,0|2,0,0]=4 29532 B18R2.65882 Fc1cncc(c1)CNCc2ccccc2F 207a_100011962886_100000210811 [0,2,0,0,0,0|2,0,0]=4 29533 B18R2.65882 Fc1cncc(c1)CNCc2ccccc2F 2230a_100011962886_100000211605 [0,2,0,0,0,0|2,0,0]=4 29534 B18R2.65882 Fc1cncc(c1)CNCc2ccccc2F 270004a_100000174869_100011361476 [0,2,0,0,0,0|2,0,0]=4 29535 B18R2.65882 Fc1cncc(c1)CNCc2ccccc2F 270004a_100011962886_100000210811 [0,2,0,0,0,0|2,0,0]=4 29536 B18R2.65882 Fc1cncc(c1)CNCc2ccccc2F 34a_100000174869_100000725299 [0,2,0,0,0,0|2,0,0]=4 29537 B18R2.65882 Fc1cncc(c1)CNCc2ccccc2F 34a_100011962886_100000211605 [0,2,0,0,0,0|2,0,0]=4 29538 B18R2.65882 Fc1cncc(c1)CNCc2ccccc2I 207a_100011962886_100000010305 [0,2,0,0,0,0|2,0,0]=4 29539 B18R2.65882 Fc1cncc(c1)CNCc2ccccc2I 207a_100015347259_100011361476 [0,2,0,0,0,0|2,0,0]=4 29540 B18R2.65882 Fc1cncc(c1)CNCc2ccccc2I 2230a_100011962886_100011215278 [0,2,0,0,0,0|2,0,0]=4 29541 B18R2.65882 Fc1cncc(c1)CNCc2ccccc2I 270004a_100011962886_100000010305 [0,2,0,0,0,0|2,0,0]=4 29542 B18R2.65882 Fc1cncc(c1)CNCc2ccccc2I 270004a_100015347259_100011361476 [0,2,0,0,0,0|2,0,0]=4 29543 B18R2.65882 Fc1cncc(c1)CNCc2ccccc2I 34a_100011962886_100011215278 [0,2,0,0,0,0|2,0,0]=4 29544 B18R2.65882 Fc1cncc(c1)COCc2ccccc2Br 34a_100000756307_100000725299 [0,2,0,0,0,0|1,0,0]=3 29545 B18R2.65882 Fc1cncc(c1)COCc2ccccc2Br 34a_100011962875_100000184730 [0,2,0,0,0,0|1,0,0]=3 29546 B18R2.65882 Fc1cncc(c1)COCc2ccccc2Br 7a_100000756307_100000725299 [0,2,0,0,0,0|1,0,0]=3 29547 B18R2.65882 Fc1cncc(c1)COCc2ccccc2Br 7a_100011962875_100000184730 [0,2,0,0,0,0|1,0,0]=3 29548 B18R2.65882 Fc1cncc(c1)COCc2ccccc2Cl 34a_100000210847_100000725299 [0,2,0,0,0,0|1,0,0]=3 29549 B18R2.65882 Fc1cncc(c1)COCc2ccccc2Cl 34a_100011962875_100000187162 [0,2,0,0,0,0|1,0,0]=3 29550 B18R2.65882 Fc1cncc(c1)COCc2ccccc2Cl 7a_100000210847_100000725299 [0,2,0,0,0,0|1,0,0]=3 29551 B18R2.65882 Fc1cncc(c1)COCc2ccccc2Cl 7a_100011962875_100000187162 [0,2,0,0,0,0|1,0,0]=3 29552 B18R2.65882 Fc1cncc(c1)COCc2ccccc2F 34a_100000211962_100000725299 [0,2,0,0,0,0|1,0,0]=3 29553 B18R2.65882 Fc1cncc(c1)COCc2ccccc2F 34a_100011962875_100000211605 [0,2,0,0,0,0|1,0,0]=3 29554 B18R2.65882 Fc1cncc(c1)COCc2ccccc2F 7a_100000211962_100000725299 [0,2,0,0,0,0|1,0,0]=3 29555 B18R2.65882 Fc1cncc(c1)COCc2ccccc2F 7a_100011962875_100000211605 [0,2,0,0,0,0|1,0,0]=3 29556 B18R2.65882 Fc1cncc(c1)COCc2ccccc2I 34a_100000187465_100000725299 [0,2,0,0,0,0|1,0,0]=3 29557 B18R2.65882 Fc1cncc(c1)COCc2ccccc2I 34a_100011962875_100011215278 [0,2,0,0,0,0|1,0,0]=3 29558 B18R2.65882 Fc1cncc(c1)COCc2ccccc2I 7a_100000187465_100000725299 [0,2,0,0,0,0|1,0,0]=3 29559 B18R2.65882 Fc1cncc(c1)COCc2ccccc2I 7a_100011962875_100011215278 [0,2,0,0,0,0|1,0,0]=3 29560 B18R2.65882 Fc1cncc(c1)COCc2cccnc2Br 34a_100000719692_100000725299 [0,2,0,0,0,0|2,0,0]=4 29561 B18R2.65882 Fc1cncc(c1)COCc2cccnc2Br 34a_100011962875_100010140945 [0,2,0,0,0,0|2,0,0]=4 29562 B18R2.65882 Fc1cncc(c1)COCc2cccnc2Br 7a_100000719692_100000725299 [0,2,0,0,0,0|2,0,0]=4 29563 B18R2.65882 Fc1cncc(c1)COCc2cccnc2Br 7a_100011962875_100010140945 [0,2,0,0,0,0|2,0,0]=4 29564 B18R2.65882 Fc1cncc(c1)COCc2cccnc2Cl 34a_100000748726_100000725299 [0,2,0,0,0,0|2,0,0]=4 29565 B18R2.65882 Fc1cncc(c1)COCc2cccnc2Cl 34a_100011962875_100000045678 [0,2,0,0,0,0|2,0,0]=4 29566 B18R2.65882 Fc1cncc(c1)COCc2cccnc2Cl 7a_100000748726_100000725299 [0,2,0,0,0,0|2,0,0]=4 29567 B18R2.65882 Fc1cncc(c1)COCc2cccnc2Cl 7a_100011962875_100000045678 [0,2,0,0,0,0|2,0,0]=4 29568 B18R2.65882 Fc1cncc(c1)COCc2cccnc2F 34a_100000079888_100000725299 [0,2,0,0,0,0|2,0,0]=4 29569 B18R2.65882 Fc1cncc(c1)COCc2cccnc2F 34a_100011962875_100000099810 [0,2,0,0,0,0|2,0,0]=4 29570 B18R2.65882 Fc1cncc(c1)COCc2cccnc2F 7a_100000079888_100000725299 [0,2,0,0,0,0|2,0,0]=4 29571 B18R2.65882 Fc1cncc(c1)COCc2cccnc2F 7a_100011962875_100000099810 [0,2,0,0,0,0|2,0,0]=4 29572 B18R2.65882 Fc1cncc(c1)COCc2ccncc2Cl 7a_100011962875_100000763264 [0,2,0,0,0,0|2,0,0]=4 29573 B18R2.65882 Fc1cncc(c1)COCc2ccncc2F 34a_100012172863_100000725299 [0,2,0,0,0,0|2,0,0]=4 29574 B18R2.65882 Fc1cncc(c1)COCc2cnccc2Cl 34a_100000117392_100000725299 [0,2,0,0,0,0|2,0,0]=4 29575 B18R2.65882 Fc1cncc(c1)COCc2ncccc2Br 34a_100011962875_100025702911 [0,2,0,0,0,0|2,0,0]=4 29576 B18R2.65882 Fc1cncc(c1)COCc2ncccc2Br 34a_100011996772_100000725299 [0,2,0,0,0,0|2,0,0]=4 29577 B18R2.65882 Fc1cncc(c1)COCc2ncccc2Br 7a_100011962875_100025702911 [0,2,0,0,0,0|2,0,0]=4 29578 B18R2.65882 Fc1cncc(c1)COCc2ncccc2Cl 34a_100012002383_100000725299 [0,2,0,0,0,0|2,0,0]=4 29579 B18R2.65882 Fc1cncc(c1)COCc2ncccc2Cl 7a_100011962875_100000099807 [0,2,0,0,0,0|2,0,0]=4 29580 B18R2.65882 Fc1cncc(c1)COCc2ncccc2F 34a_100011934865_100000725299 [0,2,0,0,0,0|2,0,0]=4 29581 B18R2.65882 Fc1cncc(c1)COCc2ncccc2F 34a_100011962875_100000104219 [0,2,0,0,0,0|2,0,0]=4 29582 B18R2.65882 Fc1cncc(c1)COCc2ncccc2F 7a_100011962875_100000104219 [0,2,0,0,0,0|2,0,0]=4 29583 B18R2.65882 Fc1cncc(c1)CSCc2ccccc2Br 62a_100000184730_100000725299 [0,2,0,0,0,0|1,1,0]=4 29584 B18R2.65882 Fc1cncc(c1)CSCc2ccccc2Br 62a_100000725299_100000184730 [0,2,0,0,0,0|1,1,0]=4 29585 B18R2.65882 Fc1cncc(c1)CSCc2ccccc2Cl 62a_100000187162_100000725299 [0,2,0,0,0,0|1,1,0]=4 29586 B18R2.65882 Fc1cncc(c1)CSCc2ccccc2Cl 62a_100000725299_100000187162 [0,2,0,0,0,0|1,1,0]=4 29587 B18R2.65882 Fc1cncc(c1)CSCc2ccccc2F 62a_100000211605_100000725299 [0,2,0,0,0,0|1,1,0]=4 29588 B18R2.65882 Fc1cncc(c1)CSCc2ccccc2F 62a_100000725299_100000211605 [0,2,0,0,0,0|1,1,0]=4 29589 B18R2.65882 Fc1cncc(c1)CSCc2ccccc2I 62a_100000725299_100011216222 [0,2,0,0,0,0|1,1,0]=4 29590 B18R2.65882 Fc1cncc(c1)CSCc2ccccc2I 62a_100011216222_100000725299 [0,2,0,0,0,0|1,1,0]=4 29591 B18R2.65882 Fc1cnccc1CNCc2cccc(c2)Br 207a_100011935246_100000210085 [0,2,0,0,0,0|2,0,0]=4 29592 B18R2.65882 Fc1cnccc1CNCc2cccc(c2)Br 270004a_100011935246_100000210085 [0,2,0,0,0,0|2,0,0]=4 29593 B18R2.65882 Fc1cnccc1CNCc2cccc(c2)Br 34a_100011935246_100000698116 [0,2,0,0,0,0|2,0,0]=4 29594 B18R2.65882 Fc1cnccc1CNCc2cccc(c2)Cl 207a_100011935246_100000210801 [0,2,0,0,0,0|2,0,0]=4 29595 B18R2.65882 Fc1cnccc1CNCc2cccc(c2)Cl 270004a_100011935246_100000210801 [0,2,0,0,0,0|2,0,0]=4 29596 B18R2.65882 Fc1cnccc1CNCc2cccc(c2)Cl 34a_100011935246_100000187163 [0,2,0,0,0,0|2,0,0]=4 29597 B18R2.65882 Fc1cnccc1CNCc2cccc(c2)I 207a_100011935246_100000014684 [0,2,0,0,0,0|2,0,0]=4 29598 B18R2.65882 Fc1cnccc1CNCc2cccc(c2)I 270004a_100011935246_100000014684 [0,2,0,0,0,0|2,0,0]=4 29599 B18R2.65882 Fc1cnccc1CNCc2cccc(c2)I 34a_100011935246_100011218688 [0,2,0,0,0,0|2,0,0]=4 29600 B18R2.65882 Fc1cnccc1COCc2cc(ccn2)Br 34a_100012172863_100010173614 [0,2,0,0,0,0|2,0,0]=4 29601 B18R2.65882 Fc1cnccc1COCc2cc(ccn2)Cl 34a_100012172863_100016988179 [0,2,0,0,0,0|2,0,0]=4 29602 B18R2.65882 Fc1cnccc1COCc2cccc(c2)Br 34a_100012172863_100000698116 [0,2,0,0,0,0|1,0,0]=3 29603 B18R2.65882 Fc1cnccc1COCc2cccc(c2)Cl 34a_100012172863_100000187163 [0,2,0,0,0,0|1,0,0]=3 29604 B18R2.65882 Fc1cnccc1COCc2cccc(c2)I 34a_100012172863_100011218688 [0,2,0,0,0,0|1,0,0]=3 29605 B18R2.65882 Fc1cnccc1COCc2cccc(n2)Br 34a_100012172863_100009889011 [0,2,0,0,0,0|2,0,0]=4 29606 B18R2.65882 Fc1cnccc1COCc2cccc(n2)Cl 34a_100012172863_100000086093 [0,2,0,0,0,0|2,0,0]=4 29607 B18R2.65882 Fc1cnccc1COCc2ccnc(c2)Br 34a_100012172863_100010243470 [0,2,0,0,0,0|2,0,0]=4 29608 B18R2.65882 Fc1cnccc1COCc2ccnc(c2)Cl 34a_100012172863_100000764220 [0,2,0,0,0,0|2,0,0]=4 29609 B18R2.65882 Fc1cnccc1COCc2cncc(c2)Br 34a_100012172863_100000738771 [0,2,0,0,0,0|2,0,0]=4 29610 B18R2.65882 Fc1cnccc1COCc2cncc(c2)Cl 34a_100012172863_100016992070 [0,2,0,0,0,0|2,0,0]=4 29611 B18R2.65882 Fc1ncccc1CNCc2cccc(c2)Br 2230a_100000174977_100000099810 [0,2,0,0,0,0|2,0,0]=4 29612 B18R2.65882 Fc1ncccc1CNCc2cccc(c2)Br 270004a_100000724633_100000210085 [0,2,0,0,0,0|2,0,0]=4 29613 B18R2.65882 Fc1ncccc1CNCc2cccc(c2)Br 34a_100000174977_100000099810 [0,2,0,0,0,0|2,0,0]=4 29614 B18R2.65882 Fc1ncccc1CNCc2cccc(c2)Br 34a_100000724633_100000698116 [0,2,0,0,0,0|2,0,0]=4 29615 B18R2.65882 Fc1ncccc1CNCc2cccc(c2)Cl 2230a_100000174878_100000099810 [0,2,0,0,0,0|2,0,0]=4 29616 B18R2.65882 Fc1ncccc1CNCc2cccc(c2)Cl 270004a_100000724633_100000210801 [0,2,0,0,0,0|2,0,0]=4 29617 B18R2.65882 Fc1ncccc1CNCc2cccc(c2)Cl 34a_100000174878_100000099810 [0,2,0,0,0,0|2,0,0]=4 29618 B18R2.65882 Fc1ncccc1CNCc2cccc(c2)Cl 34a_100000724633_100000187163 [0,2,0,0,0,0|2,0,0]=4 29619 B18R2.65882 Fc1ncccc1CNCc2cccc(c2)I 2230a_100000106179_100000099810 [0,2,0,0,0,0|2,0,0]=4 29620 B18R2.65882 Fc1ncccc1CNCc2cccc(c2)I 270004a_100000724633_100000014684 [0,2,0,0,0,0|2,0,0]=4 29621 B18R2.65882 Fc1ncccc1CNCc2cccc(c2)I 34a_100000106179_100000099810 [0,2,0,0,0,0|2,0,0]=4 29622 B18R2.65882 Fc1ncccc1CNCc2cccc(c2)I 34a_100000724633_100011218688 [0,2,0,0,0,0|2,0,0]=4 29623 B18R2.65882 Fc1ncccc1COCc2cc(ccn2)Br 34a_100000079888_100010173614 [0,2,0,0,0,0|2,0,0]=4 29624 B18R2.65882 Fc1ncccc1COCc2cc(ccn2)Br 7a_100000079888_100010173614 [0,2,0,0,0,0|2,0,0]=4 29625 B18R2.65882 Fc1ncccc1COCc2cc(ccn2)Cl 34a_100000079888_100016988179 [0,2,0,0,0,0|2,0,0]=4 29626 B18R2.65882 Fc1ncccc1COCc2cc(ccn2)Cl 34a_100000748867_100000099810 [0,2,0,0,0,0|2,0,0]=4 29627 B18R2.65882 Fc1ncccc1COCc2cc(ccn2)Cl 7a_100000079888_100016988179 [0,2,0,0,0,0|2,0,0]=4 29628 B18R2.65882 Fc1ncccc1COCc2cccc(c2)Br 34a_100000079888_100000698116 [0,2,0,0,0,0|1,0,0]=3 29629 B18R2.65882 Fc1ncccc1COCc2cccc(c2)Br 34a_100000687537_100000099810 [0,2,0,0,0,0|1,0,0]=3 29630 B18R2.65882 Fc1ncccc1COCc2cccc(c2)Br 7a_100000079888_100000211773 [0,2,0,0,0,0|1,0,0]=3 29631 B18R2.65882 Fc1ncccc1COCc2cccc(c2)Br 7a_100000687537_100000099810 [0,2,0,0,0,0|1,0,0]=3 29632 B18R2.65882 Fc1ncccc1COCc2cccc(c2)Cl 34a_100000079888_100000187163 [0,2,0,0,0,0|1,0,0]=3 29633 B18R2.65882 Fc1ncccc1COCc2cccc(c2)Cl 34a_100000241301_100000099810 [0,2,0,0,0,0|1,0,0]=3 29634 B18R2.65882 Fc1ncccc1COCc2cccc(c2)Cl 7a_100000079888_100000187163 [0,2,0,0,0,0|1,0,0]=3 29635 B18R2.65882 Fc1ncccc1COCc2cccc(c2)Cl 7a_100000241301_100000099810 [0,2,0,0,0,0|1,0,0]=3 29636 B18R2.65882 Fc1ncccc1COCc2cccc(c2)I 34a_100000079888_100011218688 [0,2,0,0,0,0|1,0,0]=3 29637 B18R2.65882 Fc1ncccc1COCc2cccc(c2)I 34a_100011215336_100000099810 [0,2,0,0,0,0|1,0,0]=3 29638 B18R2.65882 Fc1ncccc1COCc2cccc(c2)I 7a_100000079888_100011218688 [0,2,0,0,0,0|1,0,0]=3 29639 B18R2.65882 Fc1ncccc1COCc2cccc(c2)I 7a_100011215336_100000099810 [0,2,0,0,0,0|1,0,0]=3 29640 B18R2.65882 Fc1ncccc1COCc2cccc(n2)Br 34a_100000079888_100009889011 [0,2,0,0,0,0|2,0,0]=4 29641 B18R2.65882 Fc1ncccc1COCc2cccc(n2)Br 34a_100000694195_100000099810 [0,2,0,0,0,0|2,0,0]=4 29642 B18R2.65882 Fc1ncccc1COCc2cccc(n2)Br 7a_100000079888_100009889011 [0,2,0,0,0,0|2,0,0]=4 29643 B18R2.65882 Fc1ncccc1COCc2cccc(n2)Cl 34a_100000079888_100000086093 [0,2,0,0,0,0|2,0,0]=4 29644 B18R2.65882 Fc1ncccc1COCc2cccc(n2)Cl 34a_100011998359_100000099810 [0,2,0,0,0,0|2,0,0]=4 29645 B18R2.65882 Fc1ncccc1COCc2cccc(n2)Cl 7a_100000079888_100000086093 [0,2,0,0,0,0|2,0,0]=4 29646 B18R2.65882 Fc1ncccc1COCc2ccnc(c2)Br 34a_100000079888_100010243470 [0,2,0,0,0,0|2,0,0]=4 29647 B18R2.65882 Fc1ncccc1COCc2ccnc(c2)Br 34a_100009814636_100000099810 [0,2,0,0,0,0|2,0,0]=4 29648 B18R2.65882 Fc1ncccc1COCc2ccnc(c2)Br 7a_100000079888_100010254460 [0,2,0,0,0,0|2,0,0]=4 29649 B18R2.65882 Fc1ncccc1COCc2ccnc(c2)Br 7a_100009814636_100000099810 [0,2,0,0,0,0|2,0,0]=4 29650 B18R2.65882 Fc1ncccc1COCc2ccnc(c2)Cl 34a_100000079888_100000764220 [0,2,0,0,0,0|2,0,0]=4 29651 B18R2.65882 Fc1ncccc1COCc2ccnc(c2)Cl 34a_100000748751_100000099810 [0,2,0,0,0,0|2,0,0]=4 29652 B18R2.65882 Fc1ncccc1COCc2ccnc(c2)Cl 7a_100000079888_100000764220 [0,2,0,0,0,0|2,0,0]=4 29653 B18R2.65882 Fc1ncccc1COCc2cncc(c2)Br 34a_100000079888_100000738771 [0,2,0,0,0,0|2,0,0]=4 29654 B18R2.65882 Fc1ncccc1COCc2cncc(c2)Br 34a_100011259137_100000099810 [0,2,0,0,0,0|2,0,0]=4 29655 B18R2.65882 Fc1ncccc1COCc2cncc(c2)Br 7a_100000079888_100000738771 [0,2,0,0,0,0|2,0,0]=4 29656 B18R2.65882 Fc1ncccc1COCc2cncc(c2)Br 7a_100011259137_100000099810 [0,2,0,0,0,0|2,0,0]=4 29657 B18R2.65882 Fc1ncccc1COCc2cncc(c2)Cl 34a_100000079888_100016992070 [0,2,0,0,0,0|2,0,0]=4 29658 B18R2.65882 Fc1ncccc1COCc2cncc(c2)Cl 34a_100000092867_100000099810 [0,2,0,0,0,0|2,0,0]=4 29659 B18R2.65882 Fc1ncccc1COCc2cncc(c2)Cl 7a_100000079888_100016992070 [0,2,0,0,0,0|2,0,0]=4 29660 B18R2.65882 Fc1ncccc1COCc2cncc(c2)Cl 7a_100000092867_100000099810 [0,2,0,0,0,0|2,0,0]=4 29661 B18R2.65882 Fc1ncccc1CSCc2cccc(c2)Br 62a_100000099810_100000211773 [0,2,0,0,0,0|1,1,0]=4 29662 B18R2.65882 Fc1ncccc1CSCc2cccc(c2)Br 62a_100000211773_100000099810 [0,2,0,0,0,0|1,1,0]=4 29663 B18R2.65882 Fc1ncccc1CSCc2cccc(c2)Cl 62a_100000099810_100000187163 [0,2,0,0,0,0|1,1,0]=4 29664 B18R2.65882 Fc1ncccc1CSCc2cccc(c2)Cl 62a_100000187163_100000099810 [0,2,0,0,0,0|1,1,0]=4 29665 B18R2.65882 Fc1ncccc1CSCc2cccc(c2)I 62a_100000099810_100011218688 [0,2,0,0,0,0|1,1,0]=4 29666 B18R2.65882 Fc1ncccc1CSCc2cccc(c2)I 62a_100011218688_100000099810 [0,2,0,0,0,0|1,1,0]=4 29667 B18R2.65882 Ic1cccc(c1)CNCc2ccccc2I 207a_100000106179_100000010305 [0,2,0,0,0,0|1,0,0]=3 29668 B18R2.65882 Ic1cccc(c1)CNCc2ccccc2I 207a_100015347259_100000014684 [0,2,0,0,0,0|1,0,0]=3 29669 B18R2.65882 Ic1cccc(c1)CNCc2ccccc2I 2230a_100000106179_100011215278 [0,2,0,0,0,0|1,0,0]=3 29670 B18R2.65882 Ic1cccc(c1)CNCc2ccccc2I 270004a_100000106179_100000010305 [0,2,0,0,0,0|1,0,0]=3 29671 B18R2.65882 Ic1cccc(c1)CNCc2ccccc2I 270004a_100015347259_100000014684 [0,2,0,0,0,0|1,0,0]=3 29672 B18R2.65882 Ic1cccc(c1)CNCc2ccccc2I 34a_100000106179_100011215278 [0,2,0,0,0,0|1,0,0]=3 29673 B18R2.65882 Ic1cccc(c1)COCc2ccccc2I 34a_100000187465_100011218688 [0,2,0,0,0,0|0,0,0]=2 29674 B18R2.65882 Ic1cccc(c1)COCc2ccccc2I 34a_100011215336_100011215278 [0,2,0,0,0,0|0,0,0]=2 29675 B18R2.65882 Ic1cccc(c1)COCc2ccccc2I 7a_100000187465_100011218688 [0,2,0,0,0,0|0,0,0]=2 29676 B18R2.65882 Ic1cccc(c1)COCc2ccccc2I 7a_100011215336_100011215278 [0,2,0,0,0,0|0,0,0]=2 29677 B18R2.65882 Ic1cccc(c1)CSCc2ccccc2I 62a_100011216222_100011218688 [0,2,0,0,0,0|0,1,0]=3 29678 B18R2.65882 Ic1cccc(c1)CSCc2ccccc2I 62a_100011218688_100011216222 [0,2,0,0,0,0|0,1,0]=3 29679 B18R2.65882 Nc1cccc(c1)COCc2ccccc2Br 34a_100000211919_100000184730 [0,2,0,0,0,0|0,0,0]=2 29680 B18R2.65882 Nc1cccc(c1)COCc2ccccc2Cl 34a_100000211919_100000187162 [0,2,0,0,0,0|0,0,0]=2 29681 B18R2.65882 Nc1cccc(c1)COCc2ccccc2F 34a_100000211919_100000211605 [0,2,0,0,0,0|0,0,0]=2 29682 B18R2.65882 Nc1cccc(c1)COCc2ccccc2I 34a_100000211919_100011215278 [0,2,0,0,0,0|0,0,0]=2 29683 B18R2.65882 Nc1cccc(c1)COCc2cccnc2Br 34a_100000211919_100010140945 [0,2,0,0,0,0|1,0,0]=3 29684 B18R2.65882 Nc1cccc(c1)COCc2cccnc2Cl 34a_100000211919_100000045678 [0,2,0,0,0,0|1,0,0]=3 29685 B18R2.65882 Nc1cccc(c1)COCc2cccnc2F 34a_100000211919_100000099810 [0,2,0,0,0,0|1,0,0]=3 29686 B18R2.65882 Nc1cccc(c1)COCc2ncccc2Br 34a_100000211919_100025702911 [0,2,0,0,0,0|1,0,0]=3 29687 B18R2.65882 Nc1cccc(c1)COCc2ncccc2F 34a_100000211919_100000104219 [0,2,0,0,0,0|1,0,0]=3 29688 B18R2.65882 Nc1cccc(c1)COCc2ncccc2O 34a_100000211919_200020655725 [0,2,0,0,0,0|1,0,0]=3 29689 B18R2.65882 Nc1cccc(c1)OCCc2ccccc2Br 34a_100000210217_100012161201 [0,2,0,0,0,0|2,0,0]=4 29690 B18R2.65882 Nc1cccc(c1)OCCc2ccccc2Cl 34a_100000210217_100011713703 [0,2,0,0,0,0|2,0,0]=4 29691 B18R2.65882 Nc1cccc(c1)OCCc2ccccc2F 34a_100000210217_100000720011 [0,2,0,0,0,0|2,0,0]=4 29692 B18R2.65882 Nc1cccc(c1)OCCc2ccccc2O 34a_100000210217_100000722297 [0,2,0,0,0,0|2,0,0]=4 29693 B18R2.65882 Nc1cccc(c1)SCCc2ccccc2Br 62a_100000210019_100012161201 [0,2,0,0,0,0|2,0,0]=4 29694 B18R2.65882 Nc1cccc(c1)SCCc2ccccc2Br 62a_100012161201_100000210019 [0,2,0,0,0,0|2,0,0]=4 29695 B18R2.65882 Nc1cccc(c1)SCCc2ccccc2Cl 62a_100000210019_100011713703 [0,2,0,0,0,0|2,0,0]=4 29696 B18R2.65882 Nc1cccc(c1)SCCc2ccccc2Cl 62a_100011713703_100000210019 [0,2,0,0,0,0|2,0,0]=4 29697 B18R2.65882 Nc1cccc(c1)SCCc2ccccc2F 62a_100000210019_100011713696 [0,2,0,0,0,0|2,0,0]=4 29698 B18R2.65882 Nc1cccc(c1)SCCc2ccccc2F 62a_100011713696_100000210019 [0,2,0,0,0,0|2,0,0]=4 29699 B18R2.65882 Nc1cccc(c1)SCCc2ccccc2O 62a_100000210019_100000722297 [0,2,0,0,0,0|2,0,0]=4 29700 B18R2.65882 Nc1cccc(c1)SCCc2ccccc2O 62a_100000722297_100000210019 [0,2,0,0,0,0|2,0,0]=4 29701 B18R2.65882 Nc1ccccc1COCc2cc(ccn2)Br 34a_100000212039_100010173614 [0,2,0,0,0,0|1,0,0]=3 29702 B18R2.65882 Nc1ccccc1COCc2cc(ccn2)Cl 34a_100000212039_100016988179 [0,2,0,0,0,0|1,0,0]=3 29703 B18R2.65882 Nc1ccccc1COCc2cccc(c2)Br 34a_100000212039_100000698116 [0,2,0,0,0,0|0,0,0]=2 29704 B18R2.65882 Nc1ccccc1COCc2cccc(c2)Cl 34a_100000212039_100000187163 [0,2,0,0,0,0|0,0,0]=2 29705 B18R2.65882 Nc1ccccc1COCc2cccc(c2)F 34a_100000212039_100000187166 [0,2,0,0,0,0|0,0,0]=2 29706 B18R2.65882 Nc1ccccc1COCc2cccc(c2)I 34a_100000212039_100011218688 [0,2,0,0,0,0|0,0,0]=2 29707 B18R2.65882 Nc1ccccc1COCc2cccc(c2)O 34a_100000212039_100011660834 [0,2,0,0,0,0|0,0,0]=2 29708 B18R2.65882 Nc1ccccc1COCc2cccc(n2)Br 34a_100000212039_100009889011 [0,2,0,0,0,0|1,0,0]=3 29709 B18R2.65882 Nc1ccccc1COCc2cccc(n2)Cl 34a_100000212039_100000086093 [0,2,0,0,0,0|1,0,0]=3 29710 B18R2.65882 Nc1ccccc1COCc2cccc(n2)F 34a_100000212039_100009819644 [0,2,0,0,0,0|1,0,0]=3 29711 B18R2.65882 Nc1ccccc1COCc2ccnc(c2)Br 34a_100000212039_100010243470 [0,2,0,0,0,0|1,0,0]=3 29712 B18R2.65882 Nc1ccccc1COCc2ccnc(c2)Cl 34a_100000212039_100000764220 [0,2,0,0,0,0|1,0,0]=3 29713 B18R2.65882 Nc1ccccc1COCc2ccnc(n2)Cl 34a_100000212039_100000099655 [0,2,0,0,0,0|2,0,0]=4 29714 B18R2.65882 Nc1ccccc1COCc2cncc(c2)Br 34a_100000212039_100000738771 [0,2,0,0,0,0|1,0,0]=3 29715 B18R2.65882 Nc1ccccc1COCc2cncc(c2)Cl 34a_100000212039_100016992070 [0,2,0,0,0,0|1,0,0]=3 29716 B18R2.65882 Nc1ccccc1COCc2cncc(c2)F 34a_100000212039_100000725299 [0,2,0,0,0,0|1,0,0]=3 29717 B18R2.65882 Nc1ccccc1OCCc2cccc(c2)Br 34a_100000185747_100011740638 [0,2,0,0,0,0|2,0,0]=4 29718 B18R2.65882 Nc1ccccc1OCCc2cccc(c2)Br 7a_100000185747_100011740638 [0,2,0,0,0,0|2,0,0]=4 29719 B18R2.65882 Nc1ccccc1OCCc2cccc(c2)Cl 34a_100000185747_100011713710 [0,2,0,0,0,0|2,0,0]=4 29720 B18R2.65882 Nc1ccccc1OCCc2cccc(c2)Cl 7a_100000185747_100011713710 [0,2,0,0,0,0|2,0,0]=4 29721 B18R2.65882 Nc1ccccc1OCCc2cccc(c2)F 34a_100000185747_100011217235 [0,2,0,0,0,0|2,0,0]=4 29722 B18R2.65882 Nc1ccccc1OCCc2cccc(c2)F 7a_100000185747_100011217235 [0,2,0,0,0,0|2,0,0]=4 29723 B18R2.65882 Nc1ccccc1SCCc2cccc(c2)Br 62a_100000210017_100011740638 [0,2,0,0,0,0|2,0,0]=4 29724 B18R2.65882 Nc1ccccc1SCCc2cccc(c2)Br 62a_100011740638_100000210017 [0,2,0,0,0,0|2,0,0]=4 29725 B18R2.65882 Nc1ccccc1SCCc2cccc(c2)Cl 62a_100000210017_100011713710 [0,2,0,0,0,0|2,0,0]=4 29726 B18R2.65882 Nc1ccccc1SCCc2cccc(c2)Cl 62a_100011713710_100000210017 [0,2,0,0,0,0|2,0,0]=4 29727 B18R2.65882 Nc1ccccc1SCCc2cccc(c2)F 62a_100000210017_100011217235 [0,2,0,0,0,0|2,0,0]=4 29728 B18R2.65882 Nc1ccccc1SCCc2cccc(c2)F 62a_100011217235_100000210017 [0,2,0,0,0,0|2,0,0]=4 29729 B18R2.65882 Nc1cccnc1COCc2cc(ccn2)Br 34a_114873767017_100010173614 [0,2,0,0,0,0|2,0,0]=4 29730 B18R2.65882 Nc1cccnc1COCc2cc(ccn2)Cl 34a_114873767017_100016988179 [0,2,0,0,0,0|2,0,0]=4 29731 B18R2.65882 Nc1cccnc1COCc2cccc(c2)Br 34a_114873767017_100000698116 [0,2,0,0,0,0|1,0,0]=3 29732 B18R2.65882 Nc1cccnc1COCc2cccc(c2)Cl 34a_114873767017_100000187163 [0,2,0,0,0,0|1,0,0]=3 29733 B18R2.65882 Nc1cccnc1COCc2cccc(c2)F 34a_114873767017_100000187166 [0,2,0,0,0,0|1,0,0]=3 29734 B18R2.65882 Nc1cccnc1COCc2cccc(c2)I 34a_114873767017_100011218688 [0,2,0,0,0,0|1,0,0]=3 29735 B18R2.65882 Nc1cccnc1COCc2cccc(c2)O 34a_114873767017_100011660834 [0,2,0,0,0,0|1,0,0]=3 29736 B18R2.65882 Nc1cccnc1COCc2cccc(n2)Br 34a_114873767017_100009889011 [0,2,0,0,0,0|2,0,0]=4 29737 B18R2.65882 Nc1cccnc1COCc2cccc(n2)Cl 34a_114873767017_100000086093 [0,2,0,0,0,0|2,0,0]=4 29738 B18R2.65882 Nc1cccnc1COCc2cccc(n2)F 34a_114873767017_100009819644 [0,2,0,0,0,0|2,0,0]=4 29739 B18R2.65882 Nc1cccnc1COCc2ccnc(c2)Br 34a_114873767017_100010243470 [0,2,0,0,0,0|2,0,0]=4 29740 B18R2.65882 Nc1cccnc1COCc2ccnc(c2)Cl 34a_114873767017_100000764220 [0,2,0,0,0,0|2,0,0]=4 29741 B18R2.65882 Nc1cccnc1COCc2cncc(c2)Br 34a_114873767017_100000738771 [0,2,0,0,0,0|2,0,0]=4 29742 B18R2.65882 Nc1cccnc1COCc2cncc(c2)Cl 34a_114873767017_100016992070 [0,2,0,0,0,0|2,0,0]=4 29743 B18R2.65882 Nc1cccnc1COCc2cncc(c2)F 34a_114873767017_100000725299 [0,2,0,0,0,0|2,0,0]=4 29744 B18R2.65882 Nc1ccnc(c1)COCc2ccccc2Br 34a_100000692640_100000184730 [0,2,0,0,0,0|1,0,0]=3 29745 B18R2.65882 Nc1ccnc(c1)COCc2ccccc2Cl 34a_100000692640_100000187162 [0,2,0,0,0,0|1,0,0]=3 29746 B18R2.65882 Nc1ccnc(c1)COCc2ccccc2F 34a_100000692640_100000211605 [0,2,0,0,0,0|1,0,0]=3 29747 B18R2.65882 Nc1ccnc(c1)COCc2ccccc2I 34a_100000692640_100011215278 [0,2,0,0,0,0|1,0,0]=3 29748 B18R2.65882 Nc1ccnc(c1)COCc2cccnc2Br 34a_100000692640_100010140945 [0,2,0,0,0,0|2,0,0]=4 29749 B18R2.65882 Nc1ccnc(c1)COCc2cccnc2Cl 34a_100000692640_100000045678 [0,2,0,0,0,0|2,0,0]=4 29750 B18R2.65882 Nc1ccnc(c1)COCc2cccnc2F 34a_100000692640_100000099810 [0,2,0,0,0,0|2,0,0]=4 29751 B18R2.65882 Nc1ccnc(c1)COCc2ncccc2Br 34a_100000692640_100025702911 [0,2,0,0,0,0|2,0,0]=4 29752 B18R2.65882 Nc1ccnc(c1)COCc2ncccc2F 34a_100000692640_100000104219 [0,2,0,0,0,0|2,0,0]=4 29753 B18R2.65882 Nc1ccnc(c1)COCc2ncccc2O 34a_100000692640_200020655725 [0,2,0,0,0,0|2,0,0]=4 29754 B18R2.65882 Nc1cncc(c1)COCc2ccccc2Br 34a_100000085308_100000184730 [0,2,0,0,0,0|1,0,0]=3 29755 B18R2.65882 Nc1cncc(c1)COCc2ccccc2Cl 34a_100000085308_100000187162 [0,2,0,0,0,0|1,0,0]=3 29756 B18R2.65882 Nc1cncc(c1)COCc2ccccc2F 34a_100000085308_100000211605 [0,2,0,0,0,0|1,0,0]=3 29757 B18R2.65882 Nc1cncc(c1)COCc2ccccc2I 34a_100000085308_100011215278 [0,2,0,0,0,0|1,0,0]=3 29758 B18R2.65882 Nc1cncc(c1)COCc2cccnc2Br 34a_100000085308_100010140945 [0,2,0,0,0,0|2,0,0]=4 29759 B18R2.65882 Nc1cncc(c1)COCc2cccnc2Cl 34a_100000085308_100000045678 [0,2,0,0,0,0|2,0,0]=4 29760 B18R2.65882 Nc1cncc(c1)COCc2cccnc2F 34a_100000085308_100000099810 [0,2,0,0,0,0|2,0,0]=4 29761 B18R2.65882 Nc1cncc(c1)COCc2ncccc2Br 34a_100000085308_100025702911 [0,2,0,0,0,0|2,0,0]=4 29762 B18R2.65882 Nc1cncc(c1)COCc2ncccc2F 34a_100000085308_100000104219 [0,2,0,0,0,0|2,0,0]=4 29763 B18R2.65882 Nc1cncc(c1)COCc2ncccc2O 34a_100000085308_200020655725 [0,2,0,0,0,0|2,0,0]=4 29764 B18R2.65882 O=c1cccc([nH]1)CNCc2ccccc2Br 207a_100000689332_100011935257 [0,2,0,0,0,0|2,0,0]=4 29765 B18R2.65882 O=c1cccc([nH]1)CNCc2ccccc2Br 2230a_100000696482_100000184730 [0,2,0,0,0,0|2,0,0]=4 29766 B18R2.65882 O=c1cccc([nH]1)CNCc2ccccc2Cl 207a_100000174879_100011935257 [0,2,0,0,0,0|2,0,0]=4 29767 B18R2.65882 O=c1cccc([nH]1)CNCc2ccccc2Cl 2230a_100000696482_100000187162 [0,2,0,0,0,0|2,0,0]=4 29768 B18R2.65882 O=c1cccc([nH]1)CNCc2ccccc2F 207a_100000174869_100011935257 [0,2,0,0,0,0|2,0,0]=4 29769 B18R2.65882 O=c1cccc([nH]1)CNCc2ccccc2F 2230a_100000696482_100000211605 [0,2,0,0,0,0|2,0,0]=4 29770 B18R2.65882 O=c1cccc([nH]1)CNCc2ccccc2I 207a_100015347259_100011935257 [0,2,0,0,0,0|2,0,0]=4 29771 B18R2.65882 O=c1cccc([nH]1)CNCc2ccccc2I 2230a_100000696482_100011215278 [0,2,0,0,0,0|2,0,0]=4 29772 B18R2.65882 O=c1cccc([nH]1)CNCc2ccccc2O 207a_100000185550_100011935257 [0,2,0,0,0,0|2,0,0]=4 29773 B18R2.65882 Oc1cc(ccn1)CNCc2ccccc2Br 207a_100000689332_100000688113 [0,2,0,0,0,0|2,0,0]=4 29774 B18R2.65882 Oc1cc(ccn1)CNCc2ccccc2Cl 207a_100000174879_100000688113 [0,2,0,0,0,0|2,0,0]=4 29775 B18R2.65882 Oc1cc(ccn1)CNCc2ccccc2F 207a_100000174869_100000688113 [0,2,0,0,0,0|2,0,0]=4 29776 B18R2.65882 Oc1cc(ccn1)CNCc2ccccc2I 207a_100015347259_100000688113 [0,2,0,0,0,0|2,0,0]=4 29777 B18R2.65882 Oc1cc(ccn1)CNCc2ccccc2O 207a_100000185550_100000688113 [0,2,0,0,0,0|2,0,0]=4 29778 B18R2.65882 Oc1cccc(c1)CNCc2ccccc2Br 207a_100000689332_100000188321 [0,2,0,0,0,0|1,0,0]=3 29779 B18R2.65882 Oc1cccc(c1)CNCc2ccccc2Br 207a_100000743036_100000211189 [0,2,0,0,0,0|1,0,0]=3 29780 B18R2.65882 Oc1cccc(c1)CNCc2ccccc2Br 2230a_100000689332_100011660834 [0,2,0,0,0,0|1,0,0]=3 29781 B18R2.65882 Oc1cccc(c1)CNCc2ccccc2Br 2230a_100000743036_100000184730 [0,2,0,0,0,0|1,0,0]=3 29782 B18R2.65882 Oc1cccc(c1)CNCc2ccccc2Br 270004a_100000689332_100000188321 [0,2,0,0,0,0|1,0,0]=3 29783 B18R2.65882 Oc1cccc(c1)CNCc2ccccc2Br 270004a_100000743036_100000211189 [0,2,0,0,0,0|1,0,0]=3 29784 B18R2.65882 Oc1cccc(c1)CNCc2ccccc2Br 34a_100000689332_100011660834 [0,2,0,0,0,0|1,0,0]=3 29785 B18R2.65882 Oc1cccc(c1)CNCc2ccccc2Br 34a_100000743036_100000184730 [0,2,0,0,0,0|1,0,0]=3 29786 B18R2.65882 Oc1cccc(c1)CNCc2ccccc2Cl 207a_100000174879_100000188321 [0,2,0,0,0,0|1,0,0]=3 29787 B18R2.65882 Oc1cccc(c1)CNCc2ccccc2Cl 207a_100000743036_100000210073 [0,2,0,0,0,0|1,0,0]=3 29788 B18R2.65882 Oc1cccc(c1)CNCc2ccccc2Cl 2230a_100000174879_100011660834 [0,2,0,0,0,0|1,0,0]=3 29789 B18R2.65882 Oc1cccc(c1)CNCc2ccccc2Cl 2230a_100000743036_100000187162 [0,2,0,0,0,0|1,0,0]=3 29790 B18R2.65882 Oc1cccc(c1)CNCc2ccccc2Cl 270004a_100000174879_100000188321 [0,2,0,0,0,0|1,0,0]=3 29791 B18R2.65882 Oc1cccc(c1)CNCc2ccccc2Cl 270004a_100000743036_100000210073 [0,2,0,0,0,0|1,0,0]=3 29792 B18R2.65882 Oc1cccc(c1)CNCc2ccccc2Cl 34a_100000174879_100011660834 [0,2,0,0,0,0|1,0,0]=3 29793 B18R2.65882 Oc1cccc(c1)CNCc2ccccc2Cl 34a_100000743036_100000187162 [0,2,0,0,0,0|1,0,0]=3 29794 B18R2.65882 Oc1cccc(c1)CNCc2ccccc2F 207a_100000174869_100000188321 [0,2,0,0,0,0|1,0,0]=3 29795 B18R2.65882 Oc1cccc(c1)CNCc2ccccc2F 207a_100000743036_100000210811 [0,2,0,0,0,0|1,0,0]=3 29796 B18R2.65882 Oc1cccc(c1)CNCc2ccccc2F 2230a_100000743036_100000211605 [0,2,0,0,0,0|1,0,0]=3 29797 B18R2.65882 Oc1cccc(c1)CNCc2ccccc2F 270004a_100000174869_100000188321 [0,2,0,0,0,0|1,0,0]=3 29798 B18R2.65882 Oc1cccc(c1)CNCc2ccccc2F 270004a_100000743036_100000210811 [0,2,0,0,0,0|1,0,0]=3 29799 B18R2.65882 Oc1cccc(c1)CNCc2ccccc2F 34a_100000174869_100011660834 [0,2,0,0,0,0|1,0,0]=3 29800 B18R2.65882 Oc1cccc(c1)CNCc2ccccc2F 34a_100000743036_100000211605 [0,2,0,0,0,0|1,0,0]=3 29801 B18R2.65882 Oc1cccc(c1)CNCc2ccccc2I 207a_100000743036_100000010305 [0,2,0,0,0,0|1,0,0]=3 29802 B18R2.65882 Oc1cccc(c1)CNCc2ccccc2I 207a_100015347259_100000188321 [0,2,0,0,0,0|1,0,0]=3 29803 B18R2.65882 Oc1cccc(c1)CNCc2ccccc2I 2230a_100000743036_100011215278 [0,2,0,0,0,0|1,0,0]=3 29804 B18R2.65882 Oc1cccc(c1)CNCc2ccccc2I 270004a_100000743036_100000010305 [0,2,0,0,0,0|1,0,0]=3 29805 B18R2.65882 Oc1cccc(c1)CNCc2ccccc2I 270004a_100015347259_100000188321 [0,2,0,0,0,0|1,0,0]=3 29806 B18R2.65882 Oc1cccc(c1)CNCc2ccccc2I 34a_100000743036_100011215278 [0,2,0,0,0,0|1,0,0]=3 29807 B18R2.65882 Oc1cccc(c1)CNCc2ccccc2O 207a_100000185550_100000188321 [0,2,0,0,0,0|1,0,0]=3 29808 B18R2.65882 Oc1cccc(c1)CNCc2ccccc2O 270004a_100000185550_100000188321 [0,2,0,0,0,0|1,0,0]=3 29809 B18R2.65882 Oc1cccc(c1)CNCc2ccccc2O 34a_100000185550_100011660834 [0,2,0,0,0,0|1,0,0]=3 29810 B18R2.65882 Oc1cccc(c1)CNCc2cccnc2Br 2230a_100000743036_100010140945 [0,2,0,0,0,0|2,0,0]=4 29811 B18R2.65882 Oc1cccc(c1)CNCc2cccnc2Br 2230a_100009818023_100011660834 [0,2,0,0,0,0|2,0,0]=4 29812 B18R2.65882 Oc1cccc(c1)CNCc2cccnc2Br 270004a_100009818023_100000188321 [0,2,0,0,0,0|2,0,0]=4 29813 B18R2.65882 Oc1cccc(c1)CNCc2cccnc2Br 34a_100000743036_100010140945 [0,2,0,0,0,0|2,0,0]=4 29814 B18R2.65882 Oc1cccc(c1)CNCc2cccnc2Br 34a_100009818023_100011660834 [0,2,0,0,0,0|2,0,0]=4 29815 B18R2.65882 Oc1cccc(c1)CNCc2cccnc2Cl 207a_100015189234_100000188321 [0,2,0,0,0,0|2,0,0]=4 29816 B18R2.65882 Oc1cccc(c1)CNCc2cccnc2Cl 2230a_100000743036_100000045678 [0,2,0,0,0,0|2,0,0]=4 29817 B18R2.65882 Oc1cccc(c1)CNCc2cccnc2Cl 2230a_100015189234_100011660834 [0,2,0,0,0,0|2,0,0]=4 29818 B18R2.65882 Oc1cccc(c1)CNCc2cccnc2Cl 34a_100000743036_100000045678 [0,2,0,0,0,0|2,0,0]=4 29819 B18R2.65882 Oc1cccc(c1)CNCc2cccnc2Cl 34a_100015189234_100011660834 [0,2,0,0,0,0|2,0,0]=4 29820 B18R2.65882 Oc1cccc(c1)CNCc2cccnc2F 2230a_100000743036_100000099810 [0,2,0,0,0,0|2,0,0]=4 29821 B18R2.65882 Oc1cccc(c1)CNCc2cccnc2F 270004a_100000724633_100000188321 [0,2,0,0,0,0|2,0,0]=4 29822 B18R2.65882 Oc1cccc(c1)CNCc2cccnc2F 34a_100000724633_100011660834 [0,2,0,0,0,0|2,0,0]=4 29823 B18R2.65882 Oc1cccc(c1)CNCc2cccnc2F 34a_100000743036_100000099810 [0,2,0,0,0,0|2,0,0]=4 29824 B18R2.65882 Oc1cccc(c1)CNCc2cccnc2O 207a_100000743036_100011998315 [0,2,0,0,0,0|2,0,0]=4 29825 B18R2.65882 Oc1cccc(c1)CNCc2cccnc2O 270004a_100000743036_100011998315 [0,2,0,0,0,0|2,0,0]=4 29826 B18R2.65882 Oc1cccc(c1)CNCc2ccncc2Br 207a_100020640021_100000188321 [0,2,0,0,0,0|2,0,0]=4 29827 B18R2.65882 Oc1cccc(c1)CNCc2ccncc2Br 270004a_100000743036_100000755692 [0,2,0,0,0,0|2,0,0]=4 29828 B18R2.65882 Oc1cccc(c1)CNCc2ccncc2Br 270004a_100020640021_100000188321 [0,2,0,0,0,0|2,0,0]=4 29829 B18R2.65882 Oc1cccc(c1)CNCc2ccncc2Cl 207a_100000743036_100011934409 [0,2,0,0,0,0|2,0,0]=4 29830 B18R2.65882 Oc1cccc(c1)CNCc2ccncc2Cl 2230a_100000743036_100000763264 [0,2,0,0,0,0|2,0,0]=4 29831 B18R2.65882 Oc1cccc(c1)CNCc2ccncc2Cl 270004a_100000743036_100011934409 [0,2,0,0,0,0|2,0,0]=4 29832 B18R2.65882 Oc1cccc(c1)CNCc2ccncc2F 207a_100011935246_100000188321 [0,2,0,0,0,0|2,0,0]=4 29833 B18R2.65882 Oc1cccc(c1)CNCc2ccncc2F 270004a_100011935246_100000188321 [0,2,0,0,0,0|2,0,0]=4 29834 B18R2.65882 Oc1cccc(c1)CNCc2ccncc2F 34a_100011935246_100011660834 [0,2,0,0,0,0|2,0,0]=4 29835 B18R2.65882 Oc1cccc(c1)CNCc2cnccc2Br 270004a_100000743036_100009816821 [0,2,0,0,0,0|2,0,0]=4 29836 B18R2.65882 Oc1cccc(c1)CNCc2cnccc2Cl 270004a_100000743036_100000050567 [0,2,0,0,0,0|2,0,0]=4 29837 B18R2.65882 Oc1cccc(c1)CNCc2ncccc2Br 207a_100000743036_100011934733 [0,2,0,0,0,0|2,0,0]=4 29838 B18R2.65882 Oc1cccc(c1)CNCc2ncccc2Br 2230a_100000743036_100025702911 [0,2,0,0,0,0|2,0,0]=4 29839 B18R2.65882 Oc1cccc(c1)CNCc2ncccc2Br 270004a_100000743036_100011934733 [0,2,0,0,0,0|2,0,0]=4 29840 B18R2.65882 Oc1cccc(c1)CNCc2ncccc2Br 270004a_100020591323_100000188321 [0,2,0,0,0,0|2,0,0]=4 29841 B18R2.65882 Oc1cccc(c1)CNCc2ncccc2Br 34a_100000743036_100025702911 [0,2,0,0,0,0|2,0,0]=4 29842 B18R2.65882 Oc1cccc(c1)CNCc2ncccc2Cl 207a_100000743036_100012001307 [0,2,0,0,0,0|2,0,0]=4 29843 B18R2.65882 Oc1cccc(c1)CNCc2ncccc2Cl 2230a_100000743036_100000099807 [0,2,0,0,0,0|2,0,0]=4 29844 B18R2.65882 Oc1cccc(c1)CNCc2ncccc2Cl 2230a_100015189233_100011660834 [0,2,0,0,0,0|2,0,0]=4 29845 B18R2.65882 Oc1cccc(c1)CNCc2ncccc2Cl 270004a_100000743036_100012001307 [0,2,0,0,0,0|2,0,0]=4 29846 B18R2.65882 Oc1cccc(c1)CNCc2ncccc2Cl 270004a_100015189233_100000188321 [0,2,0,0,0,0|2,0,0]=4 29847 B18R2.65882 Oc1cccc(c1)CNCc2ncccc2F 207a_100000743036_100011934734 [0,2,0,0,0,0|2,0,0]=4 29848 B18R2.65882 Oc1cccc(c1)CNCc2ncccc2F 2230a_100000743036_100000104219 [0,2,0,0,0,0|2,0,0]=4 29849 B18R2.65882 Oc1cccc(c1)CNCc2ncccc2F 270004a_100000690088_100000188321 [0,2,0,0,0,0|2,0,0]=4 29850 B18R2.65882 Oc1cccc(c1)CNCc2ncccc2F 270004a_100000743036_100011934734 [0,2,0,0,0,0|2,0,0]=4 29851 B18R2.65882 Oc1cccc(c1)CNCc2ncccc2F 34a_100000690088_100011660834 [0,2,0,0,0,0|2,0,0]=4 29852 B18R2.65882 Oc1cccc(c1)CNCc2ncccc2F 34a_100000743036_100000104219 [0,2,0,0,0,0|2,0,0]=4 29853 B18R2.65882 Oc1cccc(c1)CNCc2ncccc2O 34a_100000743036_200020655725 [0,2,0,0,0,0|2,0,0]=4 29854 B18R2.65882 Oc1cccc(c1)COCc2ccccc2Br 34a_100000756307_100011660834 [0,2,0,0,0,0|0,0,0]=2 29855 B18R2.65882 Oc1cccc(c1)COCc2ccccc2Br 7a_100000756307_100000084143 [0,2,0,0,0,0|0,0,0]=2 29856 B18R2.65882 Oc1cccc(c1)COCc2ccccc2Cl 34a_100000210847_100011660834 [0,2,0,0,0,0|0,0,0]=2 29857 B18R2.65882 Oc1cccc(c1)COCc2ccccc2Cl 7a_100000210847_100000084143 [0,2,0,0,0,0|0,0,0]=2 29858 B18R2.65882 Oc1cccc(c1)COCc2ccccc2F 34a_100000211962_100011660834 [0,2,0,0,0,0|0,0,0]=2 29859 B18R2.65882 Oc1cccc(c1)COCc2ccccc2F 7a_100000211962_100000084143 [0,2,0,0,0,0|0,0,0]=2 29860 B18R2.65882 Oc1cccc(c1)COCc2ccccc2I 34a_100000187465_100011660834 [0,2,0,0,0,0|0,0,0]=2 29861 B18R2.65882 Oc1cccc(c1)COCc2ccccc2I 7a_100000187465_100000084143 [0,2,0,0,0,0|0,0,0]=2 29862 B18R2.65882 Oc1cccc(c1)COCc2cccnc2Br 34a_100000719692_100011660834 [0,2,0,0,0,0|1,0,0]=3 29863 B18R2.65882 Oc1cccc(c1)COCc2cccnc2Br 7a_100000719692_100000084143 [0,2,0,0,0,0|1,0,0]=3 29864 B18R2.65882 Oc1cccc(c1)COCc2cccnc2Cl 34a_100000748726_100011660834 [0,2,0,0,0,0|1,0,0]=3 29865 B18R2.65882 Oc1cccc(c1)COCc2cccnc2Cl 7a_100000748726_100000084143 [0,2,0,0,0,0|1,0,0]=3 29866 B18R2.65882 Oc1cccc(c1)COCc2cccnc2F 34a_100000079888_100011660834 [0,2,0,0,0,0|1,0,0]=3 29867 B18R2.65882 Oc1cccc(c1)COCc2cccnc2F 7a_100000079888_100000084143 [0,2,0,0,0,0|1,0,0]=3 29868 B18R2.65882 Oc1cccc(c1)COCc2ccncc2F 34a_100012172863_100011660834 [0,2,0,0,0,0|1,0,0]=3 29869 B18R2.65882 Oc1cccc(c1)COCc2cnccc2Cl 34a_100000117392_100011660834 [0,2,0,0,0,0|1,0,0]=3 29870 B18R2.65882 Oc1cccc(c1)COCc2ncccc2Br 34a_100011996772_100011660834 [0,2,0,0,0,0|1,0,0]=3 29871 B18R2.65882 Oc1cccc(c1)COCc2ncccc2Cl 34a_100012002383_100011660834 [0,2,0,0,0,0|1,0,0]=3 29872 B18R2.65882 Oc1cccc(c1)COCc2ncccc2F 34a_100011934865_100011660834 [0,2,0,0,0,0|1,0,0]=3 29873 B18R2.65882 Oc1cccc(c1)COCc2nccnc2Cl 34a_100000057004_100011660834 [0,2,0,0,0,0|2,0,0]=4 29874 B18R2.65882 Oc1cccc(c1)CSCc2ccccc2Br 62a_100000184730_100011660834 [0,2,0,0,0,0|0,1,0]=3 29875 B18R2.65882 Oc1cccc(c1)CSCc2ccccc2Br 62a_100011660834_100000184730 [0,2,0,0,0,0|0,1,0]=3 29876 B18R2.65882 Oc1cccc(c1)CSCc2ccccc2Cl 62a_100000187162_100011660834 [0,2,0,0,0,0|0,1,0]=3 29877 B18R2.65882 Oc1cccc(c1)CSCc2ccccc2Cl 62a_100011660834_100000187162 [0,2,0,0,0,0|0,1,0]=3 29878 B18R2.65882 Oc1cccc(c1)CSCc2ccccc2F 62a_100000211605_100011660834 [0,2,0,0,0,0|0,1,0]=3 29879 B18R2.65882 Oc1cccc(c1)CSCc2ccccc2F 62a_100011660834_100000211605 [0,2,0,0,0,0|0,1,0]=3 29880 B18R2.65882 Oc1cccc(c1)CSCc2ccccc2I 62a_100011216222_100011660834 [0,2,0,0,0,0|0,1,0]=3 29881 B18R2.65882 Oc1cccc(c1)CSCc2ccccc2I 62a_100011660834_100011216222 [0,2,0,0,0,0|0,1,0]=3 29882 B18R2.65882 Oc1cccc(c1)CSCc2cccnc2Br 62a_100010140945_100011660834 [0,2,0,0,0,0|1,1,0]=4 29883 B18R2.65882 Oc1cccc(c1)CSCc2cccnc2Br 62a_100011660834_100010140945 [0,2,0,0,0,0|1,1,0]=4 29884 B18R2.65882 Oc1cccc(c1)CSCc2cccnc2Cl 62a_100000045678_100011660834 [0,2,0,0,0,0|1,1,0]=4 29885 B18R2.65882 Oc1cccc(c1)CSCc2cccnc2Cl 62a_100011660834_100000045678 [0,2,0,0,0,0|1,1,0]=4 29886 B18R2.65882 Oc1cccc(c1)CSCc2cccnc2F 62a_100000099810_100011660834 [0,2,0,0,0,0|1,1,0]=4 29887 B18R2.65882 Oc1cccc(c1)CSCc2cccnc2F 62a_100011660834_100000099810 [0,2,0,0,0,0|1,1,0]=4 29888 B18R2.65882 Oc1cccc(c1)CSCc2ccncc2Cl 62a_100000763264_100011660834 [0,2,0,0,0,0|1,1,0]=4 29889 B18R2.65882 Oc1cccc(c1)CSCc2ccncc2Cl 62a_100011660834_100000763264 [0,2,0,0,0,0|1,1,0]=4 29890 B18R2.65882 Oc1cccc(c1)CSCc2ncccc2Br 62a_100011660834_100025702911 [0,2,0,0,0,0|1,1,0]=4 29891 B18R2.65882 Oc1cccc(c1)CSCc2ncccc2Br 62a_100025702911_100011660834 [0,2,0,0,0,0|1,1,0]=4 29892 B18R2.65882 Oc1cccc(c1)CSCc2ncccc2Cl 62a_100000099807_100011660834 [0,2,0,0,0,0|1,1,0]=4 29893 B18R2.65882 Oc1cccc(c1)CSCc2ncccc2Cl 62a_100011660834_100000099807 [0,2,0,0,0,0|1,1,0]=4 29894 B18R2.65882 Oc1cccc(c1)CSCc2ncccc2F 62a_100000104219_100011660834 [0,2,0,0,0,0|1,1,0]=4 29895 B18R2.65882 Oc1cccc(c1)CSCc2ncccc2F 62a_100011660834_100000104219 [0,2,0,0,0,0|1,1,0]=4 29896 B18R2.65882 Oc1cccc(c1)CSCc2ncccc2O 62a_100011660834_200020655725 [0,2,0,0,0,0|1,1,0]=4 29897 B18R2.65882 Oc1cccc(c1)CSCc2ncccc2O 62a_200020655725_100011660834 [0,2,0,0,0,0|1,1,0]=4 29898 B18R2.65882 Oc1cccc(c1)NCCc2ccccc2Br 34a_100000210217_100012161201 [0,2,0,0,0,0|2,0,0]=4 29899 B18R2.65882 Oc1cccc(c1)NCCc2ccccc2Cl 34a_100000210217_100011713703 [0,2,0,0,0,0|2,0,0]=4 29900 B18R2.65882 Oc1cccc(c1)NCCc2ccccc2F 34a_100000210217_100000720011 [0,2,0,0,0,0|2,0,0]=4 29901 B18R2.65882 Oc1cccc(c1)NCCc2ccccc2O 34a_100000210217_100000722297 [0,2,0,0,0,0|2,0,0]=4 29902 B18R2.65882 Oc1cccc(c1)SCCc2ccccc2Br 62a_100012161201_100000211634 [0,2,0,0,0,0|2,0,0]=4 29903 B18R2.65882 Oc1cccc(c1)SCCc2ccccc2Cl 62a_100011713703_100000211634 [0,2,0,0,0,0|2,0,0]=4 29904 B18R2.65882 Oc1cccc(c1)SCCc2ccccc2F 62a_100011713696_100000211634 [0,2,0,0,0,0|2,0,0]=4 29905 B18R2.65882 Oc1cccc(c1)SCCc2ccccc2O 62a_100000722297_100000211634 [0,2,0,0,0,0|2,0,0]=4 29906 B18R2.65882 Oc1ccccc1CCNc2cccc(c2)Br 34a_100000210019_100000722297 [0,2,0,0,0,0|2,0,0]=4 29907 B18R2.65882 Oc1ccccc1CCNc2cccc(c2)Cl 34a_100000185859_100000722297 [0,2,0,0,0,0|2,0,0]=4 29908 B18R2.65882 Oc1ccccc1CCNc2cccc(c2)F 34a_100000210047_100000722297 [0,2,0,0,0,0|2,0,0]=4 29909 B18R2.65882 Oc1ccccc1CCNc2cccc(c2)I 34a_100000211102_100000722297 [0,2,0,0,0,0|2,0,0]=4 29910 B18R2.65882 Oc1ccccc1CCOc2cccc(c2)Br 34a_100000210342_100000722297 [0,2,0,0,0,0|2,0,0]=4 29911 B18R2.65882 Oc1ccccc1CCOc2cccc(c2)Br 7a_100000210342_100000722297 [0,2,0,0,0,0|2,0,0]=4 29912 B18R2.65882 Oc1ccccc1CCOc2cccc(c2)Cl 34a_100000210295_100000722297 [0,2,0,0,0,0|2,0,0]=4 29913 B18R2.65882 Oc1ccccc1CCOc2cccc(c2)Cl 7a_100000210295_100000722297 [0,2,0,0,0,0|2,0,0]=4 29914 B18R2.65882 Oc1ccccc1CCOc2cccc(c2)F 34a_100000210426_100000722297 [0,2,0,0,0,0|2,0,0]=4 29915 B18R2.65882 Oc1ccccc1CCOc2cccc(c2)F 7a_100000210426_100000722297 [0,2,0,0,0,0|2,0,0]=4 29916 B18R2.65882 Oc1ccccc1CCOc2cccc(c2)I 34a_100000211634_100000722297 [0,2,0,0,0,0|2,0,0]=4 29917 B18R2.65882 Oc1ccccc1CCOc2cccc(c2)I 7a_100000211634_100000722297 [0,2,0,0,0,0|2,0,0]=4 29918 B18R2.65882 Oc1ccccc1CCSc2cccc(c2)Br 62a_100000691529_100000722297 [0,2,0,0,0,0|2,0,0]=4 29919 B18R2.65882 Oc1ccccc1CCSc2cccc(c2)Br 62a_100000722297_100000691529 [0,2,0,0,0,0|2,0,0]=4 29920 B18R2.65882 Oc1ccccc1CCSc2cccc(c2)Cl 62a_100000699651_100000722297 [0,2,0,0,0,0|2,0,0]=4 29921 B18R2.65882 Oc1ccccc1CCSc2cccc(c2)Cl 62a_100000722297_100000699651 [0,2,0,0,0,0|2,0,0]=4 29922 B18R2.65882 Oc1ccccc1CCSc2cccc(c2)F 62a_100000685547_100000722297 [0,2,0,0,0,0|2,0,0]=4 29923 B18R2.65882 Oc1ccccc1CCSc2cccc(c2)F 62a_100000722297_100000685547 [0,2,0,0,0,0|2,0,0]=4 29924 B18R2.65882 Oc1ccccc1CCSc2cccc(c2)[S] 62a_100000722297_114929384022 [0,2,0,0,0,0|2,0,0]=4 29925 B18R2.65882 Oc1ccccc1CCSc2cccc(c2)[S] 62a_114929384022_100000722297 [0,2,0,0,0,0|2,0,0]=4 29926 B18R2.65882 Oc1ccccc1CNCc2cc(ccn2)Br 270004a_100000185550_100009818557 [0,2,0,0,0,0|2,0,0]=4 29927 B18R2.65882 Oc1ccccc1CNCc2cc(ccn2)Br 34a_100000185550_100010173614 [0,2,0,0,0,0|2,0,0]=4 29928 B18R2.65882 Oc1ccccc1CNCc2cc(ccn2)Cl 270004a_100000185550_100011998288 [0,2,0,0,0,0|2,0,0]=4 29929 B18R2.65882 Oc1ccccc1CNCc2cc(ccn2)Cl 34a_100000185550_100016988179 [0,2,0,0,0,0|2,0,0]=4 29930 B18R2.65882 Oc1ccccc1CNCc2cccc(c2)Br 207a_100000185550_100000210085 [0,2,0,0,0,0|1,0,0]=3 29931 B18R2.65882 Oc1ccccc1CNCc2cccc(c2)Br 270004a_100000185550_100000210085 [0,2,0,0,0,0|1,0,0]=3 29932 B18R2.65882 Oc1ccccc1CNCc2cccc(c2)Br 34a_100000185550_100000698116 [0,2,0,0,0,0|1,0,0]=3 29933 B18R2.65882 Oc1ccccc1CNCc2cccc(c2)Cl 207a_100000185550_100000210801 [0,2,0,0,0,0|1,0,0]=3 29934 B18R2.65882 Oc1ccccc1CNCc2cccc(c2)Cl 270004a_100000185550_100000210801 [0,2,0,0,0,0|1,0,0]=3 29935 B18R2.65882 Oc1ccccc1CNCc2cccc(c2)Cl 34a_100000185550_100000187163 [0,2,0,0,0,0|1,0,0]=3 29936 B18R2.65882 Oc1ccccc1CNCc2cccc(c2)F 207a_100000185550_100000210812 [0,2,0,0,0,0|1,0,0]=3 29937 B18R2.65882 Oc1ccccc1CNCc2cccc(c2)F 270004a_100000185550_100000210812 [0,2,0,0,0,0|1,0,0]=3 29938 B18R2.65882 Oc1ccccc1CNCc2cccc(c2)F 34a_100000185550_100000187166 [0,2,0,0,0,0|1,0,0]=3 29939 B18R2.65882 Oc1ccccc1CNCc2cccc(c2)I 207a_100000185550_100000014684 [0,2,0,0,0,0|1,0,0]=3 29940 B18R2.65882 Oc1ccccc1CNCc2cccc(c2)I 270004a_100000185550_100000014684 [0,2,0,0,0,0|1,0,0]=3 29941 B18R2.65882 Oc1ccccc1CNCc2cccc(c2)I 34a_100000185550_100011218688 [0,2,0,0,0,0|1,0,0]=3 29942 B18R2.65882 Oc1ccccc1CNCc2cccc(n2)Br 270004a_100000185550_100000688028 [0,2,0,0,0,0|2,0,0]=4 29943 B18R2.65882 Oc1ccccc1CNCc2cccc(n2)Br 34a_100000185550_100009889011 [0,2,0,0,0,0|2,0,0]=4 29944 B18R2.65882 Oc1ccccc1CNCc2cccc(n2)Cl 270004a_100000185550_100011361687 [0,2,0,0,0,0|2,0,0]=4 29945 B18R2.65882 Oc1ccccc1CNCc2cccc(n2)Cl 34a_100000185550_100000086093 [0,2,0,0,0,0|2,0,0]=4 29946 B18R2.65882 Oc1ccccc1CNCc2cccc(n2)F 270004a_100000185550_100000050434 [0,2,0,0,0,0|2,0,0]=4 29947 B18R2.65882 Oc1ccccc1CNCc2cccc(n2)F 34a_100000185550_100009819644 [0,2,0,0,0,0|2,0,0]=4 29948 B18R2.65882 Oc1ccccc1CNCc2ccnc(c2)Br 270004a_100000185550_100009814634 [0,2,0,0,0,0|2,0,0]=4 29949 B18R2.65882 Oc1ccccc1CNCc2ccnc(c2)Br 34a_100000185550_100010243470 [0,2,0,0,0,0|2,0,0]=4 29950 B18R2.65882 Oc1ccccc1CNCc2ccnc(c2)Cl 270004a_100000185550_100011290808 [0,2,0,0,0,0|2,0,0]=4 29951 B18R2.65882 Oc1ccccc1CNCc2ccnc(c2)Cl 34a_100000185550_100000764220 [0,2,0,0,0,0|2,0,0]=4 29952 B18R2.65882 Oc1ccccc1CNCc2ccnc(c2)F 270004a_100000185550_100000068331 [0,2,0,0,0,0|2,0,0]=4 29953 B18R2.65882 Oc1ccccc1CNCc2cncc(c2)Br 207a_100000185550_100000687066 [0,2,0,0,0,0|2,0,0]=4 29954 B18R2.65882 Oc1ccccc1CNCc2cncc(c2)Br 270004a_100000185550_100000687066 [0,2,0,0,0,0|2,0,0]=4 29955 B18R2.65882 Oc1ccccc1CNCc2cncc(c2)Br 34a_100000185550_100000738771 [0,2,0,0,0,0|2,0,0]=4 29956 B18R2.65882 Oc1ccccc1CNCc2cncc(c2)Cl 207a_100000185550_100000088910 [0,2,0,0,0,0|2,0,0]=4 29957 B18R2.65882 Oc1ccccc1CNCc2cncc(c2)Cl 270004a_100000185550_100000088910 [0,2,0,0,0,0|2,0,0]=4 29958 B18R2.65882 Oc1ccccc1CNCc2cncc(c2)Cl 34a_100000185550_100016992070 [0,2,0,0,0,0|2,0,0]=4 29959 B18R2.65882 Oc1ccccc1CNCc2cncc(c2)F 207a_100000185550_100011361476 [0,2,0,0,0,0|2,0,0]=4 29960 B18R2.65882 Oc1ccccc1CNCc2cncc(c2)F 270004a_100000185550_100011361476 [0,2,0,0,0,0|2,0,0]=4 29961 B18R2.65882 Oc1ccccc1CNCc2cncc(c2)F 34a_100000185550_100000725299 [0,2,0,0,0,0|2,0,0]=4 29962 B18R2.65882 Oc1ccccc1NCCc2cccc(c2)Br 34a_100000185747_100011740638 [0,2,0,0,0,0|2,0,0]=4 29963 B18R2.65882 Oc1ccccc1NCCc2cccc(c2)Cl 34a_100000185747_100011713710 [0,2,0,0,0,0|2,0,0]=4 29964 B18R2.65882 Oc1ccccc1NCCc2cccc(c2)F 34a_100000185747_100011217235 [0,2,0,0,0,0|2,0,0]=4 29965 B18R2.65882 Oc1ccccc1SCCc2cccc(c2)Br 62a_100000739446_100011740638 [0,2,0,0,0,0|2,0,0]=4 29966 B18R2.65882 Oc1ccccc1SCCc2cccc(c2)Br 62a_100011740638_100000739446 [0,2,0,0,0,0|2,0,0]=4 29967 B18R2.65882 Oc1ccccc1SCCc2cccc(c2)Cl 62a_100000739446_100011713710 [0,2,0,0,0,0|2,0,0]=4 29968 B18R2.65882 Oc1ccccc1SCCc2cccc(c2)Cl 62a_100011713710_100000739446 [0,2,0,0,0,0|2,0,0]=4 29969 B18R2.65882 Oc1ccccc1SCCc2cccc(c2)F 62a_100000739446_100011217235 [0,2,0,0,0,0|2,0,0]=4 29970 B18R2.65882 Oc1ccccc1SCCc2cccc(c2)F 62a_100011217235_100000739446 [0,2,0,0,0,0|2,0,0]=4 29971 B18R2.65882 Oc1cccnc1CNCc2cccc(c2)Br 34a_100000174977_200020655725 [0,2,0,0,0,0|2,0,0]=4 29972 B18R2.65882 Oc1cccnc1CNCc2cccc(c2)Cl 34a_100000174878_200020655725 [0,2,0,0,0,0|2,0,0]=4 29973 B18R2.65882 Oc1cccnc1CNCc2cccc(c2)F 34a_100000174948_200020655725 [0,2,0,0,0,0|2,0,0]=4 29974 B18R2.65882 Oc1cccnc1CNCc2cccc(c2)I 34a_100000106179_200020655725 [0,2,0,0,0,0|2,0,0]=4 29975 B18R2.65882 Oc1cccnc1COCc2cc(ccn2)Cl 34a_100000748867_200020655725 [0,2,0,0,0,0|2,0,0]=4 29976 B18R2.65882 Oc1cccnc1COCc2cccc(c2)Br 34a_100000687537_200020655725 [0,2,0,0,0,0|1,0,0]=3 29977 B18R2.65882 Oc1cccnc1COCc2cccc(c2)Br 7a_100000687537_200020655725 [0,2,0,0,0,0|1,0,0]=3 29978 B18R2.65882 Oc1cccnc1COCc2cccc(c2)Cl 34a_100000241301_200020655725 [0,2,0,0,0,0|1,0,0]=3 29979 B18R2.65882 Oc1cccnc1COCc2cccc(c2)Cl 7a_100000241301_200020655725 [0,2,0,0,0,0|1,0,0]=3 29980 B18R2.65882 Oc1cccnc1COCc2cccc(c2)F 34a_100000210976_200020655725 [0,2,0,0,0,0|1,0,0]=3 29981 B18R2.65882 Oc1cccnc1COCc2cccc(c2)F 7a_100000210976_200020655725 [0,2,0,0,0,0|1,0,0]=3 29982 B18R2.65882 Oc1cccnc1COCc2cccc(c2)I 34a_100011215336_200020655725 [0,2,0,0,0,0|1,0,0]=3 29983 B18R2.65882 Oc1cccnc1COCc2cccc(c2)I 7a_100011215336_200020655725 [0,2,0,0,0,0|1,0,0]=3 29984 B18R2.65882 Oc1cccnc1COCc2cccc(n2)Br 34a_100000694195_200020655725 [0,2,0,0,0,0|2,0,0]=4 29985 B18R2.65882 Oc1cccnc1COCc2cccc(n2)Cl 34a_100011998359_200020655725 [0,2,0,0,0,0|2,0,0]=4 29986 B18R2.65882 Oc1cccnc1COCc2cccc(n2)F 34a_100000086748_200020655725 [0,2,0,0,0,0|2,0,0]=4 29987 B18R2.65882 Oc1cccnc1COCc2ccnc(c2)Br 34a_100009814636_200020655725 [0,2,0,0,0,0|2,0,0]=4 29988 B18R2.65882 Oc1cccnc1COCc2ccnc(c2)Br 7a_100009814636_200020655725 [0,2,0,0,0,0|2,0,0]=4 29989 B18R2.65882 Oc1cccnc1COCc2ccnc(c2)Cl 34a_100000748751_200020655725 [0,2,0,0,0,0|2,0,0]=4 29990 B18R2.65882 Oc1cccnc1COCc2ccnc(c2)F 34a_100000082451_200020655725 [0,2,0,0,0,0|2,0,0]=4 29991 B18R2.65882 Oc1cccnc1COCc2cncc(c2)Br 34a_100011259137_200020655725 [0,2,0,0,0,0|2,0,0]=4 29992 B18R2.65882 Oc1cccnc1COCc2cncc(c2)Br 7a_100011259137_200020655725 [0,2,0,0,0,0|2,0,0]=4 29993 B18R2.65882 Oc1cccnc1COCc2cncc(c2)Cl 34a_100000092867_200020655725 [0,2,0,0,0,0|2,0,0]=4 29994 B18R2.65882 Oc1cccnc1COCc2cncc(c2)Cl 7a_100000092867_200020655725 [0,2,0,0,0,0|2,0,0]=4 29995 B18R2.65882 Oc1cccnc1COCc2cncc(c2)F 34a_100011962875_200020655725 [0,2,0,0,0,0|2,0,0]=4 29996 B18R2.65882 Oc1cccnc1COCc2cncc(c2)F 7a_100011962875_200020655725 [0,2,0,0,0,0|2,0,0]=4 29997 B18R2.65882 Oc1cccnc1CSCc2cccc(c2)Br 62a_100000211773_200020655725 [0,2,0,0,0,0|1,1,0]=4 29998 B18R2.65882 Oc1cccnc1CSCc2cccc(c2)Br 62a_200020655725_100000211773 [0,2,0,0,0,0|1,1,0]=4 29999 B18R2.65882 Oc1cccnc1CSCc2cccc(c2)Cl 62a_100000187163_200020655725 [0,2,0,0,0,0|1,1,0]=4 30000 B18R2.65882 Oc1cccnc1CSCc2cccc(c2)Cl 62a_200020655725_100000187163 [0,2,0,0,0,0|1,1,0]=4 30001 B18R2.65882 Oc1cccnc1CSCc2cccc(c2)F 62a_100000230114_200020655725 [0,2,0,0,0,0|1,1,0]=4 30002 B18R2.65882 Oc1cccnc1CSCc2cccc(c2)F 62a_200020655725_100000230114 [0,2,0,0,0,0|1,1,0]=4 30003 B18R2.65882 Oc1cccnc1CSCc2cccc(c2)I 62a_100011218688_200020655725 [0,2,0,0,0,0|1,1,0]=4 30004 B18R2.65882 Oc1cccnc1CSCc2cccc(c2)I 62a_200020655725_100011218688 [0,2,0,0,0,0|1,1,0]=4 30005 B18R2.65882 Oc1cncc(c1)CNCc2ccccc2Br 207a_100000689332_100012187055 [0,2,0,0,0,0|2,0,0]=4 30006 B18R2.65882 Oc1cncc(c1)CNCc2ccccc2Br 270004a_100000689332_100012187055 [0,2,0,0,0,0|2,0,0]=4 30007 B18R2.65882 Oc1cncc(c1)CNCc2ccccc2Cl 207a_100000174879_100012187055 [0,2,0,0,0,0|2,0,0]=4 30008 B18R2.65882 Oc1cncc(c1)CNCc2ccccc2Cl 270004a_100000174879_100012187055 [0,2,0,0,0,0|2,0,0]=4 30009 B18R2.65882 Oc1cncc(c1)CNCc2ccccc2F 207a_100000174869_100012187055 [0,2,0,0,0,0|2,0,0]=4 30010 B18R2.65882 Oc1cncc(c1)CNCc2ccccc2F 270004a_100000174869_100012187055 [0,2,0,0,0,0|2,0,0]=4 30011 B18R2.65882 Oc1cncc(c1)CNCc2ccccc2I 207a_100015347259_100012187055 [0,2,0,0,0,0|2,0,0]=4 30012 B18R2.65882 Oc1cncc(c1)CNCc2ccccc2I 270004a_100015347259_100012187055 [0,2,0,0,0,0|2,0,0]=4 30013 B18R2.65882 Oc1cncc(c1)CNCc2ccccc2O 207a_100000185550_100012187055 [0,2,0,0,0,0|2,0,0]=4 30014 B18R2.65882 Oc1cncc(c1)CNCc2ccccc2O 270004a_100000185550_100012187055 [0,2,0,0,0,0|2,0,0]=4 30015 B18R2.65882 Oc1ncccc1CNCc2cccc(c2)Br 207a_100000174977_100011998315 [0,2,0,0,0,0|2,0,0]=4 30016 B18R2.65882 Oc1ncccc1CNCc2cccc(c2)Br 270004a_100000174977_100011998315 [0,2,0,0,0,0|2,0,0]=4 30017 B18R2.65882 Oc1ncccc1CNCc2cccc(c2)Cl 207a_100000174878_100011998315 [0,2,0,0,0,0|2,0,0]=4 30018 B18R2.65882 Oc1ncccc1CNCc2cccc(c2)Cl 270004a_100000174878_100011998315 [0,2,0,0,0,0|2,0,0]=4 30019 B18R2.65882 Oc1ncccc1CNCc2cccc(c2)F 207a_100000174948_100011998315 [0,2,0,0,0,0|2,0,0]=4 30020 B18R2.65882 Oc1ncccc1CNCc2cccc(c2)F 270004a_100000174948_100011998315 [0,2,0,0,0,0|2,0,0]=4 30021 B18R2.65882 Oc1ncccc1CNCc2cccc(c2)I 207a_100000106179_100011998315 [0,2,0,0,0,0|2,0,0]=4 30022 B18R2.65882 Oc1ncccc1CNCc2cccc(c2)I 270004a_100000106179_100011998315 [0,2,0,0,0,0|2,0,0]=4 30023 B18R2.65882 [O-][n+]1cccc(c1)COCc2ccccc2Br 34a_100000037817_100000184730 [0,2,0,0,0,0|1,0,0]=3 30024 B18R2.65882 [O-][n+]1cccc(c1)COCc2ccccc2Br 7a_100000037817_100000184730 [0,2,0,0,0,0|1,0,0]=3 30025 B18R2.65882 [O-][n+]1cccc(c1)COCc2ccccc2Cl 34a_100000037817_100000187162 [0,2,0,0,0,0|1,0,0]=3 30026 B18R2.65882 [O-][n+]1cccc(c1)COCc2ccccc2Cl 7a_100000037817_100000187162 [0,2,0,0,0,0|1,0,0]=3 30027 B18R2.65882 [O-][n+]1cccc(c1)COCc2ccccc2F 34a_100000037817_100000211605 [0,2,0,0,0,0|1,0,0]=3 30028 B18R2.65882 [O-][n+]1cccc(c1)COCc2ccccc2F 7a_100000037817_100000211605 [0,2,0,0,0,0|1,0,0]=3 30029 B18R2.65882 [O-][n+]1cccc(c1)COCc2ccccc2I 34a_100000037817_100011215278 [0,2,0,0,0,0|1,0,0]=3 30030 B18R2.65882 [O-][n+]1cccc(c1)COCc2ccccc2I 7a_100000037817_100011215278 [0,2,0,0,0,0|1,0,0]=3 30031 B18R2.65882 [O-][n+]1cccc(c1)COCc2cccnc2Br 34a_100000037817_100010140945 [0,2,0,0,0,0|2,0,0]=4 30032 B18R2.65882 [O-][n+]1cccc(c1)COCc2cccnc2Br 7a_100000037817_100010140945 [0,2,0,0,0,0|2,0,0]=4 30033 B18R2.65882 [O-][n+]1cccc(c1)COCc2cccnc2Cl 34a_100000037817_100000045678 [0,2,0,0,0,0|2,0,0]=4 30034 B18R2.65882 [O-][n+]1cccc(c1)COCc2cccnc2Cl 7a_100000037817_100000045678 [0,2,0,0,0,0|2,0,0]=4 30035 B18R2.65882 [O-][n+]1cccc(c1)COCc2cccnc2F 34a_100000037817_100000099810 [0,2,0,0,0,0|2,0,0]=4 30036 B18R2.65882 [O-][n+]1cccc(c1)COCc2cccnc2F 7a_100000037817_100000099810 [0,2,0,0,0,0|2,0,0]=4 30037 B18R2.65882 [O-][n+]1cccc(c1)COCc2ccncc2Cl 7a_100000037817_100000763264 [0,2,0,0,0,0|2,0,0]=4 30038 B18R2.65882 [O-][n+]1cccc(c1)COCc2ncccc2Br 34a_100000037817_100025702911 [0,2,0,0,0,0|2,0,0]=4 30039 B18R2.65882 [O-][n+]1cccc(c1)COCc2ncccc2Br 7a_100000037817_100025702911 [0,2,0,0,0,0|2,0,0]=4 30040 B18R2.65882 [O-][n+]1cccc(c1)COCc2ncccc2Cl 7a_100000037817_100000099807 [0,2,0,0,0,0|2,0,0]=4 30041 B18R2.65882 [O-][n+]1cccc(c1)COCc2ncccc2F 34a_100000037817_100000104219 [0,2,0,0,0,0|2,0,0]=4 30042 B18R2.65882 [O-][n+]1cccc(c1)COCc2ncccc2F 7a_100000037817_100000104219 [0,2,0,0,0,0|2,0,0]=4 30043 B18R2.65882 [O-][n+]1cccc(c1)COCc2ncccc2O 34a_100000037817_200020655725 [0,2,0,0,0,0|2,0,0]=4 30044 B18R2.65882 [O-][n+]1cccc(c1)COCc2ncccc2O 7a_100000037817_200020655725 [0,2,0,0,0,0|2,0,0]=4 30045 B18R2.65882 [S]c1cccc(c1)SCCc2ccccc2Br 62a_100012161201_114929384022 [0,2,0,0,0,0|2,0,0]=4 30046 B18R2.65882 [S]c1cccc(c1)SCCc2ccccc2Br 62a_114929384022_100012161201 [0,2,0,0,0,0|2,0,0]=4 30047 B18R2.65882 [S]c1cccc(c1)SCCc2ccccc2Cl 62a_100011713703_114929384022 [0,2,0,0,0,0|2,0,0]=4 30048 B18R2.65882 [S]c1cccc(c1)SCCc2ccccc2Cl 62a_114929384022_100011713703 [0,2,0,0,0,0|2,0,0]=4 30049 B18R2.1508 BrCc1cccc(c1)COCc2ccccc2 34a_100010188025_100015291786 [0,2,0,0,0,0|0,0,0]=2 30050 B18R2.1508 BrCc1cccc(c1)COCc2ccccc2 7a_100010188025_100000211182 [0,2,0,0,0,0|0,0,0]=2 30051 B18R2.1508 BrCc1cccc(c1)COCc2ccccn2 34a_100010188025_100000721315 [0,2,0,0,0,0|1,0,0]=3 30052 B18R2.1508 BrCc1cccc(c1)COCc2ccccn2 7a_100010188025_100000721315 [0,2,0,0,0,0|1,0,0]=3 30053 B18R2.1508 BrCc1cccc(c1)COCc2cccnc2 34a_100010188025_100000733263 [0,2,0,0,0,0|1,0,0]=3 30054 B18R2.1508 BrCc1cccc(c1)COCc2cccnc2 7a_100010188025_100000741622 [0,2,0,0,0,0|1,0,0]=3 30055 B18R2.1508 BrCc1cccc(c1)COCc2cccnn2 34a_100010188025_100016990269 [0,2,0,0,0,0|2,0,0]=4 30056 B18R2.1508 BrCc1cccc(c1)COCc2cccnn2 7a_100010188025_100016990269 [0,2,0,0,0,0|2,0,0]=4 30057 B18R2.1508 BrCc1cccc(c1)COCc2ccncc2 7a_100010188025_100015193705 [0,2,0,0,0,0|1,0,0]=3 30058 B18R2.1508 BrCc1cccc(c1)COCc2cnccn2 34a_100010188025_100016995436 [0,2,0,0,0,0|2,0,0]=4 30059 B18R2.1508 BrCc1cccc(c1)COCc2cnccn2 7a_100010188025_100016995436 [0,2,0,0,0,0|2,0,0]=4 30060 B18R2.1508 BrCc1cccc(c1)COCc2cncnc2 34a_100010188025_100015196519 [0,2,0,0,0,0|2,0,0]=4 30061 B18R2.1508 BrCc1cccc(c1)COCc2cncnc2 7a_100010188025_100015196519 [0,2,0,0,0,0|2,0,0]=4 30062 B18R2.1508 BrCc1cccc(c1)COCc2ncccn2 34a_100010188025_100000703007 [0,2,0,0,0,0|2,0,0]=4 30063 B18R2.1508 BrCc1cccc(c1)COCc2ncccn2 7a_100010188025_100000703007 [0,2,0,0,0,0|2,0,0]=4 30064 B18R2.1508 BrCc1cccc(c1)OCCc2ccccc2 34a_100011660834_100000765856 [0,2,0,0,0,0|2,0,0]=4 30065 B18R2.1508 BrCc1cccc(c1)OCCc2ccccc2 7a_100011660834_100000765856 [0,2,0,0,0,0|2,0,0]=4 30066 B18R2.1508 C#Cc1cccc(c1)CNCc2ccccc2 207a_100015324214_100011361529 [0,2,0,0,0,0|1,0,0]=3 30067 B18R2.1508 C#Cc1cccc(c1)CNCc2cccnc2 207a_100000210453_100011361529 [0,2,0,0,0,0|2,0,0]=4 30068 B18R2.1508 C#Cc1cccc(c1)COCc2ccccc2 34a_100010272118_100015291786 [0,2,0,0,0,0|0,0,0]=2 30069 B18R2.1508 C#Cc1cccc(c1)COCc2ccccc2 7a_100010272118_100000211182 [0,2,0,0,0,0|0,0,0]=2 30070 B18R2.1508 C#Cc1cccc(c1)COCc2ccccn2 34a_100010272118_100000721315 [0,2,0,0,0,0|1,0,0]=3 30071 B18R2.1508 C#Cc1cccc(c1)COCc2ccccn2 7a_100010272118_100000721315 [0,2,0,0,0,0|1,0,0]=3 30072 B18R2.1508 C#Cc1cccc(c1)COCc2cccnc2 34a_100010272118_100000733263 [0,2,0,0,0,0|1,0,0]=3 30073 B18R2.1508 C#Cc1cccc(c1)COCc2cccnc2 7a_100010272118_100000741622 [0,2,0,0,0,0|1,0,0]=3 30074 B18R2.1508 C#Cc1cccc(c1)COCc2cccnn2 34a_100010272118_100016990269 [0,2,0,0,0,0|2,0,0]=4 30075 B18R2.1508 C#Cc1cccc(c1)COCc2cccnn2 7a_100010272118_100016990269 [0,2,0,0,0,0|2,0,0]=4 30076 B18R2.1508 C#Cc1cccc(c1)COCc2ccncc2 7a_100010272118_100015193705 [0,2,0,0,0,0|1,0,0]=3 30077 B18R2.1508 C#Cc1cccc(c1)COCc2cnccn2 34a_100010272118_100016995436 [0,2,0,0,0,0|2,0,0]=4 30078 B18R2.1508 C#Cc1cccc(c1)COCc2cnccn2 7a_100010272118_100016995436 [0,2,0,0,0,0|2,0,0]=4 30079 B18R2.1508 C#Cc1cccc(c1)COCc2cncnc2 34a_100010272118_100015196519 [0,2,0,0,0,0|2,0,0]=4 30080 B18R2.1508 C#Cc1cccc(c1)COCc2cncnc2 7a_100010272118_100015196519 [0,2,0,0,0,0|2,0,0]=4 30081 B18R2.1508 C#Cc1cccc(c1)COCc2ncccn2 34a_100010272118_100000703007 [0,2,0,0,0,0|2,0,0]=4 30082 B18R2.1508 C#Cc1cccc(c1)COCc2ncccn2 7a_100010272118_100000703007 [0,2,0,0,0,0|2,0,0]=4 30083 B18R2.1508 C#Cc1cccc(c1)NCCc2ccccc2 2230a_100000735509_100000765856 [0,2,0,0,0,0|2,0,0]=4 30084 B18R2.1508 C#Cc1cccc(c1)NCCc2ccccc2 34a_100000735509_100000765856 [0,2,0,0,0,0|2,0,0]=4 30085 B18R2.1508 C#Cc1cccc(c1)OCCc2ccccc2 34a_100011216014_100000765856 [0,2,0,0,0,0|2,0,0]=4 30086 B18R2.1508 C#Cc1cccc(c1)OCCc2ccccc2 7a_100011216014_100000765856 [0,2,0,0,0,0|2,0,0]=4 30087 B18R2.1508 C#Cc1cncc(c1)CNCc2ccccc2 270004a_100015324214_200012002314 [0,2,0,0,0,0|2,0,0]=4 30088 B18R2.1508 C=Cc1cccc(c1)CNCc2ccccc2 270004a_100015324214_100011218069 [0,2,0,0,0,0|1,0,0]=3 30089 B18R2.1508 C=Cc1cccc(c1)CNCc2ccccn2 270004a_100000210449_100011218069 [0,2,0,0,0,0|2,0,0]=4 30090 B18R2.1508 C=Cc1cccc(c1)CNCc2cccnc2 270004a_100000210453_100011218069 [0,2,0,0,0,0|2,0,0]=4 30091 B18R2.1508 C=Cc1cccc(c1)NCCc2ccccc2 34a_100011827668_100000765856 [0,2,0,0,0,0|2,0,0]=4 30092 B18R2.1508 C=Cc1cccc(c1)OCCc2ccccc2 34a_100011309434_100000765856 [0,2,0,0,0,0|2,0,0]=4 30093 B18R2.1508 C=Cc1cccc(c1)OCCc2ccccc2 7a_100011309434_100000765856 [0,2,0,0,0,0|2,0,0]=4 30094 B18R2.1508 C=Cc1cccc(c1)SCCc2ccccc2 62a_100000765856_100011215241 [0,2,0,0,0,0|2,0,0]=4 30095 B18R2.1508 C=Cc1cccc(c1)SCCc2ccccc2 62a_100011215241_100011218657 [0,2,0,0,0,0|2,0,0]=4 30096 B18R2.1508 CCc1cccc(c1)C=CCc2ccccc2 271570a_200016263579_100000684523 [0,2,0,0,0,0|1,0,1]=4 30097 B18R2.1508 CCc1cccc(c1)CNCc2ccccc2 207a_100015324214_100011999841 [0,2,0,0,0,0|1,0,0]=3 30098 B18R2.1508 CCc1cccc(c1)CNCc2ccccc2 270004a_100015324214_100011999841 [0,2,0,0,0,0|1,0,0]=3 30099 B18R2.1508 CCc1cccc(c1)CNCc2ccccn2 270004a_100000210449_100011999841 [0,2,0,0,0,0|2,0,0]=4 30100 B18R2.1508 CCc1cccc(c1)CNCc2cccnc2 207a_100000210453_100011999841 [0,2,0,0,0,0|2,0,0]=4 30101 B18R2.1508 CCc1cccc(c1)CNCc2cccnc2 270004a_100000210453_100011999841 [0,2,0,0,0,0|2,0,0]=4 30102 B18R2.1508 CCc1cccc(c1)NCCc2ccccc2 2230a_100000211250_100000765856 [0,2,0,0,0,0|2,0,0]=4 30103 B18R2.1508 CCc1cccc(c1)NCCc2ccccc2 34a_100000211250_100000765856 [0,2,0,0,0,0|2,0,0]=4 30104 B18R2.1508 CCc1cccc(c1)NCCc2ccccc2 7a_100000211250_100000765856 [0,2,0,0,0,0|2,0,0]=4 30105 B18R2.1508 CCc1cccc(c1)OCCc2ccccc2 34a_100000211550_100000765856 [0,2,0,0,0,0|2,0,0]=4 30106 B18R2.1508 CCc1cccc(c1)OCCc2ccccc2 7a_100000211550_100000765856 [0,2,0,0,0,0|2,0,0]=4 30107 B18R2.1508 CCc1cccc(c1)SCCc2ccccc2 62a_100000765856_100011263222 [0,2,0,0,0,0|2,0,0]=4 30108 B18R2.1508 CCc1cccc(c1)SCCc2ccccc2 62a_100011263222_100011218657 [0,2,0,0,0,0|2,0,0]=4 30109 B18R2.1508 CNc1cccc(c1)C=CCc2ccccc2 271570a_200016263579_100000219648 [0,2,0,0,0,0|1,0,1]=4 30110 B18R2.1508 CNc1cccc(c1)OCCc2ccccc2 34a_100000756613_100000765856 [0,2,0,0,0,0|2,0,0]=4 30111 B18R2.1508 CNc1cccc(c1)OCCc2ccccc2 7a_100000756613_100000765856 [0,2,0,0,0,0|2,0,0]=4 30112 B18R2.1508 CNc1cccc(c1)SCCc2ccccc2 62a_100000219648_100011218657 [0,2,0,0,0,0|2,0,0]=4 30113 B18R2.1508 CNc1cccc(c1)SCCc2ccccc2 62a_100000765856_100000219648 [0,2,0,0,0,0|2,0,0]=4 30114 B18R2.1508 COc1cc(ccn1)CNCc2ccccc2 207a_100015324214_100000050969 [0,2,0,0,0,0|2,0,0]=4 30115 B18R2.1508 COc1cc(ccn1)CNCc2ccccc2 207a_100102525109_100015611070 [0,2,0,0,0,0|2,0,0]=4 30116 B18R2.1508 COc1cc(ccn1)CNCc2ccccc2 2230a_100015324214_100103152439 [0,2,0,0,0,0|2,0,0]=4 30117 B18R2.1508 COc1cc(ccn1)CNCc2ccccc2 270004a_100015324214_100000050969 [0,2,0,0,0,0|2,0,0]=4 30118 B18R2.1508 COc1cc(ccn1)CNCc2ccccc2 270004a_100102525109_100015611070 [0,2,0,0,0,0|2,0,0]=4 30119 B18R2.1508 COc1cc(ccn1)CNCc2ccccc2 34a_100015324214_100103152439 [0,2,0,0,0,0|2,0,0]=4 30120 B18R2.1508 COc1cc(ccn1)COCc2ccccc2 34a_100000210790_100103152439 [0,2,0,0,0,0|1,0,0]=3 30121 B18R2.1508 COc1cc(ccn1)COCc2ccccc2 7a_100000210790_100103152439 [0,2,0,0,0,0|1,0,0]=3 30122 B18R2.1508 COc1cc(ccn1)CSCc2ccccc2 62a_100000211182_100103152439 [0,2,0,0,0,0|1,1,0]=4 30123 B18R2.1508 COc1cc(ccn1)CSCc2ccccc2 62a_100103152439_100015291786 [0,2,0,0,0,0|1,1,0]=4 30124 B18R2.1508 COc1cccc(c1)C=CCc2ccccc2 271570a_200016263579_100000170001 [0,2,0,0,0,0|1,0,1]=4 30125 B18R2.1508 COc1cccc(c1)CCNc2ccccc2 34a_100000106764_100011713679 [0,2,0,0,0,0|2,0,0]=4 30126 B18R2.1508 COc1cccc(c1)CCOc2ccccc2 34a_100000210340_100011713679 [0,2,0,0,0,0|2,0,0]=4 30127 B18R2.1508 COc1cccc(c1)CCOc2ccccc2 7a_100000210340_100011713679 [0,2,0,0,0,0|2,0,0]=4 30128 B18R2.1508 COc1cccc(c1)CCSc2ccccc2 62a_100000719477_100011713679 [0,2,0,0,0,0|2,0,0]=4 30129 B18R2.1508 COc1cccc(c1)CCSc2ccccc2 62a_100011713679_100000041952 [0,2,0,0,0,0|2,0,0]=4 30130 B18R2.1508 COc1cccc(c1)CNCc2ccccc2 207a_100000174954_100015611070 [0,2,0,0,0,0|1,0,0]=3 30131 B18R2.1508 COc1cccc(c1)CNCc2ccccc2 207a_100015324214_100000170238 [0,2,0,0,0,0|1,0,0]=3 30132 B18R2.1508 COc1cccc(c1)CNCc2ccccc2 2230a_100000174954_100015291786 [0,2,0,0,0,0|1,0,0]=3 30133 B18R2.1508 COc1cccc(c1)CNCc2ccccc2 2230a_100015324214_100000211672 [0,2,0,0,0,0|1,0,0]=3 30134 B18R2.1508 COc1cccc(c1)CNCc2ccccc2 270004a_100000174954_100015611070 [0,2,0,0,0,0|1,0,0]=3 30135 B18R2.1508 COc1cccc(c1)CNCc2ccccc2 270004a_100015324214_100000170238 [0,2,0,0,0,0|1,0,0]=3 30136 B18R2.1508 COc1cccc(c1)CNCc2ccccc2 34a_100000174954_100015291786 [0,2,0,0,0,0|1,0,0]=3 30137 B18R2.1508 COc1cccc(c1)CNCc2ccccc2 34a_100015324214_100000688526 [0,2,0,0,0,0|1,0,0]=3 30138 B18R2.1508 COc1cccc(c1)CNCc2ccccn2 207a_100000174954_100000209966 [0,2,0,0,0,0|2,0,0]=4 30139 B18R2.1508 COc1cccc(c1)CNCc2ccccn2 2230a_100000174954_100000721315 [0,2,0,0,0,0|2,0,0]=4 30140 B18R2.1508 COc1cccc(c1)CNCc2ccccn2 270004a_100000174954_100000209966 [0,2,0,0,0,0|2,0,0]=4 30141 B18R2.1508 COc1cccc(c1)CNCc2ccccn2 270004a_100000210449_100000170238 [0,2,0,0,0,0|2,0,0]=4 30142 B18R2.1508 COc1cccc(c1)CNCc2ccccn2 34a_100000174954_100000721315 [0,2,0,0,0,0|2,0,0]=4 30143 B18R2.1508 COc1cccc(c1)CNCc2cccnc2 207a_100000174954_100000209961 [0,2,0,0,0,0|2,0,0]=4 30144 B18R2.1508 COc1cccc(c1)CNCc2cccnc2 207a_100000210453_100000170238 [0,2,0,0,0,0|2,0,0]=4 30145 B18R2.1508 COc1cccc(c1)CNCc2cccnc2 2230a_100000174954_100000741622 [0,2,0,0,0,0|2,0,0]=4 30146 B18R2.1508 COc1cccc(c1)CNCc2cccnc2 270004a_100000174954_100000209961 [0,2,0,0,0,0|2,0,0]=4 30147 B18R2.1508 COc1cccc(c1)CNCc2cccnc2 270004a_100000210453_100000170238 [0,2,0,0,0,0|2,0,0]=4 30148 B18R2.1508 COc1cccc(c1)CNCc2cccnc2 34a_100000174954_100000733263 [0,2,0,0,0,0|2,0,0]=4 30149 B18R2.1508 COc1cccc(c1)CNCc2ccncc2 207a_100000174954_100000186114 [0,2,0,0,0,0|2,0,0]=4 30150 B18R2.1508 COc1cccc(c1)CNCc2ccncc2 2230a_100000174954_100015193705 [0,2,0,0,0,0|2,0,0]=4 30151 B18R2.1508 COc1cccc(c1)COCc2ccccc2 34a_100000198976_100015291786 [0,2,0,0,0,0|0,0,0]=2 30152 B18R2.1508 COc1cccc(c1)COCc2ccccc2 34a_100000210790_100000688526 [0,2,0,0,0,0|0,0,0]=2 30153 B18R2.1508 COc1cccc(c1)COCc2ccccc2 7a_100000210790_100000211672 [0,2,0,0,0,0|0,0,0]=2 30154 B18R2.1508 COc1cccc(c1)COCc2ccccn2 34a_100000198976_100000721315 [0,2,0,0,0,0|1,0,0]=3 30155 B18R2.1508 COc1cccc(c1)COCc2cccnc2 34a_100000198976_100000733263 [0,2,0,0,0,0|1,0,0]=3 30156 B18R2.1508 COc1cccc(c1)COCc2cccnn2 34a_100000198976_100016990269 [0,2,0,0,0,0|2,0,0]=4 30157 B18R2.1508 COc1cccc(c1)COCc2cnccn2 34a_100000198976_100016995436 [0,2,0,0,0,0|2,0,0]=4 30158 B18R2.1508 COc1cccc(c1)COCc2cncnc2 34a_100000198976_100015196519 [0,2,0,0,0,0|2,0,0]=4 30159 B18R2.1508 COc1cccc(c1)COCc2ncccn2 34a_100000198976_100000703007 [0,2,0,0,0,0|2,0,0]=4 30160 B18R2.1508 COc1cccc(c1)CSCc2ccccc2 62a_100000211182_100000211672 [0,2,0,0,0,0|0,1,0]=3 30161 B18R2.1508 COc1cccc(c1)CSCc2ccccc2 62a_100000688526_100015291786 [0,2,0,0,0,0|0,1,0]=3 30162 B18R2.1508 COc1cccc(c1)CSCc2ccccn2 62a_100000688526_100000721315 [0,2,0,0,0,0|1,1,0]=4 30163 B18R2.1508 COc1cccc(c1)CSCc2ccccn2 62a_100000721315_100000211672 [0,2,0,0,0,0|1,1,0]=4 30164 B18R2.1508 COc1cccc(c1)CSCc2cccnc2 62a_100000688526_100000741622 [0,2,0,0,0,0|1,1,0]=4 30165 B18R2.1508 COc1cccc(c1)CSCc2cccnc2 62a_100000741622_100000211672 [0,2,0,0,0,0|1,1,0]=4 30166 B18R2.1508 COc1cccc(c1)CSCc2ccncc2 62a_100000688526_100015193705 [0,2,0,0,0,0|1,1,0]=4 30167 B18R2.1508 COc1cccc(c1)CSCc2ccncc2 62a_100015193705_100000211672 [0,2,0,0,0,0|1,1,0]=4 30168 B18R2.1508 COc1cccc(c1)NCCc2ccccc2 34a_100000210024_100000765856 [0,2,0,0,0,0|2,0,0]=4 30169 B18R2.1508 COc1cccc(c1)OCCc2ccccc2 34a_100000211255_100000765856 [0,2,0,0,0,0|2,0,0]=4 30170 B18R2.1508 COc1cccc(c1)OCCc2ccccc2 7a_100000211255_100000765856 [0,2,0,0,0,0|2,0,0]=4 30171 B18R2.1508 COc1cccc(c1)SCCc2ccccc2 62a_100000765856_100000170001 [0,2,0,0,0,0|2,0,0]=4 30172 B18R2.1508 COc1cccc(n1)CNCc2ccccc2 207a_100015324214_100000694346 [0,2,0,0,0,0|2,0,0]=4 30173 B18R2.1508 COc1cccc(n1)CNCc2ccccc2 2230a_100000746380_100015291786 [0,2,0,0,0,0|2,0,0]=4 30174 B18R2.1508 COc1cccc(n1)CNCc2ccccc2 2230a_100015324214_100000755263 [0,2,0,0,0,0|2,0,0]=4 30175 B18R2.1508 COc1cccc(n1)CNCc2ccccc2 270004a_100015324214_100000694346 [0,2,0,0,0,0|2,0,0]=4 30176 B18R2.1508 COc1cccc(n1)CNCc2ccccc2 34a_100015324214_100000755263 [0,2,0,0,0,0|2,0,0]=4 30177 B18R2.1508 COc1cccc(n1)COCc2ccccc2 34a_100000210790_100000755263 [0,2,0,0,0,0|1,0,0]=3 30178 B18R2.1508 COc1cccc(n1)COCc2ccccc2 7a_100000210790_100000755263 [0,2,0,0,0,0|1,0,0]=3 30179 B18R2.1508 COc1cccc(n1)CSCc2ccccc2 62a_100000211182_100000755263 [0,2,0,0,0,0|1,1,0]=4 30180 B18R2.1508 COc1cccc(n1)CSCc2ccccc2 62a_100000755263_100015291786 [0,2,0,0,0,0|1,1,0]=4 30181 B18R2.1508 COc1ccnc(c1)CNCc2ccccc2 207a_100015324214_100000087537 [0,2,0,0,0,0|2,0,0]=4 30182 B18R2.1508 COc1ccnc(c1)CNCc2ccccc2 2230a_100015324214_100000752681 [0,2,0,0,0,0|2,0,0]=4 30183 B18R2.1508 COc1ccnc(c1)CNCc2ccccc2 270004a_100015324214_100000087537 [0,2,0,0,0,0|2,0,0]=4 30184 B18R2.1508 COc1ccnc(c1)CNCc2ccccc2 34a_100015324214_100000752681 [0,2,0,0,0,0|2,0,0]=4 30185 B18R2.1508 COc1ccnc(c1)COCc2ccccc2 34a_100000210790_100000752681 [0,2,0,0,0,0|1,0,0]=3 30186 B18R2.1508 COc1ccnc(c1)COCc2ccccc2 34a_100000749536_100015291786 [0,2,0,0,0,0|1,0,0]=3 30187 B18R2.1508 COc1ccnc(c1)COCc2ccccc2 7a_100000210790_100000752681 [0,2,0,0,0,0|1,0,0]=3 30188 B18R2.1508 COc1ccnc(c1)COCc2ccccn2 34a_100000749536_100000721315 [0,2,0,0,0,0|2,0,0]=4 30189 B18R2.1508 COc1ccnc(c1)COCc2cccnc2 34a_100000749536_100000733263 [0,2,0,0,0,0|2,0,0]=4 30190 B18R2.1508 COc1ccnc(c1)CSCc2ccccc2 62a_100000211182_100000752681 [0,2,0,0,0,0|1,1,0]=4 30191 B18R2.1508 COc1ccnc(c1)CSCc2ccccc2 62a_100000752681_100015291786 [0,2,0,0,0,0|1,1,0]=4 30192 B18R2.1508 COc1cncc(c1)CNCc2ccccc2 207a_100015324214_100011361638 [0,2,0,0,0,0|2,0,0]=4 30193 B18R2.1508 COc1cncc(c1)CNCc2ccccc2 207a_100020589029_100015611070 [0,2,0,0,0,0|2,0,0]=4 30194 B18R2.1508 COc1cncc(c1)CNCc2ccccc2 2230a_100020589029_100015291786 [0,2,0,0,0,0|2,0,0]=4 30195 B18R2.1508 COc1cncc(c1)CNCc2ccccc2 270004a_100015324214_100011361638 [0,2,0,0,0,0|2,0,0]=4 30196 B18R2.1508 COc1cncc(c1)CNCc2ccccc2 270004a_100020589029_100015611070 [0,2,0,0,0,0|2,0,0]=4 30197 B18R2.1508 COc1cncc(c1)CNCc2ccccc2 34a_100020589029_100015291786 [0,2,0,0,0,0|2,0,0]=4 30198 B18R2.1508 COc1cncc(c1)COCc2ccccc2 34a_100000732071_100015291786 [0,2,0,0,0,0|1,0,0]=3 30199 B18R2.1508 COc1cncc(c1)COCc2ccccn2 34a_100000732071_100000721315 [0,2,0,0,0,0|2,0,0]=4 30200 B18R2.1508 COc1cncc(c1)COCc2cccnc2 34a_100000732071_100000733263 [0,2,0,0,0,0|2,0,0]=4 30201 B18R2.1508 CSc1cccc(c1)C=CCc2ccccc2 271570a_200016263579_100011215954 [0,2,0,0,0,0|1,0,1]=4 30202 B18R2.1508 CSc1cccc(c1)CNCc2ccccc2 207a_100015324214_100011935093 [0,2,0,0,0,0|1,0,0]=3 30203 B18R2.1508 CSc1cccc(c1)CNCc2ccccc2 270004a_100015324214_100011935093 [0,2,0,0,0,0|1,0,0]=3 30204 B18R2.1508 CSc1cccc(c1)CNCc2ccccn2 270004a_100000210449_100011935093 [0,2,0,0,0,0|2,0,0]=4 30205 B18R2.1508 CSc1cccc(c1)CNCc2cccnc2 207a_100000210453_100011935093 [0,2,0,0,0,0|2,0,0]=4 30206 B18R2.1508 CSc1cccc(c1)CNCc2cccnc2 270004a_100000210453_100011935093 [0,2,0,0,0,0|2,0,0]=4 30207 B18R2.1508 CSc1cccc(c1)NCCc2ccccc2 2230a_100000210049_100000765856 [0,2,0,0,0,0|2,0,0]=4 30208 B18R2.1508 CSc1cccc(c1)NCCc2ccccc2 34a_100000210049_100000765856 [0,2,0,0,0,0|2,0,0]=4 30209 B18R2.1508 CSc1cccc(c1)OCCc2ccccc2 34a_100011265683_100000765856 [0,2,0,0,0,0|2,0,0]=4 30210 B18R2.1508 CSc1cccc(c1)OCCc2ccccc2 7a_100011265683_100000765856 [0,2,0,0,0,0|2,0,0]=4 30211 B18R2.1508 CSc1cccc(c1)SCCc2ccccc2 62a_100000765856_100011215954 [0,2,0,0,0,0|2,0,0]=4 30212 B18R2.1508 CSc1cccc(c1)SCCc2ccccc2 62a_100011215954_100011218657 [0,2,0,0,0,0|2,0,0]=4 30213 B18R2.1508 CSc1nccc(n1)COCc2ccccc2 7a_100009868414_100000211182 [0,2,0,0,0,0|2,0,0]=4 30214 B18R2.1508 ClCc1cccc(c1)COCc2ccccc2 34a_200000090956_100015291786 [0,2,0,0,0,0|0,0,0]=2 30215 B18R2.1508 ClCc1cccc(c1)COCc2ccccc2 7a_200000090956_100000211182 [0,2,0,0,0,0|0,0,0]=2 30216 B18R2.1508 ClCc1cccc(c1)COCc2ccccn2 34a_200000090956_100000721315 [0,2,0,0,0,0|1,0,0]=3 30217 B18R2.1508 ClCc1cccc(c1)COCc2ccccn2 7a_200000090956_100000721315 [0,2,0,0,0,0|1,0,0]=3 30218 B18R2.1508 ClCc1cccc(c1)COCc2cccnc2 34a_200000090956_100000733263 [0,2,0,0,0,0|1,0,0]=3 30219 B18R2.1508 ClCc1cccc(c1)COCc2cccnc2 7a_200000090956_100000741622 [0,2,0,0,0,0|1,0,0]=3 30220 B18R2.1508 ClCc1cccc(c1)COCc2cccnn2 34a_200000090956_100016990269 [0,2,0,0,0,0|2,0,0]=4 30221 B18R2.1508 ClCc1cccc(c1)COCc2cccnn2 7a_200000090956_100016990269 [0,2,0,0,0,0|2,0,0]=4 30222 B18R2.1508 ClCc1cccc(c1)COCc2ccncc2 7a_200000090956_100015193705 [0,2,0,0,0,0|1,0,0]=3 30223 B18R2.1508 ClCc1cccc(c1)COCc2cnccn2 34a_200000090956_100016995436 [0,2,0,0,0,0|2,0,0]=4 30224 B18R2.1508 ClCc1cccc(c1)COCc2cnccn2 7a_200000090956_100016995436 [0,2,0,0,0,0|2,0,0]=4 30225 B18R2.1508 ClCc1cccc(c1)COCc2cncnc2 34a_200000090956_100015196519 [0,2,0,0,0,0|2,0,0]=4 30226 B18R2.1508 ClCc1cccc(c1)COCc2cncnc2 7a_200000090956_100015196519 [0,2,0,0,0,0|2,0,0]=4 30227 B18R2.1508 ClCc1cccc(c1)COCc2ncccn2 34a_200000090956_100000703007 [0,2,0,0,0,0|2,0,0]=4 30228 B18R2.1508 ClCc1cccc(c1)COCc2ncccn2 7a_200000090956_100000703007 [0,2,0,0,0,0|2,0,0]=4 30229 B18R2.1508 ClCc1cccc(c1)OCCc2ccccc2 34a_100000084143_100000765856 [0,2,0,0,0,0|2,0,0]=4 30230 B18R2.1508 ClCc1cccc(c1)OCCc2ccccc2 7a_100000084143_100000765856 [0,2,0,0,0,0|2,0,0]=4 30231 B18R2.1508 FCc1cccc(c1)C=CCc2ccccc2 271570a_200016263579_100010878472 [0,2,0,0,0,0|1,0,1]=4 30232 B18R2.1508 FCc1cccc(c1)NCCc2ccccc2 2230a_100000126320_100000765856 [0,2,0,0,0,0|2,0,0]=4 30233 B18R2.1508 FCc1cccc(c1)NCCc2ccccc2 34a_100000126320_100000765856 [0,2,0,0,0,0|2,0,0]=4 30234 B18R2.1508 FCc1cccc(c1)NCCc2ccccc2 7a_100000126320_100000765856 [0,2,0,0,0,0|2,0,0]=4 30235 B18R2.1508 FCc1cccc(c1)SCCc2ccccc2 62a_100000765856_100010878472 [0,2,0,0,0,0|2,0,0]=4 30236 B18R2.1508 FCc1cccc(c1)SCCc2ccccc2 62a_100010878472_100011218657 [0,2,0,0,0,0|2,0,0]=4 30237 B18R2.1508 FCc1cccc(n1)CNCc2ccccc2 207a_100015324214_100016121940 [0,2,0,0,0,0|2,0,0]=4 30238 B18R2.1508 FCc1cccc(n1)CNCc2ccccc2 270004a_100015324214_100016121940 [0,2,0,0,0,0|2,0,0]=4 30239 B18R2.1508 N#Cc1cc(ccn1)COCc2ccccc2 7a_100000767107_100000211182 [0,2,0,0,0,0|1,0,0]=3 30240 B18R2.1508 N#Cc1cc(ccn1)COCc2ccccn2 7a_100000767107_100000721315 [0,2,0,0,0,0|2,0,0]=4 30241 B18R2.1508 N#Cc1cc(ccn1)COCc2cccnc2 7a_100000767107_100000741622 [0,2,0,0,0,0|2,0,0]=4 30242 B18R2.1508 N#Cc1cc(ccn1)COCc2ccncc2 7a_100000767107_100015193705 [0,2,0,0,0,0|2,0,0]=4 30243 B18R2.1508 N#Cc1cccc(c1)C=CCc2ccccc2 271570a_200016263579_100000189340 [0,2,0,0,0,0|1,0,1]=4 30244 B18R2.1508 N#Cc1cccc(c1)CNCc2ccccc2 207a_100000755147_100015611070 [0,2,0,0,0,0|1,0,0]=3 30245 B18R2.1508 N#Cc1cccc(c1)CNCc2ccccc2 207a_100015324214_100000241001 [0,2,0,0,0,0|1,0,0]=3 30246 B18R2.1508 N#Cc1cccc(c1)CNCc2ccccc2 2230a_100015324214_100000233786 [0,2,0,0,0,0|1,0,0]=3 30247 B18R2.1508 N#Cc1cccc(c1)CNCc2ccccc2 270004a_100000755147_100015611070 [0,2,0,0,0,0|1,0,0]=3 30248 B18R2.1508 N#Cc1cccc(c1)CNCc2ccccc2 270004a_100015324214_100000241001 [0,2,0,0,0,0|1,0,0]=3 30249 B18R2.1508 N#Cc1cccc(c1)CNCc2ccccc2 34a_100000755147_100015291786 [0,2,0,0,0,0|1,0,0]=3 30250 B18R2.1508 N#Cc1cccc(c1)CNCc2ccccc2 34a_100015324214_100000233786 [0,2,0,0,0,0|1,0,0]=3 30251 B18R2.1508 N#Cc1cccc(c1)CNCc2ccccn2 207a_100000755147_100000209966 [0,2,0,0,0,0|2,0,0]=4 30252 B18R2.1508 N#Cc1cccc(c1)CNCc2ccccn2 270004a_100000210449_100000241001 [0,2,0,0,0,0|2,0,0]=4 30253 B18R2.1508 N#Cc1cccc(c1)CNCc2ccccn2 270004a_100000755147_100000209966 [0,2,0,0,0,0|2,0,0]=4 30254 B18R2.1508 N#Cc1cccc(c1)CNCc2ccccn2 34a_100000755147_100000721315 [0,2,0,0,0,0|2,0,0]=4 30255 B18R2.1508 N#Cc1cccc(c1)CNCc2cccnc2 207a_100000210453_100000241001 [0,2,0,0,0,0|2,0,0]=4 30256 B18R2.1508 N#Cc1cccc(c1)CNCc2cccnc2 207a_100000755147_100000209961 [0,2,0,0,0,0|2,0,0]=4 30257 B18R2.1508 N#Cc1cccc(c1)CNCc2cccnc2 270004a_100000210453_100000241001 [0,2,0,0,0,0|2,0,0]=4 30258 B18R2.1508 N#Cc1cccc(c1)CNCc2cccnc2 270004a_100000755147_100000209961 [0,2,0,0,0,0|2,0,0]=4 30259 B18R2.1508 N#Cc1cccc(c1)CNCc2cccnc2 34a_100000755147_100000733263 [0,2,0,0,0,0|2,0,0]=4 30260 B18R2.1508 N#Cc1cccc(c1)CNCc2ccncc2 207a_100000755147_100000186114 [0,2,0,0,0,0|2,0,0]=4 30261 B18R2.1508 N#Cc1cccc(c1)COCc2ccccc2 34a_100000210790_100000233786 [0,2,0,0,0,0|0,0,0]=2 30262 B18R2.1508 N#Cc1cccc(c1)COCc2ccccc2 34a_100000753308_100015291786 [0,2,0,0,0,0|0,0,0]=2 30263 B18R2.1508 N#Cc1cccc(c1)COCc2ccccc2 7a_100000210790_100000233786 [0,2,0,0,0,0|0,0,0]=2 30264 B18R2.1508 N#Cc1cccc(c1)COCc2ccccc2 7a_100000753308_100000211182 [0,2,0,0,0,0|0,0,0]=2 30265 B18R2.1508 N#Cc1cccc(c1)COCc2ccccn2 34a_100000753308_100000721315 [0,2,0,0,0,0|1,0,0]=3 30266 B18R2.1508 N#Cc1cccc(c1)COCc2ccccn2 7a_100000753308_100000721315 [0,2,0,0,0,0|1,0,0]=3 30267 B18R2.1508 N#Cc1cccc(c1)COCc2cccnc2 34a_100000753308_100000733263 [0,2,0,0,0,0|1,0,0]=3 30268 B18R2.1508 N#Cc1cccc(c1)COCc2cccnc2 7a_100000753308_100000741622 [0,2,0,0,0,0|1,0,0]=3 30269 B18R2.1508 N#Cc1cccc(c1)COCc2cccnn2 34a_100000753308_100016990269 [0,2,0,0,0,0|2,0,0]=4 30270 B18R2.1508 N#Cc1cccc(c1)COCc2cccnn2 7a_100000753308_100016990269 [0,2,0,0,0,0|2,0,0]=4 30271 B18R2.1508 N#Cc1cccc(c1)COCc2ccncc2 7a_100000753308_100015193705 [0,2,0,0,0,0|1,0,0]=3 30272 B18R2.1508 N#Cc1cccc(c1)COCc2cnccn2 34a_100000753308_100016995436 [0,2,0,0,0,0|2,0,0]=4 30273 B18R2.1508 N#Cc1cccc(c1)COCc2cnccn2 7a_100000753308_100016995436 [0,2,0,0,0,0|2,0,0]=4 30274 B18R2.1508 N#Cc1cccc(c1)COCc2cncnc2 34a_100000753308_100015196519 [0,2,0,0,0,0|2,0,0]=4 30275 B18R2.1508 N#Cc1cccc(c1)COCc2cncnc2 7a_100000753308_100015196519 [0,2,0,0,0,0|2,0,0]=4 30276 B18R2.1508 N#Cc1cccc(c1)COCc2ncccn2 34a_100000753308_100000703007 [0,2,0,0,0,0|2,0,0]=4 30277 B18R2.1508 N#Cc1cccc(c1)COCc2ncccn2 7a_100000753308_100000703007 [0,2,0,0,0,0|2,0,0]=4 30278 B18R2.1508 N#Cc1cccc(c1)CSCc2ccccc2 62a_100000211182_100000233786 [0,2,0,0,0,0|0,1,0]=3 30279 B18R2.1508 N#Cc1cccc(c1)CSCc2ccccn2 62a_100000721315_100000233786 [0,2,0,0,0,0|1,1,0]=4 30280 B18R2.1508 N#Cc1cccc(c1)CSCc2cccnc2 62a_100000741622_100000233786 [0,2,0,0,0,0|1,1,0]=4 30281 B18R2.1508 N#Cc1cccc(c1)CSCc2ccncc2 62a_100015193705_100000233786 [0,2,0,0,0,0|1,1,0]=4 30282 B18R2.1508 N#Cc1cccc(c1)NCCc2ccccc2 34a_100000210922_100000765856 [0,2,0,0,0,0|2,0,0]=4 30283 B18R2.1508 N#Cc1cccc(c1)NCCc2ccccc2 7a_100000210922_100000765856 [0,2,0,0,0,0|2,0,0]=4 30284 B18R2.1508 N#Cc1cccc(c1)OCCc2ccccc2 34a_100000184713_100000765856 [0,2,0,0,0,0|2,0,0]=4 30285 B18R2.1508 N#Cc1cccc(c1)OCCc2ccccc2 7a_100000184713_100000765856 [0,2,0,0,0,0|2,0,0]=4 30286 B18R2.1508 N#Cc1cccc(c1)SCCc2ccccc2 62a_100000765856_100000189340 [0,2,0,0,0,0|2,0,0]=4 30287 B18R2.1508 N#Cc1cccc(n1)CNCc2ccccc2 2230a_100015324214_100000097530 [0,2,0,0,0,0|2,0,0]=4 30288 B18R2.1508 N#Cc1cccc(n1)CNCc2ccccc2 34a_100015324214_100000097530 [0,2,0,0,0,0|2,0,0]=4 30289 B18R2.1508 N#Cc1cccc(n1)COCc2ccccc2 34a_100000210790_100000097530 [0,2,0,0,0,0|1,0,0]=3 30290 B18R2.1508 N#Cc1cccc(n1)COCc2ccccc2 7a_100000210790_100000097530 [0,2,0,0,0,0|1,0,0]=3 30291 B18R2.1508 N#Cc1cccc(n1)COCc2ccccc2 7a_200000085287_100000211182 [0,2,0,0,0,0|1,0,0]=3 30292 B18R2.1508 N#Cc1cccc(n1)COCc2ccccn2 7a_200000085287_100000721315 [0,2,0,0,0,0|2,0,0]=4 30293 B18R2.1508 N#Cc1cccc(n1)COCc2cccnc2 7a_200000085287_100000741622 [0,2,0,0,0,0|2,0,0]=4 30294 B18R2.1508 N#Cc1cccc(n1)COCc2ccncc2 7a_200000085287_100015193705 [0,2,0,0,0,0|2,0,0]=4 30295 B18R2.1508 N#Cc1cccc(n1)CSCc2ccccc2 62a_100000211182_100000097530 [0,2,0,0,0,0|1,1,0]=4 30296 B18R2.1508 N#Cc1ccnc(c1)CNCc2ccccc2 270004a_100015324214_100009883299 [0,2,0,0,0,0|2,0,0]=4 30297 B18R2.1508 N#Cc1cncc(c1)CNCc2ccccc2 207a_100015324214_100011361567 [0,2,0,0,0,0|2,0,0]=4 30298 B18R2.1508 N#Cc1cncc(c1)CNCc2ccccc2 2230a_100015324214_200020634941 [0,2,0,0,0,0|2,0,0]=4 30299 B18R2.1508 N#Cc1cncc(c1)CNCc2ccccc2 270004a_100015324214_100011361567 [0,2,0,0,0,0|2,0,0]=4 30300 B18R2.1508 N#Cc1cncc(c1)CNCc2ccccc2 34a_100015324214_200020634941 [0,2,0,0,0,0|2,0,0]=4 30301 B18R2.1508 N#Cc1cncc(c1)COCc2ccccc2 34a_100000210790_200020634941 [0,2,0,0,0,0|1,0,0]=3 30302 B18R2.1508 N#Cc1cncc(c1)COCc2ccccc2 7a_100000085282_100000211182 [0,2,0,0,0,0|1,0,0]=3 30303 B18R2.1508 N#Cc1cncc(c1)COCc2ccccc2 7a_100000210790_200020634941 [0,2,0,0,0,0|1,0,0]=3 30304 B18R2.1508 N#Cc1cncc(c1)COCc2ccccn2 7a_100000085282_100000721315 [0,2,0,0,0,0|2,0,0]=4 30305 B18R2.1508 N#Cc1cncc(c1)COCc2cccnc2 7a_100000085282_100000741622 [0,2,0,0,0,0|2,0,0]=4 30306 B18R2.1508 N#Cc1cncc(c1)COCc2ccncc2 7a_100000085282_100015193705 [0,2,0,0,0,0|2,0,0]=4 30307 B18R2.1508 N#Cc1cncc(c1)CSCc2ccccc2 62a_100000211182_200020634941 [0,2,0,0,0,0|1,1,0]=4 30308 B18R2.1508 NCc1cccc(c1)C=CCc2ccccc2 271570a_200016263579_100000106179 [0,2,0,0,0,0|1,0,1]=4 30309 B18R2.1508 NCc1cccc(c1)COCc2ccccc2 34a_100011269909_100015291786 [0,2,0,0,0,0|0,0,0]=2 30310 B18R2.1508 NCc1cccc(c1)COCc2ccccn2 34a_100011269909_100000721315 [0,2,0,0,0,0|1,0,0]=3 30311 B18R2.1508 NCc1cccc(c1)COCc2cccnc2 34a_100011269909_100000733263 [0,2,0,0,0,0|1,0,0]=3 30312 B18R2.1508 NCc1cccc(c1)COCc2cccnn2 34a_100011269909_100016990269 [0,2,0,0,0,0|2,0,0]=4 30313 B18R2.1508 NCc1cccc(c1)COCc2cnccn2 34a_100011269909_100016995436 [0,2,0,0,0,0|2,0,0]=4 30314 B18R2.1508 NCc1cccc(c1)COCc2cncnc2 34a_100011269909_100015196519 [0,2,0,0,0,0|2,0,0]=4 30315 B18R2.1508 NCc1cccc(c1)COCc2ncccn2 34a_100011269909_100000703007 [0,2,0,0,0,0|2,0,0]=4 30316 B18R2.1508 NCc1cccc(c1)OCCc2ccccc2 34a_100000743036_100000765856 [0,2,0,0,0,0|2,0,0]=4 30317 B18R2.1508 NCc1cccc(c1)SCCc2ccccc2 62a_100000106179_100011218657 [0,2,0,0,0,0|2,0,0]=4 30318 B18R2.1508 NCc1cccc(c1)SCCc2ccccc2 62a_100000765856_100000106179 [0,2,0,0,0,0|2,0,0]=4 30319 B18R2.1508 NCc1ccnc(c1)COCc2ccccc2 34a_100020589248_100015291786 [0,2,0,0,0,0|1,0,0]=3 30320 B18R2.1508 NCc1ccnc(c1)COCc2ccccn2 34a_100020589248_100000721315 [0,2,0,0,0,0|2,0,0]=4 30321 B18R2.1508 NCc1ccnc(c1)COCc2cccnc2 34a_100020589248_100000733263 [0,2,0,0,0,0|2,0,0]=4 30322 B18R2.1508 NNc1cccc(c1)C=CCc2ccccc2 271570a_200016263579_100000217339 [0,2,0,0,0,0|1,0,1]=4 30323 B18R2.1508 NNc1cccc(c1)SCCc2ccccc2 62a_100000217339_100011218657 [0,2,0,0,0,0|2,0,0]=4 30324 B18R2.1508 NNc1cccc(c1)SCCc2ccccc2 62a_100000765856_100000217339 [0,2,0,0,0,0|2,0,0]=4 30325 B18R2.1508 O=Cc1cccc(c1)C=CCc2ccccc2 271570a_200016263579_100000014684 [0,2,0,0,0,0|1,0,1]=4 30326 B18R2.1508 O=Cc1cccc(c1)CNCc2ccccc2 2230a_100015324214_100009816774 [0,2,0,0,0,0|1,0,0]=3 30327 B18R2.1508 O=Cc1cccc(c1)CNCc2ccccc2 34a_100015324214_100009816774 [0,2,0,0,0,0|1,0,0]=3 30328 B18R2.1508 O=Cc1cccc(c1)COCc2ccccc2 34a_100000210790_100009816774 [0,2,0,0,0,0|0,0,0]=2 30329 B18R2.1508 O=Cc1cccc(c1)COCc2ccccc2 7a_100000210790_100009816774 [0,2,0,0,0,0|0,0,0]=2 30330 B18R2.1508 O=Cc1cccc(c1)CSCc2ccccc2 62a_100000211182_100009816774 [0,2,0,0,0,0|0,1,0]=3 30331 B18R2.1508 O=Cc1cccc(c1)CSCc2ccccc2 62a_100009816774_100015291786 [0,2,0,0,0,0|0,1,0]=3 30332 B18R2.1508 O=Cc1cccc(c1)CSCc2ccccn2 62a_100000721315_100009816774 [0,2,0,0,0,0|1,1,0]=4 30333 B18R2.1508 O=Cc1cccc(c1)CSCc2ccccn2 62a_100009816774_100000721315 [0,2,0,0,0,0|1,1,0]=4 30334 B18R2.1508 O=Cc1cccc(c1)CSCc2cccnc2 62a_100000741622_100009816774 [0,2,0,0,0,0|1,1,0]=4 30335 B18R2.1508 O=Cc1cccc(c1)CSCc2cccnc2 62a_100009816774_100000741622 [0,2,0,0,0,0|1,1,0]=4 30336 B18R2.1508 O=Cc1cccc(c1)CSCc2ccncc2 62a_100009816774_100015193705 [0,2,0,0,0,0|1,1,0]=4 30337 B18R2.1508 O=Cc1cccc(c1)CSCc2ccncc2 62a_100015193705_100009816774 [0,2,0,0,0,0|1,1,0]=4 30338 B18R2.1508 O=Cc1cccc(c1)SCCc2ccccc2 62a_100000014684_100011218657 [0,2,0,0,0,0|2,0,0]=4 30339 B18R2.1508 O=Cc1cccc(c1)SCCc2ccccc2 62a_100000765856_100000014684 [0,2,0,0,0,0|2,0,0]=4 30340 B18R2.1508 OCc1cc(ccn1)CNCc2ccccc2 207a_100020589248_100015611070 [0,2,0,0,0,0|2,0,0]=4 30341 B18R2.1508 OCc1cccc(c1)C=CCc2ccccc2 271570a_200016263579_100000687537 [0,2,0,0,0,0|1,0,1]=4 30342 B18R2.1508 OCc1cccc(c1)CNCc2ccccc2 207a_100011269909_100015611070 [0,2,0,0,0,0|1,0,0]=3 30343 B18R2.1508 OCc1cccc(c1)CNCc2ccccc2 207a_100015324214_200000050894 [0,2,0,0,0,0|1,0,0]=3 30344 B18R2.1508 OCc1cccc(c1)CNCc2ccccc2 2230a_100011269909_100015291786 [0,2,0,0,0,0|1,0,0]=3 30345 B18R2.1508 OCc1cccc(c1)CNCc2ccccc2 2230a_100015324214_100010188025 [0,2,0,0,0,0|1,0,0]=3 30346 B18R2.1508 OCc1cccc(c1)CNCc2ccccc2 270004a_100011269909_100015611070 [0,2,0,0,0,0|1,0,0]=3 30347 B18R2.1508 OCc1cccc(c1)CNCc2ccccc2 270004a_100015324214_200000050894 [0,2,0,0,0,0|1,0,0]=3 30348 B18R2.1508 OCc1cccc(c1)CNCc2ccccc2 34a_100011269909_100015291786 [0,2,0,0,0,0|1,0,0]=3 30349 B18R2.1508 OCc1cccc(c1)CNCc2ccccc2 34a_100015324214_100010188025 [0,2,0,0,0,0|1,0,0]=3 30350 B18R2.1508 OCc1cccc(c1)CNCc2ccccn2 207a_100011269909_100000209966 [0,2,0,0,0,0|2,0,0]=4 30351 B18R2.1508 OCc1cccc(c1)CNCc2ccccn2 2230a_100011269909_100000721315 [0,2,0,0,0,0|2,0,0]=4 30352 B18R2.1508 OCc1cccc(c1)CNCc2ccccn2 270004a_100000210449_200000050894 [0,2,0,0,0,0|2,0,0]=4 30353 B18R2.1508 OCc1cccc(c1)CNCc2ccccn2 270004a_100011269909_100000209966 [0,2,0,0,0,0|2,0,0]=4 30354 B18R2.1508 OCc1cccc(c1)CNCc2ccccn2 34a_100011269909_100000721315 [0,2,0,0,0,0|2,0,0]=4 30355 B18R2.1508 OCc1cccc(c1)CNCc2cccnc2 207a_100000210453_200000050894 [0,2,0,0,0,0|2,0,0]=4 30356 B18R2.1508 OCc1cccc(c1)CNCc2cccnc2 207a_100011269909_100000209961 [0,2,0,0,0,0|2,0,0]=4 30357 B18R2.1508 OCc1cccc(c1)CNCc2cccnc2 2230a_100011269909_100000741622 [0,2,0,0,0,0|2,0,0]=4 30358 B18R2.1508 OCc1cccc(c1)CNCc2cccnc2 270004a_100000210453_200000050894 [0,2,0,0,0,0|2,0,0]=4 30359 B18R2.1508 OCc1cccc(c1)CNCc2cccnc2 270004a_100011269909_100000209961 [0,2,0,0,0,0|2,0,0]=4 30360 B18R2.1508 OCc1cccc(c1)CNCc2cccnc2 34a_100011269909_100000733263 [0,2,0,0,0,0|2,0,0]=4 30361 B18R2.1508 OCc1cccc(c1)CNCc2ccncc2 207a_100011269909_100000186114 [0,2,0,0,0,0|2,0,0]=4 30362 B18R2.1508 OCc1cccc(c1)CNCc2ccncc2 2230a_100011269909_100015193705 [0,2,0,0,0,0|2,0,0]=4 30363 B18R2.1508 OCc1cccc(c1)COCc2ccccc2 34a_100000210790_100010188025 [0,2,0,0,0,0|0,0,0]=2 30364 B18R2.1508 OCc1cccc(c1)COCc2ccccc2 7a_100000210790_100010188025 [0,2,0,0,0,0|0,0,0]=2 30365 B18R2.1508 OCc1cccc(c1)CSCc2ccccc2 62a_100000211182_100010188025 [0,2,0,0,0,0|0,1,0]=3 30366 B18R2.1508 OCc1cccc(c1)CSCc2ccccc2 62a_100010188025_100015291786 [0,2,0,0,0,0|0,1,0]=3 30367 B18R2.1508 OCc1cccc(c1)CSCc2ccccn2 62a_100000721315_100010188025 [0,2,0,0,0,0|1,1,0]=4 30368 B18R2.1508 OCc1cccc(c1)CSCc2ccccn2 62a_100010188025_100000721315 [0,2,0,0,0,0|1,1,0]=4 30369 B18R2.1508 OCc1cccc(c1)CSCc2cccnc2 62a_100000741622_100010188025 [0,2,0,0,0,0|1,1,0]=4 30370 B18R2.1508 OCc1cccc(c1)CSCc2cccnc2 62a_100010188025_100000741622 [0,2,0,0,0,0|1,1,0]=4 30371 B18R2.1508 OCc1cccc(c1)CSCc2ccncc2 62a_100010188025_100015193705 [0,2,0,0,0,0|1,1,0]=4 30372 B18R2.1508 OCc1cccc(c1)CSCc2ccncc2 62a_100015193705_100010188025 [0,2,0,0,0,0|1,1,0]=4 30373 B18R2.1508 OCc1cccc(c1)NCCc2ccccc2 2230a_100000211919_100000765856 [0,2,0,0,0,0|2,0,0]=4 30374 B18R2.1508 OCc1cccc(c1)NCCc2ccccc2 34a_100000211919_100000765856 [0,2,0,0,0,0|2,0,0]=4 30375 B18R2.1508 OCc1cccc(c1)OCCc2ccccc2 34a_100011214949_100000765856 [0,2,0,0,0,0|2,0,0]=4 30376 B18R2.1508 OCc1cccc(c1)OCCc2ccccc2 7a_100011214949_100000765856 [0,2,0,0,0,0|2,0,0]=4 30377 B18R2.1508 OCc1cccc(c1)SCCc2ccccc2 62a_100000687537_100011218657 [0,2,0,0,0,0|2,0,0]=4 30378 B18R2.1508 OCc1cccc(c1)SCCc2ccccc2 62a_100000765856_100000687537 [0,2,0,0,0,0|2,0,0]=4 30379 B18R2.1508 OCc1cccc(n1)CNCc2ccccc2 207a_100015324214_200000070131 [0,2,0,0,0,0|2,0,0]=4 30380 B18R2.1508 OCc1cccc(n1)CNCc2ccccc2 2230a_100015324214_100009813551 [0,2,0,0,0,0|2,0,0]=4 30381 B18R2.1508 OCc1cccc(n1)CNCc2ccccc2 270004a_100015324214_200000070131 [0,2,0,0,0,0|2,0,0]=4 30382 B18R2.1508 OCc1cccc(n1)CNCc2ccccc2 34a_100015324214_100009813551 [0,2,0,0,0,0|2,0,0]=4 30383 B18R2.1508 OCc1cccc(n1)COCc2ccccc2 34a_100000210790_100009813551 [0,2,0,0,0,0|1,0,0]=3 30384 B18R2.1508 OCc1cccc(n1)COCc2ccccc2 7a_100000210790_100009813551 [0,2,0,0,0,0|1,0,0]=3 30385 B18R2.1508 OCc1cccc(n1)CSCc2ccccc2 62a_100000211182_100009813551 [0,2,0,0,0,0|1,1,0]=4 30386 B18R2.1508 OCc1cccc(n1)CSCc2ccccc2 62a_100009813551_100015291786 [0,2,0,0,0,0|1,1,0]=4 30387 B18R2.3665 Brc1cc(cc(c1)C=CCc2ccccc2)Br 271570a_200016263579_100009814770 [0,2,0,0,0,0|1,0,1]=4 30388 B18R2.3665 Brc1cc(cc(c1)CNCc2ccccc2)Br 207a_100015211796_100015611070 [0,2,0,0,0,0|1,0,0]=3 30389 B18R2.3665 Brc1cc(cc(c1)CNCc2ccccc2)Br 207a_100015324214_100000719502 [0,2,0,0,0,0|1,0,0]=3 30390 B18R2.3665 Brc1cc(cc(c1)CNCc2ccccc2)Br 2230a_100015211796_100015291786 [0,2,0,0,0,0|1,0,0]=3 30391 B18R2.3665 Brc1cc(cc(c1)CNCc2ccccc2)Br 2230a_100015324214_100011216082 [0,2,0,0,0,0|1,0,0]=3 30392 B18R2.3665 Brc1cc(cc(c1)CNCc2ccccc2)Br 269862a_100015324214_100000719502 [0,2,0,0,0,0|1,0,0]=3 30393 B18R2.3665 Brc1cc(cc(c1)CNCc2ccccc2)Br 270004a_100015211796_100015611070 [0,2,0,0,0,0|1,0,0]=3 30394 B18R2.3665 Brc1cc(cc(c1)CNCc2ccccc2)Br 270004a_100015324214_100000719502 [0,2,0,0,0,0|1,0,0]=3 30395 B18R2.3665 Brc1cc(cc(c1)CNCc2ccccc2)Br 34a_100015211796_100015291786 [0,2,0,0,0,0|1,0,0]=3 30396 B18R2.3665 Brc1cc(cc(c1)CNCc2ccccc2)Br 34a_100015324214_100011216082 [0,2,0,0,0,0|1,0,0]=3 30397 B18R2.3665 Brc1cc(cc(c1)CNCc2ccccc2)I 207a_100015324214_100010185649 [0,2,0,0,0,0|1,0,0]=3 30398 B18R2.3665 Brc1cc(cc(c1)CNCc2ccccc2)I 2230a_100015324214_100010146614 [0,2,0,0,0,0|1,0,0]=3 30399 B18R2.3665 Brc1cc(cc(c1)CNCc2ccccc2)I 269862a_100015324214_100010185649 [0,2,0,0,0,0|1,0,0]=3 30400 B18R2.3665 Brc1cc(cc(c1)CNCc2ccccc2)I 270004a_100015324214_100010185649 [0,2,0,0,0,0|1,0,0]=3 30401 B18R2.3665 Brc1cc(cc(c1)CNCc2ccccc2)I 34a_100015324214_100010146614 [0,2,0,0,0,0|1,0,0]=3 30402 B18R2.3665 Brc1cc(cc(c1)CNCc2ccccn2)Br 207a_100015211796_100000209966 [0,2,0,0,0,0|2,0,0]=4 30403 B18R2.3665 Brc1cc(cc(c1)CNCc2ccccn2)Br 2230a_100015211796_100000721315 [0,2,0,0,0,0|2,0,0]=4 30404 B18R2.3665 Brc1cc(cc(c1)CNCc2ccccn2)Br 270004a_100000210449_100000719502 [0,2,0,0,0,0|2,0,0]=4 30405 B18R2.3665 Brc1cc(cc(c1)CNCc2ccccn2)Br 270004a_100015211796_100000209966 [0,2,0,0,0,0|2,0,0]=4 30406 B18R2.3665 Brc1cc(cc(c1)CNCc2ccccn2)Br 34a_100015211796_100000721315 [0,2,0,0,0,0|2,0,0]=4 30407 B18R2.3665 Brc1cc(cc(c1)CNCc2ccccn2)I 270004a_100000210449_100010185649 [0,2,0,0,0,0|2,0,0]=4 30408 B18R2.3665 Brc1cc(cc(c1)CNCc2cccnc2)Br 207a_100000210453_100000719502 [0,2,0,0,0,0|2,0,0]=4 30409 B18R2.3665 Brc1cc(cc(c1)CNCc2cccnc2)Br 207a_100015211796_100000209961 [0,2,0,0,0,0|2,0,0]=4 30410 B18R2.3665 Brc1cc(cc(c1)CNCc2cccnc2)Br 2230a_100015211796_100000741622 [0,2,0,0,0,0|2,0,0]=4 30411 B18R2.3665 Brc1cc(cc(c1)CNCc2cccnc2)Br 269862a_100000210453_100000719502 [0,2,0,0,0,0|2,0,0]=4 30412 B18R2.3665 Brc1cc(cc(c1)CNCc2cccnc2)Br 270004a_100000210453_100000719502 [0,2,0,0,0,0|2,0,0]=4 30413 B18R2.3665 Brc1cc(cc(c1)CNCc2cccnc2)Br 270004a_100015211796_100000209961 [0,2,0,0,0,0|2,0,0]=4 30414 B18R2.3665 Brc1cc(cc(c1)CNCc2cccnc2)Br 34a_100015211796_100000733263 [0,2,0,0,0,0|2,0,0]=4 30415 B18R2.3665 Brc1cc(cc(c1)CNCc2cccnc2)I 207a_100000210453_100010185649 [0,2,0,0,0,0|2,0,0]=4 30416 B18R2.3665 Brc1cc(cc(c1)CNCc2cccnc2)I 269862a_100000210453_100010185649 [0,2,0,0,0,0|2,0,0]=4 30417 B18R2.3665 Brc1cc(cc(c1)CNCc2cccnc2)I 270004a_100000210453_100010185649 [0,2,0,0,0,0|2,0,0]=4 30418 B18R2.3665 Brc1cc(cc(c1)CNCc2ccncc2)Br 207a_100015211796_100000186114 [0,2,0,0,0,0|2,0,0]=4 30419 B18R2.3665 Brc1cc(cc(c1)CNCc2ccncc2)Br 2230a_100015211796_100015193705 [0,2,0,0,0,0|2,0,0]=4 30420 B18R2.3665 Brc1cc(cc(c1)CNCc2ccncc2)Br 269862a_100000210450_100000719502 [0,2,0,0,0,0|2,0,0]=4 30421 B18R2.3665 Brc1cc(cc(c1)CNCc2ccncc2)I 269862a_100000210450_100010185649 [0,2,0,0,0,0|2,0,0]=4 30422 B18R2.3665 Brc1cc(cc(c1)COCc2ccccc2)Br 34a_100000210790_100011216082 [0,2,0,0,0,0|0,0,0]=2 30423 B18R2.3665 Brc1cc(cc(c1)COCc2ccccc2)Br 34a_100011218366_100015291786 [0,2,0,0,0,0|0,0,0]=2 30424 B18R2.3665 Brc1cc(cc(c1)COCc2ccccc2)Br 7a_100000210790_100011216082 [0,2,0,0,0,0|0,0,0]=2 30425 B18R2.3665 Brc1cc(cc(c1)COCc2ccccc2)Br 7a_100011218366_100000211182 [0,2,0,0,0,0|0,0,0]=2 30426 B18R2.3665 Brc1cc(cc(c1)COCc2ccccc2)I 34a_100000210790_100010146614 [0,2,0,0,0,0|0,0,0]=2 30427 B18R2.3665 Brc1cc(cc(c1)COCc2ccccc2)I 7a_100000210790_100010146614 [0,2,0,0,0,0|0,0,0]=2 30428 B18R2.3665 Brc1cc(cc(c1)COCc2ccccc2)I 7a_100009814756_100000211182 [0,2,0,0,0,0|0,0,0]=2 30429 B18R2.3665 Brc1cc(cc(c1)COCc2ccccn2)Br 34a_100011218366_100000721315 [0,2,0,0,0,0|1,0,0]=3 30430 B18R2.3665 Brc1cc(cc(c1)COCc2ccccn2)Br 7a_100011218366_100000721315 [0,2,0,0,0,0|1,0,0]=3 30431 B18R2.3665 Brc1cc(cc(c1)COCc2ccccn2)I 7a_100009814756_100000721315 [0,2,0,0,0,0|1,0,0]=3 30432 B18R2.3665 Brc1cc(cc(c1)COCc2cccnc2)Br 34a_100011218366_100000733263 [0,2,0,0,0,0|1,0,0]=3 30433 B18R2.3665 Brc1cc(cc(c1)COCc2cccnc2)Br 7a_100011218366_100000741622 [0,2,0,0,0,0|1,0,0]=3 30434 B18R2.3665 Brc1cc(cc(c1)COCc2cccnc2)I 7a_100009814756_100000741622 [0,2,0,0,0,0|1,0,0]=3 30435 B18R2.3665 Brc1cc(cc(c1)COCc2cccnn2)Br 34a_100011218366_100016990269 [0,2,0,0,0,0|2,0,0]=4 30436 B18R2.3665 Brc1cc(cc(c1)COCc2cccnn2)Br 7a_100011218366_100016990269 [0,2,0,0,0,0|2,0,0]=4 30437 B18R2.3665 Brc1cc(cc(c1)COCc2cccnn2)I 7a_100009814756_100016990269 [0,2,0,0,0,0|2,0,0]=4 30438 B18R2.3665 Brc1cc(cc(c1)COCc2ccncc2)Br 7a_100011218366_100015193705 [0,2,0,0,0,0|1,0,0]=3 30439 B18R2.3665 Brc1cc(cc(c1)COCc2ccncc2)I 7a_100009814756_100015193705 [0,2,0,0,0,0|1,0,0]=3 30440 B18R2.3665 Brc1cc(cc(c1)COCc2cnccn2)Br 34a_100011218366_100016995436 [0,2,0,0,0,0|2,0,0]=4 30441 B18R2.3665 Brc1cc(cc(c1)COCc2cnccn2)Br 7a_100011218366_100016995436 [0,2,0,0,0,0|2,0,0]=4 30442 B18R2.3665 Brc1cc(cc(c1)COCc2cnccn2)I 7a_100009814756_100016995436 [0,2,0,0,0,0|2,0,0]=4 30443 B18R2.3665 Brc1cc(cc(c1)COCc2cncnc2)Br 34a_100011218366_100015196519 [0,2,0,0,0,0|2,0,0]=4 30444 B18R2.3665 Brc1cc(cc(c1)COCc2cncnc2)Br 7a_100011218366_100015196519 [0,2,0,0,0,0|2,0,0]=4 30445 B18R2.3665 Brc1cc(cc(c1)COCc2cncnc2)I 7a_100009814756_100015196519 [0,2,0,0,0,0|2,0,0]=4 30446 B18R2.3665 Brc1cc(cc(c1)COCc2ncccn2)Br 34a_100011218366_100000703007 [0,2,0,0,0,0|2,0,0]=4 30447 B18R2.3665 Brc1cc(cc(c1)COCc2ncccn2)Br 7a_100011218366_100000703007 [0,2,0,0,0,0|2,0,0]=4 30448 B18R2.3665 Brc1cc(cc(c1)COCc2ncccn2)I 7a_100009814756_100000703007 [0,2,0,0,0,0|2,0,0]=4 30449 B18R2.3665 Brc1cc(cc(c1)CSCc2ccccc2)Br 62a_100000211182_100011216082 [0,2,0,0,0,0|0,1,0]=3 30450 B18R2.3665 Brc1cc(cc(c1)CSCc2ccccc2)Br 62a_100011216082_100015291786 [0,2,0,0,0,0|0,1,0]=3 30451 B18R2.3665 Brc1cc(cc(c1)CSCc2ccccc2)I 62a_100000211182_100010146614 [0,2,0,0,0,0|0,1,0]=3 30452 B18R2.3665 Brc1cc(cc(c1)CSCc2ccccc2)I 62a_100010146614_100015291786 [0,2,0,0,0,0|0,1,0]=3 30453 B18R2.3665 Brc1cc(cc(c1)CSCc2ccccn2)Br 62a_100000721315_100011216082 [0,2,0,0,0,0|1,1,0]=4 30454 B18R2.3665 Brc1cc(cc(c1)CSCc2ccccn2)Br 62a_100011216082_100000721315 [0,2,0,0,0,0|1,1,0]=4 30455 B18R2.3665 Brc1cc(cc(c1)CSCc2ccccn2)I 62a_100000721315_100010146614 [0,2,0,0,0,0|1,1,0]=4 30456 B18R2.3665 Brc1cc(cc(c1)CSCc2ccccn2)I 62a_100010146614_100000721315 [0,2,0,0,0,0|1,1,0]=4 30457 B18R2.3665 Brc1cc(cc(c1)CSCc2cccnc2)Br 62a_100000741622_100011216082 [0,2,0,0,0,0|1,1,0]=4 30458 B18R2.3665 Brc1cc(cc(c1)CSCc2cccnc2)Br 62a_100011216082_100000741622 [0,2,0,0,0,0|1,1,0]=4 30459 B18R2.3665 Brc1cc(cc(c1)CSCc2cccnc2)I 62a_100000741622_100010146614 [0,2,0,0,0,0|1,1,0]=4 30460 B18R2.3665 Brc1cc(cc(c1)CSCc2cccnc2)I 62a_100010146614_100000741622 [0,2,0,0,0,0|1,1,0]=4 30461 B18R2.3665 Brc1cc(cc(c1)CSCc2ccncc2)Br 62a_100011216082_100015193705 [0,2,0,0,0,0|1,1,0]=4 30462 B18R2.3665 Brc1cc(cc(c1)CSCc2ccncc2)Br 62a_100015193705_100011216082 [0,2,0,0,0,0|1,1,0]=4 30463 B18R2.3665 Brc1cc(cc(c1)CSCc2ccncc2)I 62a_100010146614_100015193705 [0,2,0,0,0,0|1,1,0]=4 30464 B18R2.3665 Brc1cc(cc(c1)CSCc2ccncc2)I 62a_100015193705_100010146614 [0,2,0,0,0,0|1,1,0]=4 30465 B18R2.3665 Brc1cc(cc(c1)NCCc2ccccc2)Br 27a_100000106460_100009814770 [0,2,0,0,0,0|2,0,0]=4 30466 B18R2.3665 Brc1cc(cc(c1)NCCc2ccccc2)Br 34a_100012047176_100000765856 [0,2,0,0,0,0|2,0,0]=4 30467 B18R2.3665 Brc1cc(cc(c1)NCCc2ccccc2)Br 7a_100012047176_100000765856 [0,2,0,0,0,0|2,0,0]=4 30468 B18R2.3665 Brc1cc(cc(c1)NCCc2ccccc2)I 7a_100009814763_100000765856 [0,2,0,0,0,0|2,0,0]=4 30469 B18R2.3665 Brc1cc(cc(c1)OCCc2ccccc2)Br 34a_100010167048_100000765856 [0,2,0,0,0,0|2,0,0]=4 30470 B18R2.3665 Brc1cc(cc(c1)OCCc2ccccc2)Br 7a_100010167048_100000765856 [0,2,0,0,0,0|2,0,0]=4 30471 B18R2.3665 Brc1cc(cc(c1)OCCc2ccccc2)I 34a_100010068917_100000765856 [0,2,0,0,0,0|2,0,0]=4 30472 B18R2.3665 Brc1cc(cc(c1)OCCc2ccccc2)I 7a_100010068917_100000765856 [0,2,0,0,0,0|2,0,0]=4 30473 B18R2.3665 Brc1cc(cc(c1)SCCc2ccccc2)Br 62a_100000765856_100009814770 [0,2,0,0,0,0|2,0,0]=4 30474 B18R2.3665 Brc1cc(cc(c1)SCCc2ccccc2)Br 62a_100009814770_100011218657 [0,2,0,0,0,0|2,0,0]=4 30475 B18R2.3665 Brc1cc(cc(n1)Br)COCc2ccccc2 7a_100010209938_100000211182 [0,2,0,0,0,0|1,0,0]=3 30476 B18R2.3665 Brc1cc(cc(n1)Br)COCc2ccccn2 7a_100010209938_100000721315 [0,2,0,0,0,0|2,0,0]=4 30477 B18R2.3665 Brc1cc(cc(n1)Br)COCc2cccnc2 7a_100010209938_100000741622 [0,2,0,0,0,0|2,0,0]=4 30478 B18R2.3665 Brc1cc(cc(n1)Br)COCc2ccncc2 7a_100010209938_100015193705 [0,2,0,0,0,0|2,0,0]=4 30479 B18R2.3665 Cc1cc(cc(c1)C=CCc2ccccc2)C 271570a_200016263579_100011215608 [0,2,0,0,0,0|1,0,1]=4 30480 B18R2.3665 Cc1cc(cc(c1)C=CCc2ccccc2)Cl 271570a_200016263579_100010172791 [0,2,0,0,0,0|1,0,1]=4 30481 B18R2.3665 Cc1cc(cc(c1)C=CCc2ccccc2)F 271570a_200016263579_100011356977 [0,2,0,0,0,0|1,0,1]=4 30482 B18R2.3665 Cc1cc(cc(c1)C=CCc2ccccc2)N 271570a_200016263579_100000695972 [0,2,0,0,0,0|1,0,1]=4 30483 B18R2.3665 Cc1cc(cc(c1)C=CCc2ccccc2)O 271570a_200016263579_100011999630 [0,2,0,0,0,0|1,0,1]=4 30484 B18R2.3665 Cc1cc(cc(c1)CNCc2ccccc2)Br 207a_100015324214_100000686105 [0,2,0,0,0,0|1,0,0]=3 30485 B18R2.3665 Cc1cc(cc(c1)CNCc2ccccc2)Br 2230a_100015324214_100012348363 [0,2,0,0,0,0|1,0,0]=3 30486 B18R2.3665 Cc1cc(cc(c1)CNCc2ccccc2)Br 269862a_100015324214_100000686105 [0,2,0,0,0,0|1,0,0]=3 30487 B18R2.3665 Cc1cc(cc(c1)CNCc2ccccc2)Br 270004a_100015324214_100000686105 [0,2,0,0,0,0|1,0,0]=3 30488 B18R2.3665 Cc1cc(cc(c1)CNCc2ccccc2)Br 34a_100015324214_100012348363 [0,2,0,0,0,0|1,0,0]=3 30489 B18R2.3665 Cc1cc(cc(c1)CNCc2ccccc2)C 207a_100015324214_100000745632 [0,2,0,0,0,0|1,0,0]=3 30490 B18R2.3665 Cc1cc(cc(c1)CNCc2ccccc2)C 207a_100020591340_100015611070 [0,2,0,0,0,0|1,0,0]=3 30491 B18R2.3665 Cc1cc(cc(c1)CNCc2ccccc2)C 2230a_100015324214_100000181317 [0,2,0,0,0,0|1,0,0]=3 30492 B18R2.3665 Cc1cc(cc(c1)CNCc2ccccc2)C 2230a_100020591340_100015291786 [0,2,0,0,0,0|1,0,0]=3 30493 B18R2.3665 Cc1cc(cc(c1)CNCc2ccccc2)C 270004a_100015324214_100000745632 [0,2,0,0,0,0|1,0,0]=3 30494 B18R2.3665 Cc1cc(cc(c1)CNCc2ccccc2)C 270004a_100020591340_100015611070 [0,2,0,0,0,0|1,0,0]=3 30495 B18R2.3665 Cc1cc(cc(c1)CNCc2ccccc2)C 34a_100015324214_100000181317 [0,2,0,0,0,0|1,0,0]=3 30496 B18R2.3665 Cc1cc(cc(c1)CNCc2ccccc2)C 34a_100020591340_100015291786 [0,2,0,0,0,0|1,0,0]=3 30497 B18R2.3665 Cc1cc(cc(c1)CNCc2ccccc2)Cl 207a_100015324214_100000684525 [0,2,0,0,0,0|1,0,0]=3 30498 B18R2.3665 Cc1cc(cc(c1)CNCc2ccccc2)Cl 270004a_100015324214_100000684525 [0,2,0,0,0,0|1,0,0]=3 30499 B18R2.3665 Cc1cc(cc(c1)CNCc2ccccc2)F 207a_100011830484_100015611070 [0,2,0,0,0,0|1,0,0]=3 30500 B18R2.3665 Cc1cc(cc(c1)CNCc2ccccc2)F 207a_100015324214_100011217087 [0,2,0,0,0,0|1,0,0]=3 30501 B18R2.3665 Cc1cc(cc(c1)CNCc2ccccc2)F 2230a_100011830484_100015291786 [0,2,0,0,0,0|1,0,0]=3 30502 B18R2.3665 Cc1cc(cc(c1)CNCc2ccccc2)F 2230a_100015324214_100011219130 [0,2,0,0,0,0|1,0,0]=3 30503 B18R2.3665 Cc1cc(cc(c1)CNCc2ccccc2)F 270004a_100011830484_100015611070 [0,2,0,0,0,0|1,0,0]=3 30504 B18R2.3665 Cc1cc(cc(c1)CNCc2ccccc2)F 270004a_100015324214_100011217087 [0,2,0,0,0,0|1,0,0]=3 30505 B18R2.3665 Cc1cc(cc(c1)CNCc2ccccc2)F 34a_100011830484_100015291786 [0,2,0,0,0,0|1,0,0]=3 30506 B18R2.3665 Cc1cc(cc(c1)CNCc2ccccc2)F 34a_100015324214_100011219130 [0,2,0,0,0,0|1,0,0]=3 30507 B18R2.3665 Cc1cc(cc(c1)CNCc2ccccc2)O 207a_100015324214_100009853434 [0,2,0,0,0,0|1,0,0]=3 30508 B18R2.3665 Cc1cc(cc(c1)CNCc2ccccc2)O 270004a_100015324214_100009853434 [0,2,0,0,0,0|1,0,0]=3 30509 B18R2.3665 Cc1cc(cc(c1)CNCc2ccccn2)Br 270004a_100000210449_100000686105 [0,2,0,0,0,0|2,0,0]=4 30510 B18R2.3665 Cc1cc(cc(c1)CNCc2ccccn2)C 207a_100020591340_100000209966 [0,2,0,0,0,0|2,0,0]=4 30511 B18R2.3665 Cc1cc(cc(c1)CNCc2ccccn2)C 2230a_100020591340_100000721315 [0,2,0,0,0,0|2,0,0]=4 30512 B18R2.3665 Cc1cc(cc(c1)CNCc2ccccn2)C 270004a_100000210449_100000745632 [0,2,0,0,0,0|2,0,0]=4 30513 B18R2.3665 Cc1cc(cc(c1)CNCc2ccccn2)C 270004a_100020591340_100000209966 [0,2,0,0,0,0|2,0,0]=4 30514 B18R2.3665 Cc1cc(cc(c1)CNCc2ccccn2)C 34a_100020591340_100000721315 [0,2,0,0,0,0|2,0,0]=4 30515 B18R2.3665 Cc1cc(cc(c1)CNCc2ccccn2)Cl 270004a_100000210449_100000684525 [0,2,0,0,0,0|2,0,0]=4 30516 B18R2.3665 Cc1cc(cc(c1)CNCc2ccccn2)F 207a_100011830484_100000209966 [0,2,0,0,0,0|2,0,0]=4 30517 B18R2.3665 Cc1cc(cc(c1)CNCc2ccccn2)F 2230a_100011830484_100000721315 [0,2,0,0,0,0|2,0,0]=4 30518 B18R2.3665 Cc1cc(cc(c1)CNCc2ccccn2)F 270004a_100000210449_100011217087 [0,2,0,0,0,0|2,0,0]=4 30519 B18R2.3665 Cc1cc(cc(c1)CNCc2ccccn2)F 270004a_100011830484_100000209966 [0,2,0,0,0,0|2,0,0]=4 30520 B18R2.3665 Cc1cc(cc(c1)CNCc2ccccn2)F 34a_100011830484_100000721315 [0,2,0,0,0,0|2,0,0]=4 30521 B18R2.3665 Cc1cc(cc(c1)CNCc2ccccn2)O 270004a_100000210449_100009853434 [0,2,0,0,0,0|2,0,0]=4 30522 B18R2.3665 Cc1cc(cc(c1)CNCc2cccnc2)Br 207a_100000210453_100000686105 [0,2,0,0,0,0|2,0,0]=4 30523 B18R2.3665 Cc1cc(cc(c1)CNCc2cccnc2)Br 269862a_100000210453_100000686105 [0,2,0,0,0,0|2,0,0]=4 30524 B18R2.3665 Cc1cc(cc(c1)CNCc2cccnc2)Br 270004a_100000210453_100000686105 [0,2,0,0,0,0|2,0,0]=4 30525 B18R2.3665 Cc1cc(cc(c1)CNCc2cccnc2)C 207a_100000210453_100000745632 [0,2,0,0,0,0|2,0,0]=4 30526 B18R2.3665 Cc1cc(cc(c1)CNCc2cccnc2)C 207a_100020591340_100000209961 [0,2,0,0,0,0|2,0,0]=4 30527 B18R2.3665 Cc1cc(cc(c1)CNCc2cccnc2)C 2230a_100020591340_100000741622 [0,2,0,0,0,0|2,0,0]=4 30528 B18R2.3665 Cc1cc(cc(c1)CNCc2cccnc2)C 270004a_100000210453_100000745632 [0,2,0,0,0,0|2,0,0]=4 30529 B18R2.3665 Cc1cc(cc(c1)CNCc2cccnc2)C 270004a_100020591340_100000209961 [0,2,0,0,0,0|2,0,0]=4 30530 B18R2.3665 Cc1cc(cc(c1)CNCc2cccnc2)C 34a_100020591340_100000733263 [0,2,0,0,0,0|2,0,0]=4 30531 B18R2.3665 Cc1cc(cc(c1)CNCc2cccnc2)Cl 207a_100000210453_100000684525 [0,2,0,0,0,0|2,0,0]=4 30532 B18R2.3665 Cc1cc(cc(c1)CNCc2cccnc2)Cl 270004a_100000210453_100000684525 [0,2,0,0,0,0|2,0,0]=4 30533 B18R2.3665 Cc1cc(cc(c1)CNCc2cccnc2)F 207a_100000210453_100011217087 [0,2,0,0,0,0|2,0,0]=4 30534 B18R2.3665 Cc1cc(cc(c1)CNCc2cccnc2)F 207a_100011830484_100000209961 [0,2,0,0,0,0|2,0,0]=4 30535 B18R2.3665 Cc1cc(cc(c1)CNCc2cccnc2)F 2230a_100011830484_100000741622 [0,2,0,0,0,0|2,0,0]=4 30536 B18R2.3665 Cc1cc(cc(c1)CNCc2cccnc2)F 270004a_100000210453_100011217087 [0,2,0,0,0,0|2,0,0]=4 30537 B18R2.3665 Cc1cc(cc(c1)CNCc2cccnc2)F 270004a_100011830484_100000209961 [0,2,0,0,0,0|2,0,0]=4 30538 B18R2.3665 Cc1cc(cc(c1)CNCc2cccnc2)F 34a_100011830484_100000733263 [0,2,0,0,0,0|2,0,0]=4 30539 B18R2.3665 Cc1cc(cc(c1)CNCc2cccnc2)O 207a_100000210453_100009853434 [0,2,0,0,0,0|2,0,0]=4 30540 B18R2.3665 Cc1cc(cc(c1)CNCc2cccnc2)O 270004a_100000210453_100009853434 [0,2,0,0,0,0|2,0,0]=4 30541 B18R2.3665 Cc1cc(cc(c1)CNCc2ccncc2)Br 269862a_100000210450_100000686105 [0,2,0,0,0,0|2,0,0]=4 30542 B18R2.3665 Cc1cc(cc(c1)CNCc2ccncc2)C 207a_100020591340_100000186114 [0,2,0,0,0,0|2,0,0]=4 30543 B18R2.3665 Cc1cc(cc(c1)CNCc2ccncc2)C 2230a_100020591340_100015193705 [0,2,0,0,0,0|2,0,0]=4 30544 B18R2.3665 Cc1cc(cc(c1)CNCc2ccncc2)F 207a_100011830484_100000186114 [0,2,0,0,0,0|2,0,0]=4 30545 B18R2.3665 Cc1cc(cc(c1)CNCc2ccncc2)F 2230a_100011830484_100015193705 [0,2,0,0,0,0|2,0,0]=4 30546 B18R2.3665 Cc1cc(cc(c1)COCc2ccccc2)Br 34a_100000210790_100012348363 [0,2,0,0,0,0|0,0,0]=2 30547 B18R2.3665 Cc1cc(cc(c1)COCc2ccccc2)Br 34a_100000720511_100015291786 [0,2,0,0,0,0|0,0,0]=2 30548 B18R2.3665 Cc1cc(cc(c1)COCc2ccccc2)Br 7a_100000210790_100012348363 [0,2,0,0,0,0|0,0,0]=2 30549 B18R2.3665 Cc1cc(cc(c1)COCc2ccccc2)Br 7a_100000720511_100000211182 [0,2,0,0,0,0|0,0,0]=2 30550 B18R2.3665 Cc1cc(cc(c1)COCc2ccccc2)C 34a_100000210790_100000181317 [0,2,0,0,0,0|0,0,0]=2 30551 B18R2.3665 Cc1cc(cc(c1)COCc2ccccc2)C 34a_100011216556_100015291786 [0,2,0,0,0,0|0,0,0]=2 30552 B18R2.3665 Cc1cc(cc(c1)COCc2ccccc2)C 7a_100000210790_100000181317 [0,2,0,0,0,0|0,0,0]=2 30553 B18R2.3665 Cc1cc(cc(c1)COCc2ccccc2)C 7a_100011216556_100000211182 [0,2,0,0,0,0|0,0,0]=2 30554 B18R2.3665 Cc1cc(cc(c1)COCc2ccccc2)F 34a_100000210790_100011219130 [0,2,0,0,0,0|0,0,0]=2 30555 B18R2.3665 Cc1cc(cc(c1)COCc2ccccc2)F 34a_100011217934_100015291786 [0,2,0,0,0,0|0,0,0]=2 30556 B18R2.3665 Cc1cc(cc(c1)COCc2ccccc2)F 7a_100000210790_100011219130 [0,2,0,0,0,0|0,0,0]=2 30557 B18R2.3665 Cc1cc(cc(c1)COCc2ccccc2)F 7a_100011217934_100000211182 [0,2,0,0,0,0|0,0,0]=2 30558 B18R2.3665 Cc1cc(cc(c1)COCc2ccccn2)Br 34a_100000720511_100000721315 [0,2,0,0,0,0|1,0,0]=3 30559 B18R2.3665 Cc1cc(cc(c1)COCc2ccccn2)Br 7a_100000720511_100000721315 [0,2,0,0,0,0|1,0,0]=3 30560 B18R2.3665 Cc1cc(cc(c1)COCc2ccccn2)C 34a_100011216556_100000721315 [0,2,0,0,0,0|1,0,0]=3 30561 B18R2.3665 Cc1cc(cc(c1)COCc2ccccn2)C 7a_100011216556_100000721315 [0,2,0,0,0,0|1,0,0]=3 30562 B18R2.3665 Cc1cc(cc(c1)COCc2ccccn2)F 34a_100011217934_100000721315 [0,2,0,0,0,0|1,0,0]=3 30563 B18R2.3665 Cc1cc(cc(c1)COCc2ccccn2)F 7a_100011217934_100000721315 [0,2,0,0,0,0|1,0,0]=3 30564 B18R2.3665 Cc1cc(cc(c1)COCc2cccnc2)Br 34a_100000720511_100000733263 [0,2,0,0,0,0|1,0,0]=3 30565 B18R2.3665 Cc1cc(cc(c1)COCc2cccnc2)Br 7a_100000720511_100000741622 [0,2,0,0,0,0|1,0,0]=3 30566 B18R2.3665 Cc1cc(cc(c1)COCc2cccnc2)C 34a_100011216556_100000733263 [0,2,0,0,0,0|1,0,0]=3 30567 B18R2.3665 Cc1cc(cc(c1)COCc2cccnc2)C 7a_100011216556_100000741622 [0,2,0,0,0,0|1,0,0]=3 30568 B18R2.3665 Cc1cc(cc(c1)COCc2cccnc2)F 34a_100011217934_100000733263 [0,2,0,0,0,0|1,0,0]=3 30569 B18R2.3665 Cc1cc(cc(c1)COCc2cccnc2)F 7a_100011217934_100000741622 [0,2,0,0,0,0|1,0,0]=3 30570 B18R2.3665 Cc1cc(cc(c1)COCc2cccnn2)Br 34a_100000720511_100016990269 [0,2,0,0,0,0|2,0,0]=4 30571 B18R2.3665 Cc1cc(cc(c1)COCc2cccnn2)Br 7a_100000720511_100016990269 [0,2,0,0,0,0|2,0,0]=4 30572 B18R2.3665 Cc1cc(cc(c1)COCc2cccnn2)C 34a_100011216556_100016990269 [0,2,0,0,0,0|2,0,0]=4 30573 B18R2.3665 Cc1cc(cc(c1)COCc2cccnn2)C 7a_100011216556_100016990269 [0,2,0,0,0,0|2,0,0]=4 30574 B18R2.3665 Cc1cc(cc(c1)COCc2cccnn2)F 34a_100011217934_100016990269 [0,2,0,0,0,0|2,0,0]=4 30575 B18R2.3665 Cc1cc(cc(c1)COCc2cccnn2)F 7a_100011217934_100016990269 [0,2,0,0,0,0|2,0,0]=4 30576 B18R2.3665 Cc1cc(cc(c1)COCc2ccncc2)Br 7a_100000720511_100015193705 [0,2,0,0,0,0|1,0,0]=3 30577 B18R2.3665 Cc1cc(cc(c1)COCc2ccncc2)C 7a_100011216556_100015193705 [0,2,0,0,0,0|1,0,0]=3 30578 B18R2.3665 Cc1cc(cc(c1)COCc2ccncc2)F 7a_100011217934_100015193705 [0,2,0,0,0,0|1,0,0]=3 30579 B18R2.3665 Cc1cc(cc(c1)COCc2cnccn2)Br 34a_100000720511_100016995436 [0,2,0,0,0,0|2,0,0]=4 30580 B18R2.3665 Cc1cc(cc(c1)COCc2cnccn2)Br 7a_100000720511_100016995436 [0,2,0,0,0,0|2,0,0]=4 30581 B18R2.3665 Cc1cc(cc(c1)COCc2cnccn2)C 34a_100011216556_100016995436 [0,2,0,0,0,0|2,0,0]=4 30582 B18R2.3665 Cc1cc(cc(c1)COCc2cnccn2)C 7a_100011216556_100016995436 [0,2,0,0,0,0|2,0,0]=4 30583 B18R2.3665 Cc1cc(cc(c1)COCc2cnccn2)F 34a_100011217934_100016995436 [0,2,0,0,0,0|2,0,0]=4 30584 B18R2.3665 Cc1cc(cc(c1)COCc2cnccn2)F 7a_100011217934_100016995436 [0,2,0,0,0,0|2,0,0]=4 30585 B18R2.3665 Cc1cc(cc(c1)COCc2cncnc2)Br 34a_100000720511_100015196519 [0,2,0,0,0,0|2,0,0]=4 30586 B18R2.3665 Cc1cc(cc(c1)COCc2cncnc2)Br 7a_100000720511_100015196519 [0,2,0,0,0,0|2,0,0]=4 30587 B18R2.3665 Cc1cc(cc(c1)COCc2cncnc2)C 34a_100011216556_100015196519 [0,2,0,0,0,0|2,0,0]=4 30588 B18R2.3665 Cc1cc(cc(c1)COCc2cncnc2)C 7a_100011216556_100015196519 [0,2,0,0,0,0|2,0,0]=4 30589 B18R2.3665 Cc1cc(cc(c1)COCc2cncnc2)F 34a_100011217934_100015196519 [0,2,0,0,0,0|2,0,0]=4 30590 B18R2.3665 Cc1cc(cc(c1)COCc2cncnc2)F 7a_100011217934_100015196519 [0,2,0,0,0,0|2,0,0]=4 30591 B18R2.3665 Cc1cc(cc(c1)COCc2ncccn2)Br 34a_100000720511_100000703007 [0,2,0,0,0,0|2,0,0]=4 30592 B18R2.3665 Cc1cc(cc(c1)COCc2ncccn2)Br 7a_100000720511_100000703007 [0,2,0,0,0,0|2,0,0]=4 30593 B18R2.3665 Cc1cc(cc(c1)COCc2ncccn2)C 34a_100011216556_100000703007 [0,2,0,0,0,0|2,0,0]=4 30594 B18R2.3665 Cc1cc(cc(c1)COCc2ncccn2)C 7a_100011216556_100000703007 [0,2,0,0,0,0|2,0,0]=4 30595 B18R2.3665 Cc1cc(cc(c1)COCc2ncccn2)F 34a_100011217934_100000703007 [0,2,0,0,0,0|2,0,0]=4 30596 B18R2.3665 Cc1cc(cc(c1)COCc2ncccn2)F 7a_100011217934_100000703007 [0,2,0,0,0,0|2,0,0]=4 30597 B18R2.3665 Cc1cc(cc(c1)CSCc2ccccc2)Br 62a_100000211182_100012348363 [0,2,0,0,0,0|0,1,0]=3 30598 B18R2.3665 Cc1cc(cc(c1)CSCc2ccccc2)Br 62a_100012348363_100015291786 [0,2,0,0,0,0|0,1,0]=3 30599 B18R2.3665 Cc1cc(cc(c1)CSCc2ccccc2)C 62a_100000181317_100015291786 [0,2,0,0,0,0|0,1,0]=3 30600 B18R2.3665 Cc1cc(cc(c1)CSCc2ccccc2)C 62a_100000211182_100000181317 [0,2,0,0,0,0|0,1,0]=3 30601 B18R2.3665 Cc1cc(cc(c1)CSCc2ccccc2)F 62a_100000211182_100011219130 [0,2,0,0,0,0|0,1,0]=3 30602 B18R2.3665 Cc1cc(cc(c1)CSCc2ccccc2)F 62a_100011219130_100015291786 [0,2,0,0,0,0|0,1,0]=3 30603 B18R2.3665 Cc1cc(cc(c1)CSCc2ccccn2)Br 62a_100000721315_100012348363 [0,2,0,0,0,0|1,1,0]=4 30604 B18R2.3665 Cc1cc(cc(c1)CSCc2ccccn2)Br 62a_100012348363_100000721315 [0,2,0,0,0,0|1,1,0]=4 30605 B18R2.3665 Cc1cc(cc(c1)CSCc2ccccn2)C 62a_100000181317_100000721315 [0,2,0,0,0,0|1,1,0]=4 30606 B18R2.3665 Cc1cc(cc(c1)CSCc2ccccn2)C 62a_100000721315_100000181317 [0,2,0,0,0,0|1,1,0]=4 30607 B18R2.3665 Cc1cc(cc(c1)CSCc2ccccn2)F 62a_100000721315_100011219130 [0,2,0,0,0,0|1,1,0]=4 30608 B18R2.3665 Cc1cc(cc(c1)CSCc2ccccn2)F 62a_100011219130_100000721315 [0,2,0,0,0,0|1,1,0]=4 30609 B18R2.3665 Cc1cc(cc(c1)CSCc2cccnc2)Br 62a_100000741622_100012348363 [0,2,0,0,0,0|1,1,0]=4 30610 B18R2.3665 Cc1cc(cc(c1)CSCc2cccnc2)Br 62a_100012348363_100000741622 [0,2,0,0,0,0|1,1,0]=4 30611 B18R2.3665 Cc1cc(cc(c1)CSCc2cccnc2)C 62a_100000181317_100000741622 [0,2,0,0,0,0|1,1,0]=4 30612 B18R2.3665 Cc1cc(cc(c1)CSCc2cccnc2)C 62a_100000741622_100000181317 [0,2,0,0,0,0|1,1,0]=4 30613 B18R2.3665 Cc1cc(cc(c1)CSCc2cccnc2)F 62a_100000741622_100011219130 [0,2,0,0,0,0|1,1,0]=4 30614 B18R2.3665 Cc1cc(cc(c1)CSCc2cccnc2)F 62a_100011219130_100000741622 [0,2,0,0,0,0|1,1,0]=4 30615 B18R2.3665 Cc1cc(cc(c1)CSCc2ccncc2)Br 62a_100012348363_100015193705 [0,2,0,0,0,0|1,1,0]=4 30616 B18R2.3665 Cc1cc(cc(c1)CSCc2ccncc2)Br 62a_100015193705_100012348363 [0,2,0,0,0,0|1,1,0]=4 30617 B18R2.3665 Cc1cc(cc(c1)CSCc2ccncc2)C 62a_100000181317_100015193705 [0,2,0,0,0,0|1,1,0]=4 30618 B18R2.3665 Cc1cc(cc(c1)CSCc2ccncc2)C 62a_100015193705_100000181317 [0,2,0,0,0,0|1,1,0]=4 30619 B18R2.3665 Cc1cc(cc(c1)CSCc2ccncc2)F 62a_100011219130_100015193705 [0,2,0,0,0,0|1,1,0]=4 30620 B18R2.3665 Cc1cc(cc(c1)CSCc2ccncc2)F 62a_100015193705_100011219130 [0,2,0,0,0,0|1,1,0]=4 30621 B18R2.3665 Cc1cc(cc(c1)NCCc2ccccc2)Br 34a_100000695972_100000765856 [0,2,0,0,0,0|2,0,0]=4 30622 B18R2.3665 Cc1cc(cc(c1)NCCc2ccccc2)Br 7a_100000695972_100000765856 [0,2,0,0,0,0|2,0,0]=4 30623 B18R2.3665 Cc1cc(cc(c1)NCCc2ccccc2)C 2230a_100000210930_100000765856 [0,2,0,0,0,0|2,0,0]=4 30624 B18R2.3665 Cc1cc(cc(c1)NCCc2ccccc2)C 34a_100000210930_100000765856 [0,2,0,0,0,0|2,0,0]=4 30625 B18R2.3665 Cc1cc(cc(c1)NCCc2ccccc2)C 7a_100000210930_100000765856 [0,2,0,0,0,0|2,0,0]=4 30626 B18R2.3665 Cc1cc(cc(c1)NCCc2ccccc2)Cl 2230a_100012022512_100000765856 [0,2,0,0,0,0|2,0,0]=4 30627 B18R2.3665 Cc1cc(cc(c1)NCCc2ccccc2)Cl 34a_100012022512_100000765856 [0,2,0,0,0,0|2,0,0]=4 30628 B18R2.3665 Cc1cc(cc(c1)NCCc2ccccc2)Cl 7a_100012022512_100000765856 [0,2,0,0,0,0|2,0,0]=4 30629 B18R2.3665 Cc1cc(cc(c1)NCCc2ccccc2)F 2230a_100000742734_100000765856 [0,2,0,0,0,0|2,0,0]=4 30630 B18R2.3665 Cc1cc(cc(c1)NCCc2ccccc2)F 34a_100000742734_100000765856 [0,2,0,0,0,0|2,0,0]=4 30631 B18R2.3665 Cc1cc(cc(c1)NCCc2ccccc2)F 7a_100000742734_100000765856 [0,2,0,0,0,0|2,0,0]=4 30632 B18R2.3665 Cc1cc(cc(c1)NCCc2ccccc2)O 34a_100011995906_100000765856 [0,2,0,0,0,0|2,0,0]=4 30633 B18R2.3665 Cc1cc(cc(c1)NCCc2ccccc2)O 7a_100011995906_100000765856 [0,2,0,0,0,0|2,0,0]=4 30634 B18R2.3665 Cc1cc(cc(c1)OCCc2ccccc2)Br 34a_100011999630_100000765856 [0,2,0,0,0,0|2,0,0]=4 30635 B18R2.3665 Cc1cc(cc(c1)OCCc2ccccc2)Br 7a_100011999630_100000765856 [0,2,0,0,0,0|2,0,0]=4 30636 B18R2.3665 Cc1cc(cc(c1)OCCc2ccccc2)C 34a_100000210933_100000765856 [0,2,0,0,0,0|2,0,0]=4 30637 B18R2.3665 Cc1cc(cc(c1)OCCc2ccccc2)C 7a_100000210933_100000765856 [0,2,0,0,0,0|2,0,0]=4 30638 B18R2.3665 Cc1cc(cc(c1)OCCc2ccccc2)Cl 34a_100000087485_100000765856 [0,2,0,0,0,0|2,0,0]=4 30639 B18R2.3665 Cc1cc(cc(c1)OCCc2ccccc2)Cl 7a_100000087485_100000765856 [0,2,0,0,0,0|2,0,0]=4 30640 B18R2.3665 Cc1cc(cc(c1)OCCc2ccccc2)F 34a_100011830401_100000765856 [0,2,0,0,0,0|2,0,0]=4 30641 B18R2.3665 Cc1cc(cc(c1)OCCc2ccccc2)F 7a_100011830401_100000765856 [0,2,0,0,0,0|2,0,0]=4 30642 B18R2.3665 Cc1cc(cc(c1)OCCc2ccccc2)N 34a_100011995906_100000765856 [0,2,0,0,0,0|2,0,0]=4 30643 B18R2.3665 Cc1cc(cc(c1)OCCc2ccccc2)N 7a_100011995906_100000765856 [0,2,0,0,0,0|2,0,0]=4 30644 B18R2.3665 Cc1cc(cc(c1)SCCc2ccccc2)C 62a_100000765856_100011215608 [0,2,0,0,0,0|2,0,0]=4 30645 B18R2.3665 Cc1cc(cc(c1)SCCc2ccccc2)C 62a_100011215608_100011218657 [0,2,0,0,0,0|2,0,0]=4 30646 B18R2.3665 Cc1cc(cc(c1)SCCc2ccccc2)Cl 62a_100000765856_100010172791 [0,2,0,0,0,0|2,0,0]=4 30647 B18R2.3665 Cc1cc(cc(c1)SCCc2ccccc2)Cl 62a_100010172791_100011218657 [0,2,0,0,0,0|2,0,0]=4 30648 B18R2.3665 Cc1cc(cc(c1)SCCc2ccccc2)F 62a_100000765856_100011356977 [0,2,0,0,0,0|2,0,0]=4 30649 B18R2.3665 Cc1cc(cc(c1)SCCc2ccccc2)F 62a_100011356977_100011218657 [0,2,0,0,0,0|2,0,0]=4 30650 B18R2.3665 Cc1cc(cc(c1)SCCc2ccccc2)N 62a_100000695972_100011218657 [0,2,0,0,0,0|2,0,0]=4 30651 B18R2.3665 Cc1cc(cc(c1)SCCc2ccccc2)N 62a_100000765856_100000695972 [0,2,0,0,0,0|2,0,0]=4 30652 B18R2.3665 Cc1cc(cc(c1)SCCc2ccccc2)O 62a_100000765856_100011999630 [0,2,0,0,0,0|2,0,0]=4 30653 B18R2.3665 Cc1cc(cc(n1)C)CNCc2ccccc2 207a_100015324214_100011997668 [0,2,0,0,0,0|2,0,0]=4 30654 B18R2.3665 Cc1cc(cc(n1)C)CNCc2ccccc2 2230a_100015324214_200000139866 [0,2,0,0,0,0|2,0,0]=4 30655 B18R2.3665 Cc1cc(cc(n1)C)CNCc2ccccc2 270004a_100015324214_100011997668 [0,2,0,0,0,0|2,0,0]=4 30656 B18R2.3665 Cc1cc(cc(n1)C)CNCc2ccccc2 34a_100015324214_200000139866 [0,2,0,0,0,0|2,0,0]=4 30657 B18R2.3665 Cc1cc(cc(n1)C)COCc2ccccc2 34a_100000210790_200000139866 [0,2,0,0,0,0|1,0,0]=3 30658 B18R2.3665 Cc1cc(cc(n1)C)COCc2ccccc2 34a_100012017140_100015291786 [0,2,0,0,0,0|1,0,0]=3 30659 B18R2.3665 Cc1cc(cc(n1)C)COCc2ccccc2 7a_100000210790_200000139866 [0,2,0,0,0,0|1,0,0]=3 30660 B18R2.3665 Cc1cc(cc(n1)C)COCc2ccccn2 34a_100012017140_100000721315 [0,2,0,0,0,0|2,0,0]=4 30661 B18R2.3665 Cc1cc(cc(n1)C)COCc2cccnc2 34a_100012017140_100000733263 [0,2,0,0,0,0|2,0,0]=4 30662 B18R2.3665 Cc1cc(cc(n1)C)CSCc2ccccc2 62a_100000211182_200000139866 [0,2,0,0,0,0|1,1,0]=4 30663 B18R2.3665 Cc1cc(cc(n1)C)CSCc2ccccc2 62a_200000139866_100015291786 [0,2,0,0,0,0|1,1,0]=4 30664 B18R2.3665 Cc1cc(cc(n1)CNCc2ccccc2)Br 270004a_100010178683_100015611070 [0,2,0,0,0,0|2,0,0]=4 30665 B18R2.3665 Cc1cc(cc(n1)CNCc2ccccc2)Br 270004a_100015324214_100009814795 [0,2,0,0,0,0|2,0,0]=4 30666 B18R2.3665 Cc1cc(cc(n1)COCc2ccccc2)Br 34a_100010178681_100015291786 [0,2,0,0,0,0|1,0,0]=3 30667 B18R2.3665 Cc1cc(cc(n1)COCc2ccccn2)Br 34a_100010178681_100000721315 [0,2,0,0,0,0|2,0,0]=4 30668 B18R2.3665 Cc1cc(cc(n1)COCc2cccnc2)Br 34a_100010178681_100000733263 [0,2,0,0,0,0|2,0,0]=4 30669 B18R2.3665 Cc1cc(nc(c1)CNCc2ccccc2)C 2230a_100015324214_100012357514 [0,2,0,0,0,0|2,0,0]=4 30670 B18R2.3665 Cc1cc(nc(c1)CNCc2ccccc2)C 34a_100015324214_100012357514 [0,2,0,0,0,0|2,0,0]=4 30671 B18R2.3665 Cc1cc(nc(c1)COCc2ccccc2)C 34a_100000210790_100012357514 [0,2,0,0,0,0|1,0,0]=3 30672 B18R2.3665 Cc1cc(nc(c1)COCc2ccccc2)C 34a_100012182918_100015291786 [0,2,0,0,0,0|1,0,0]=3 30673 B18R2.3665 Cc1cc(nc(c1)COCc2ccccc2)C 7a_100000210790_100012357514 [0,2,0,0,0,0|1,0,0]=3 30674 B18R2.3665 Cc1cc(nc(c1)COCc2ccccn2)C 34a_100012182918_100000721315 [0,2,0,0,0,0|2,0,0]=4 30675 B18R2.3665 Cc1cc(nc(c1)COCc2cccnc2)C 34a_100012182918_100000733263 [0,2,0,0,0,0|2,0,0]=4 30676 B18R2.3665 Cc1cc(nc(c1)CSCc2ccccc2)C 62a_100000211182_100012357514 [0,2,0,0,0,0|1,1,0]=4 30677 B18R2.3665 Cc1cc(nc(c1)CSCc2ccccc2)C 62a_100012357514_100015291786 [0,2,0,0,0,0|1,1,0]=4 30678 B18R2.3665 Cc1cc(nc(n1)COCc2ccccc2)C 34a_100000210790_100011935097 [0,2,0,0,0,0|2,0,0]=4 30679 B18R2.3665 Cc1cc(nc(n1)COCc2ccccc2)C 7a_100000210790_100011935097 [0,2,0,0,0,0|2,0,0]=4 30680 B18R2.3665 Clc1cc(cc(c1)C=CCc2ccccc2)Br 271570a_200016263579_100009814755 [0,2,0,0,0,0|1,0,1]=4 30681 B18R2.3665 Clc1cc(cc(c1)C=CCc2ccccc2)Cl 271570a_200016263579_100000747138 [0,2,0,0,0,0|1,0,1]=4 30682 B18R2.3665 Clc1cc(cc(c1)CCNc2ccccc2)Cl 34a_100000106764_100000691793 [0,2,0,0,0,0|2,0,0]=4 30683 B18R2.3665 Clc1cc(cc(c1)CCOc2ccccc2)Cl 34a_100000210340_100000691793 [0,2,0,0,0,0|2,0,0]=4 30684 B18R2.3665 Clc1cc(cc(c1)CCOc2ccccc2)Cl 7a_100000210340_100000691793 [0,2,0,0,0,0|2,0,0]=4 30685 B18R2.3665 Clc1cc(cc(c1)CCSc2ccccc2)Cl 62a_100000691793_100000041952 [0,2,0,0,0,0|2,0,0]=4 30686 B18R2.3665 Clc1cc(cc(c1)CCSc2ccccc2)Cl 62a_100000719477_100000691793 [0,2,0,0,0,0|2,0,0]=4 30687 B18R2.3665 Clc1cc(cc(c1)CNCc2ccccc2)Br 207a_100015324214_100011934515 [0,2,0,0,0,0|1,0,0]=3 30688 B18R2.3665 Clc1cc(cc(c1)CNCc2ccccc2)Br 269862a_100015324214_100011934515 [0,2,0,0,0,0|1,0,0]=3 30689 B18R2.3665 Clc1cc(cc(c1)CNCc2ccccc2)Br 270004a_100015324214_100011934515 [0,2,0,0,0,0|1,0,0]=3 30690 B18R2.3665 Clc1cc(cc(c1)CNCc2ccccc2)Cl 207a_100011211636_100015611070 [0,2,0,0,0,0|1,0,0]=3 30691 B18R2.3665 Clc1cc(cc(c1)CNCc2ccccc2)Cl 207a_100015324214_100000741761 [0,2,0,0,0,0|1,0,0]=3 30692 B18R2.3665 Clc1cc(cc(c1)CNCc2ccccc2)Cl 2230a_100011211636_100015291786 [0,2,0,0,0,0|1,0,0]=3 30693 B18R2.3665 Clc1cc(cc(c1)CNCc2ccccc2)Cl 2230a_100015324214_100000685807 [0,2,0,0,0,0|1,0,0]=3 30694 B18R2.3665 Clc1cc(cc(c1)CNCc2ccccc2)Cl 270004a_100011211636_100015611070 [0,2,0,0,0,0|1,0,0]=3 30695 B18R2.3665 Clc1cc(cc(c1)CNCc2ccccc2)Cl 270004a_100015324214_100000741761 [0,2,0,0,0,0|1,0,0]=3 30696 B18R2.3665 Clc1cc(cc(c1)CNCc2ccccc2)Cl 34a_100011211636_100015291786 [0,2,0,0,0,0|1,0,0]=3 30697 B18R2.3665 Clc1cc(cc(c1)CNCc2ccccn2)Br 270004a_100000210449_100011934515 [0,2,0,0,0,0|2,0,0]=4 30698 B18R2.3665 Clc1cc(cc(c1)CNCc2ccccn2)Cl 207a_100011211636_100000209966 [0,2,0,0,0,0|2,0,0]=4 30699 B18R2.3665 Clc1cc(cc(c1)CNCc2ccccn2)Cl 2230a_100011211636_100000721315 [0,2,0,0,0,0|2,0,0]=4 30700 B18R2.3665 Clc1cc(cc(c1)CNCc2ccccn2)Cl 270004a_100000210449_100000741761 [0,2,0,0,0,0|2,0,0]=4 30701 B18R2.3665 Clc1cc(cc(c1)CNCc2ccccn2)Cl 270004a_100011211636_100000209966 [0,2,0,0,0,0|2,0,0]=4 30702 B18R2.3665 Clc1cc(cc(c1)CNCc2ccccn2)Cl 34a_100011211636_100000721315 [0,2,0,0,0,0|2,0,0]=4 30703 B18R2.3665 Clc1cc(cc(c1)CNCc2cccnc2)Br 207a_100000210453_100011934515 [0,2,0,0,0,0|2,0,0]=4 30704 B18R2.3665 Clc1cc(cc(c1)CNCc2cccnc2)Br 269862a_100000210453_100011934515 [0,2,0,0,0,0|2,0,0]=4 30705 B18R2.3665 Clc1cc(cc(c1)CNCc2cccnc2)Br 270004a_100000210453_100011934515 [0,2,0,0,0,0|2,0,0]=4 30706 B18R2.3665 Clc1cc(cc(c1)CNCc2cccnc2)Cl 207a_100000210453_100000741761 [0,2,0,0,0,0|2,0,0]=4 30707 B18R2.3665 Clc1cc(cc(c1)CNCc2cccnc2)Cl 207a_100011211636_100000209961 [0,2,0,0,0,0|2,0,0]=4 30708 B18R2.3665 Clc1cc(cc(c1)CNCc2cccnc2)Cl 2230a_100011211636_100000741622 [0,2,0,0,0,0|2,0,0]=4 30709 B18R2.3665 Clc1cc(cc(c1)CNCc2cccnc2)Cl 270004a_100000210453_100000741761 [0,2,0,0,0,0|2,0,0]=4 30710 B18R2.3665 Clc1cc(cc(c1)CNCc2cccnc2)Cl 270004a_100011211636_100000209961 [0,2,0,0,0,0|2,0,0]=4 30711 B18R2.3665 Clc1cc(cc(c1)CNCc2cccnc2)Cl 34a_100011211636_100000733263 [0,2,0,0,0,0|2,0,0]=4 30712 B18R2.3665 Clc1cc(cc(c1)CNCc2ccncc2)Br 269862a_100000210450_100011934515 [0,2,0,0,0,0|2,0,0]=4 30713 B18R2.3665 Clc1cc(cc(c1)CNCc2ccncc2)Cl 207a_100011211636_100000186114 [0,2,0,0,0,0|2,0,0]=4 30714 B18R2.3665 Clc1cc(cc(c1)CNCc2ccncc2)Cl 2230a_100011211636_100015193705 [0,2,0,0,0,0|2,0,0]=4 30715 B18R2.3665 Clc1cc(cc(c1)COCc2ccccc2)Br 34a_100012353933_100015291786 [0,2,0,0,0,0|0,0,0]=2 30716 B18R2.3665 Clc1cc(cc(c1)COCc2ccccc2)Br 7a_100012353933_100000211182 [0,2,0,0,0,0|0,0,0]=2 30717 B18R2.3665 Clc1cc(cc(c1)COCc2ccccc2)Cl 34a_100011218629_100015291786 [0,2,0,0,0,0|0,0,0]=2 30718 B18R2.3665 Clc1cc(cc(c1)COCc2ccccc2)Cl 7a_100000210790_100011219208 [0,2,0,0,0,0|0,0,0]=2 30719 B18R2.3665 Clc1cc(cc(c1)COCc2ccccc2)Cl 7a_100011218629_100000211182 [0,2,0,0,0,0|0,0,0]=2 30720 B18R2.3665 Clc1cc(cc(c1)COCc2ccccn2)Br 34a_100012353933_100000721315 [0,2,0,0,0,0|1,0,0]=3 30721 B18R2.3665 Clc1cc(cc(c1)COCc2ccccn2)Br 7a_100012353933_100000721315 [0,2,0,0,0,0|1,0,0]=3 30722 B18R2.3665 Clc1cc(cc(c1)COCc2ccccn2)Cl 34a_100011218629_100000721315 [0,2,0,0,0,0|1,0,0]=3 30723 B18R2.3665 Clc1cc(cc(c1)COCc2ccccn2)Cl 7a_100011218629_100000721315 [0,2,0,0,0,0|1,0,0]=3 30724 B18R2.3665 Clc1cc(cc(c1)COCc2cccnc2)Br 34a_100012353933_100000733263 [0,2,0,0,0,0|1,0,0]=3 30725 B18R2.3665 Clc1cc(cc(c1)COCc2cccnc2)Br 7a_100012353933_100000741622 [0,2,0,0,0,0|1,0,0]=3 30726 B18R2.3665 Clc1cc(cc(c1)COCc2cccnc2)Cl 34a_100011218629_100000733263 [0,2,0,0,0,0|1,0,0]=3 30727 B18R2.3665 Clc1cc(cc(c1)COCc2cccnc2)Cl 7a_100011218629_100000741622 [0,2,0,0,0,0|1,0,0]=3 30728 B18R2.3665 Clc1cc(cc(c1)COCc2cccnn2)Br 34a_100012353933_100016990269 [0,2,0,0,0,0|2,0,0]=4 30729 B18R2.3665 Clc1cc(cc(c1)COCc2cccnn2)Br 7a_100012353933_100016990269 [0,2,0,0,0,0|2,0,0]=4 30730 B18R2.3665 Clc1cc(cc(c1)COCc2cccnn2)Cl 34a_100011218629_100016990269 [0,2,0,0,0,0|2,0,0]=4 30731 B18R2.3665 Clc1cc(cc(c1)COCc2cccnn2)Cl 7a_100011218629_100016990269 [0,2,0,0,0,0|2,0,0]=4 30732 B18R2.3665 Clc1cc(cc(c1)COCc2ccncc2)Br 7a_100012353933_100015193705 [0,2,0,0,0,0|1,0,0]=3 30733 B18R2.3665 Clc1cc(cc(c1)COCc2ccncc2)Cl 7a_100011218629_100015193705 [0,2,0,0,0,0|1,0,0]=3 30734 B18R2.3665 Clc1cc(cc(c1)COCc2cnccn2)Br 34a_100012353933_100016995436 [0,2,0,0,0,0|2,0,0]=4 30735 B18R2.3665 Clc1cc(cc(c1)COCc2cnccn2)Br 7a_100012353933_100016995436 [0,2,0,0,0,0|2,0,0]=4 30736 B18R2.3665 Clc1cc(cc(c1)COCc2cnccn2)Cl 34a_100011218629_100016995436 [0,2,0,0,0,0|2,0,0]=4 30737 B18R2.3665 Clc1cc(cc(c1)COCc2cnccn2)Cl 7a_100011218629_100016995436 [0,2,0,0,0,0|2,0,0]=4 30738 B18R2.3665 Clc1cc(cc(c1)COCc2cncnc2)Br 34a_100012353933_100015196519 [0,2,0,0,0,0|2,0,0]=4 30739 B18R2.3665 Clc1cc(cc(c1)COCc2cncnc2)Br 7a_100012353933_100015196519 [0,2,0,0,0,0|2,0,0]=4 30740 B18R2.3665 Clc1cc(cc(c1)COCc2cncnc2)Cl 34a_100011218629_100015196519 [0,2,0,0,0,0|2,0,0]=4 30741 B18R2.3665 Clc1cc(cc(c1)COCc2cncnc2)Cl 7a_100011218629_100015196519 [0,2,0,0,0,0|2,0,0]=4 30742 B18R2.3665 Clc1cc(cc(c1)COCc2ncccn2)Br 34a_100012353933_100000703007 [0,2,0,0,0,0|2,0,0]=4 30743 B18R2.3665 Clc1cc(cc(c1)COCc2ncccn2)Br 7a_100012353933_100000703007 [0,2,0,0,0,0|2,0,0]=4 30744 B18R2.3665 Clc1cc(cc(c1)COCc2ncccn2)Cl 34a_100011218629_100000703007 [0,2,0,0,0,0|2,0,0]=4 30745 B18R2.3665 Clc1cc(cc(c1)COCc2ncccn2)Cl 7a_100011218629_100000703007 [0,2,0,0,0,0|2,0,0]=4 30746 B18R2.3665 Clc1cc(cc(c1)CSCc2ccccc2)Cl 62a_100000211182_100011219208 [0,2,0,0,0,0|0,1,0]=3 30747 B18R2.3665 Clc1cc(cc(c1)CSCc2ccccc2)Cl 62a_100011219208_100015291786 [0,2,0,0,0,0|0,1,0]=3 30748 B18R2.3665 Clc1cc(cc(c1)CSCc2ccccn2)Cl 62a_100000721315_100011219208 [0,2,0,0,0,0|1,1,0]=4 30749 B18R2.3665 Clc1cc(cc(c1)CSCc2ccccn2)Cl 62a_100011219208_100000721315 [0,2,0,0,0,0|1,1,0]=4 30750 B18R2.3665 Clc1cc(cc(c1)CSCc2cccnc2)Cl 62a_100000741622_100011219208 [0,2,0,0,0,0|1,1,0]=4 30751 B18R2.3665 Clc1cc(cc(c1)CSCc2cccnc2)Cl 62a_100011219208_100000741622 [0,2,0,0,0,0|1,1,0]=4 30752 B18R2.3665 Clc1cc(cc(c1)CSCc2ccncc2)Cl 62a_100011219208_100015193705 [0,2,0,0,0,0|1,1,0]=4 30753 B18R2.3665 Clc1cc(cc(c1)CSCc2ccncc2)Cl 62a_100015193705_100011219208 [0,2,0,0,0,0|1,1,0]=4 30754 B18R2.3665 Clc1cc(cc(c1)NCCc2ccccc2)Br 34a_100011934539_100000765856 [0,2,0,0,0,0|2,0,0]=4 30755 B18R2.3665 Clc1cc(cc(c1)NCCc2ccccc2)Br 7a_100011934539_100000765856 [0,2,0,0,0,0|2,0,0]=4 30756 B18R2.3665 Clc1cc(cc(c1)NCCc2ccccc2)Cl 34a_100000210456_100000765856 [0,2,0,0,0,0|2,0,0]=4 30757 B18R2.3665 Clc1cc(cc(c1)NCCc2ccccc2)Cl 7a_100000210456_100000765856 [0,2,0,0,0,0|2,0,0]=4 30758 B18R2.3665 Clc1cc(cc(c1)NCCc2ccccc2)I 7a_100010147676_100000765856 [0,2,0,0,0,0|2,0,0]=4 30759 B18R2.3665 Clc1cc(cc(c1)OCCc2ccccc2)Br 34a_100010185897_100000765856 [0,2,0,0,0,0|2,0,0]=4 30760 B18R2.3665 Clc1cc(cc(c1)OCCc2ccccc2)Br 7a_100010185897_100000765856 [0,2,0,0,0,0|2,0,0]=4 30761 B18R2.3665 Clc1cc(cc(c1)OCCc2ccccc2)Cl 34a_100000181315_100000765856 [0,2,0,0,0,0|2,0,0]=4 30762 B18R2.3665 Clc1cc(cc(c1)OCCc2ccccc2)Cl 7a_100000181315_100000765856 [0,2,0,0,0,0|2,0,0]=4 30763 B18R2.3665 Clc1cc(cc(c1)OCCc2ccccc2)I 34a_100010068924_100000765856 [0,2,0,0,0,0|2,0,0]=4 30764 B18R2.3665 Clc1cc(cc(c1)OCCc2ccccc2)I 7a_100010068924_100000765856 [0,2,0,0,0,0|2,0,0]=4 30765 B18R2.3665 Clc1cc(cc(c1)SCCc2ccccc2)Br 62a_100000765856_100009814755 [0,2,0,0,0,0|2,0,0]=4 30766 B18R2.3665 Clc1cc(cc(c1)SCCc2ccccc2)Br 62a_100009814755_100011218657 [0,2,0,0,0,0|2,0,0]=4 30767 B18R2.3665 Clc1cc(cc(c1)SCCc2ccccc2)Cl 62a_100000747138_100011218657 [0,2,0,0,0,0|2,0,0]=4 30768 B18R2.3665 Clc1cc(cc(c1)SCCc2ccccc2)Cl 62a_100000765856_100000747138 [0,2,0,0,0,0|2,0,0]=4 30769 B18R2.3665 Clc1cc(cc(n1)Cl)CNCc2ccccc2 2230a_100015324214_100000052781 [0,2,0,0,0,0|2,0,0]=4 30770 B18R2.3665 Clc1cc(cc(n1)Cl)CNCc2ccccc2 2230a_103437231814_100015291786 [0,2,0,0,0,0|2,0,0]=4 30771 B18R2.3665 Clc1cc(cc(n1)Cl)CNCc2ccccc2 270004a_100015324214_100000043607 [0,2,0,0,0,0|2,0,0]=4 30772 B18R2.3665 Clc1cc(cc(n1)Cl)CNCc2ccccc2 270004a_103437231814_100015611070 [0,2,0,0,0,0|2,0,0]=4 30773 B18R2.3665 Clc1cc(cc(n1)Cl)COCc2ccccc2 34a_100000041643_100015291786 [0,2,0,0,0,0|1,0,0]=3 30774 B18R2.3665 Clc1cc(cc(n1)Cl)COCc2ccccc2 7a_100000041643_100000211182 [0,2,0,0,0,0|1,0,0]=3 30775 B18R2.3665 Clc1cc(cc(n1)Cl)COCc2ccccc2 7a_100000210790_100000052781 [0,2,0,0,0,0|1,0,0]=3 30776 B18R2.3665 Clc1cc(cc(n1)Cl)COCc2ccccn2 34a_100000041643_100000721315 [0,2,0,0,0,0|2,0,0]=4 30777 B18R2.3665 Clc1cc(cc(n1)Cl)COCc2ccccn2 7a_100000041643_100000721315 [0,2,0,0,0,0|2,0,0]=4 30778 B18R2.3665 Clc1cc(cc(n1)Cl)COCc2cccnc2 34a_100000041643_100000733263 [0,2,0,0,0,0|2,0,0]=4 30779 B18R2.3665 Clc1cc(cc(n1)Cl)COCc2cccnc2 7a_100000041643_100000741622 [0,2,0,0,0,0|2,0,0]=4 30780 B18R2.3665 Clc1cc(cc(n1)Cl)COCc2ccncc2 7a_100000041643_100015193705 [0,2,0,0,0,0|2,0,0]=4 30781 B18R2.3665 Clc1cc(cc(n1)Cl)CSCc2ccccc2 62a_100000052781_100015291786 [0,2,0,0,0,0|1,1,0]=4 30782 B18R2.3665 Clc1cc(cc(n1)Cl)CSCc2ccccc2 62a_100000211182_100000052781 [0,2,0,0,0,0|1,1,0]=4 30783 B18R2.3665 Clc1cc(nc(c1)CNCc2ccccc2)Cl 270004a_100015324214_200009876806 [0,2,0,0,0,0|2,0,0]=4 30784 B18R2.3665 Fc1cc(cc(c1)C=CCc2ccccc2)Br 271570a_200016263579_100009814764 [0,2,0,0,0,0|1,0,1]=4 30785 B18R2.3665 Fc1cc(cc(c1)C=CCc2ccccc2)Cl 271570a_200016263579_100013859453 [0,2,0,0,0,0|1,0,1]=4 30786 B18R2.3665 Fc1cc(cc(c1)C=CCc2ccccc2)F 271570a_200016263579_100011218498 [0,2,0,0,0,0|1,0,1]=4 30787 B18R2.3665 Fc1cc(cc(c1)CCNc2ccccc2)F 34a_100000106764_100011754442 [0,2,0,0,0,0|2,0,0]=4 30788 B18R2.3665 Fc1cc(cc(c1)CCOc2ccccc2)F 34a_100000210340_100011754442 [0,2,0,0,0,0|2,0,0]=4 30789 B18R2.3665 Fc1cc(cc(c1)CCOc2ccccc2)F 7a_100000210340_100011754442 [0,2,0,0,0,0|2,0,0]=4 30790 B18R2.3665 Fc1cc(cc(c1)CCSc2ccccc2)F 62a_100000719477_100011754442 [0,2,0,0,0,0|2,0,0]=4 30791 B18R2.3665 Fc1cc(cc(c1)CCSc2ccccc2)F 62a_100011754442_100000041952 [0,2,0,0,0,0|2,0,0]=4 30792 B18R2.3665 Fc1cc(cc(c1)CNCc2ccccc2)Br 207a_100015324214_100011794424 [0,2,0,0,0,0|1,0,0]=3 30793 B18R2.3665 Fc1cc(cc(c1)CNCc2ccccc2)Br 207a_100020611034_100015611070 [0,2,0,0,0,0|1,0,0]=3 30794 B18R2.3665 Fc1cc(cc(c1)CNCc2ccccc2)Br 2230a_100015324214_100000766940 [0,2,0,0,0,0|1,0,0]=3 30795 B18R2.3665 Fc1cc(cc(c1)CNCc2ccccc2)Br 2230a_100020611034_100015291786 [0,2,0,0,0,0|1,0,0]=3 30796 B18R2.3665 Fc1cc(cc(c1)CNCc2ccccc2)Br 269862a_100015324214_100011794424 [0,2,0,0,0,0|1,0,0]=3 30797 B18R2.3665 Fc1cc(cc(c1)CNCc2ccccc2)Br 270004a_100015324214_100011794424 [0,2,0,0,0,0|1,0,0]=3 30798 B18R2.3665 Fc1cc(cc(c1)CNCc2ccccc2)Br 270004a_100020611034_100015611070 [0,2,0,0,0,0|1,0,0]=3 30799 B18R2.3665 Fc1cc(cc(c1)CNCc2ccccc2)Br 34a_100015324214_100000766940 [0,2,0,0,0,0|1,0,0]=3 30800 B18R2.3665 Fc1cc(cc(c1)CNCc2ccccc2)Br 34a_100020611034_100015291786 [0,2,0,0,0,0|1,0,0]=3 30801 B18R2.3665 Fc1cc(cc(c1)CNCc2ccccc2)Cl 207a_100015324214_100000703917 [0,2,0,0,0,0|1,0,0]=3 30802 B18R2.3665 Fc1cc(cc(c1)CNCc2ccccc2)Cl 207a_100137329012_100015611070 [0,2,0,0,0,0|1,0,0]=3 30803 B18R2.3665 Fc1cc(cc(c1)CNCc2ccccc2)Cl 2230a_100015324214_100011219885 [0,2,0,0,0,0|1,0,0]=3 30804 B18R2.3665 Fc1cc(cc(c1)CNCc2ccccc2)Cl 2230a_100137329012_100015291786 [0,2,0,0,0,0|1,0,0]=3 30805 B18R2.3665 Fc1cc(cc(c1)CNCc2ccccc2)Cl 269862a_100015324214_100000703917 [0,2,0,0,0,0|1,0,0]=3 30806 B18R2.3665 Fc1cc(cc(c1)CNCc2ccccc2)Cl 270004a_100015324214_100000703917 [0,2,0,0,0,0|1,0,0]=3 30807 B18R2.3665 Fc1cc(cc(c1)CNCc2ccccc2)Cl 270004a_100137329012_100015611070 [0,2,0,0,0,0|1,0,0]=3 30808 B18R2.3665 Fc1cc(cc(c1)CNCc2ccccc2)Cl 34a_100015324214_100011219885 [0,2,0,0,0,0|1,0,0]=3 30809 B18R2.3665 Fc1cc(cc(c1)CNCc2ccccc2)Cl 34a_100137329012_100015291786 [0,2,0,0,0,0|1,0,0]=3 30810 B18R2.3665 Fc1cc(cc(c1)CNCc2ccccc2)F 207a_100000737602_100015611070 [0,2,0,0,0,0|1,0,0]=3 30811 B18R2.3665 Fc1cc(cc(c1)CNCc2ccccc2)F 207a_100015324214_100000743029 [0,2,0,0,0,0|1,0,0]=3 30812 B18R2.3665 Fc1cc(cc(c1)CNCc2ccccc2)F 2230a_100000737602_100015291786 [0,2,0,0,0,0|1,0,0]=3 30813 B18R2.3665 Fc1cc(cc(c1)CNCc2ccccc2)F 2230a_100015324214_100000697002 [0,2,0,0,0,0|1,0,0]=3 30814 B18R2.3665 Fc1cc(cc(c1)CNCc2ccccc2)F 269862a_100015324214_100000743029 [0,2,0,0,0,0|1,0,0]=3 30815 B18R2.3665 Fc1cc(cc(c1)CNCc2ccccc2)F 270004a_100000737602_100015611070 [0,2,0,0,0,0|1,0,0]=3 30816 B18R2.3665 Fc1cc(cc(c1)CNCc2ccccc2)F 270004a_100015324214_100000743029 [0,2,0,0,0,0|1,0,0]=3 30817 B18R2.3665 Fc1cc(cc(c1)CNCc2ccccc2)F 34a_100000737602_100015291786 [0,2,0,0,0,0|1,0,0]=3 30818 B18R2.3665 Fc1cc(cc(c1)CNCc2ccccc2)F 34a_100015324214_100000697002 [0,2,0,0,0,0|1,0,0]=3 30819 B18R2.3665 Fc1cc(cc(c1)CNCc2ccccc2)I 207a_100015324214_100010185655 [0,2,0,0,0,0|1,0,0]=3 30820 B18R2.3665 Fc1cc(cc(c1)CNCc2ccccc2)I 2230a_100015324214_100010149605 [0,2,0,0,0,0|1,0,0]=3 30821 B18R2.3665 Fc1cc(cc(c1)CNCc2ccccc2)I 269862a_100015324214_100010185655 [0,2,0,0,0,0|1,0,0]=3 30822 B18R2.3665 Fc1cc(cc(c1)CNCc2ccccc2)I 270004a_100015324214_100010185655 [0,2,0,0,0,0|1,0,0]=3 30823 B18R2.3665 Fc1cc(cc(c1)CNCc2ccccc2)I 34a_100015324214_100010149605 [0,2,0,0,0,0|1,0,0]=3 30824 B18R2.3665 Fc1cc(cc(c1)CNCc2ccccn2)Br 207a_100020611034_100000209966 [0,2,0,0,0,0|2,0,0]=4 30825 B18R2.3665 Fc1cc(cc(c1)CNCc2ccccn2)Br 2230a_100020611034_100000721315 [0,2,0,0,0,0|2,0,0]=4 30826 B18R2.3665 Fc1cc(cc(c1)CNCc2ccccn2)Br 270004a_100000210449_100011794424 [0,2,0,0,0,0|2,0,0]=4 30827 B18R2.3665 Fc1cc(cc(c1)CNCc2ccccn2)Br 270004a_100020611034_100000209966 [0,2,0,0,0,0|2,0,0]=4 30828 B18R2.3665 Fc1cc(cc(c1)CNCc2ccccn2)Br 34a_100020611034_100000721315 [0,2,0,0,0,0|2,0,0]=4 30829 B18R2.3665 Fc1cc(cc(c1)CNCc2ccccn2)Cl 207a_100137329012_100000209966 [0,2,0,0,0,0|2,0,0]=4 30830 B18R2.3665 Fc1cc(cc(c1)CNCc2ccccn2)Cl 2230a_100137329012_100000721315 [0,2,0,0,0,0|2,0,0]=4 30831 B18R2.3665 Fc1cc(cc(c1)CNCc2ccccn2)Cl 270004a_100000210449_100000703917 [0,2,0,0,0,0|2,0,0]=4 30832 B18R2.3665 Fc1cc(cc(c1)CNCc2ccccn2)Cl 270004a_100137329012_100000209966 [0,2,0,0,0,0|2,0,0]=4 30833 B18R2.3665 Fc1cc(cc(c1)CNCc2ccccn2)Cl 34a_100137329012_100000721315 [0,2,0,0,0,0|2,0,0]=4 30834 B18R2.3665 Fc1cc(cc(c1)CNCc2ccccn2)F 207a_100000737602_100000209966 [0,2,0,0,0,0|2,0,0]=4 30835 B18R2.3665 Fc1cc(cc(c1)CNCc2ccccn2)F 2230a_100000737602_100000721315 [0,2,0,0,0,0|2,0,0]=4 30836 B18R2.3665 Fc1cc(cc(c1)CNCc2ccccn2)F 270004a_100000210449_100000743029 [0,2,0,0,0,0|2,0,0]=4 30837 B18R2.3665 Fc1cc(cc(c1)CNCc2ccccn2)F 270004a_100000737602_100000209966 [0,2,0,0,0,0|2,0,0]=4 30838 B18R2.3665 Fc1cc(cc(c1)CNCc2ccccn2)F 34a_100000737602_100000721315 [0,2,0,0,0,0|2,0,0]=4 30839 B18R2.3665 Fc1cc(cc(c1)CNCc2ccccn2)I 270004a_100000210449_100010185655 [0,2,0,0,0,0|2,0,0]=4 30840 B18R2.3665 Fc1cc(cc(c1)CNCc2cccnc2)Br 207a_100000210453_100011794424 [0,2,0,0,0,0|2,0,0]=4 30841 B18R2.3665 Fc1cc(cc(c1)CNCc2cccnc2)Br 207a_100020611034_100000209961 [0,2,0,0,0,0|2,0,0]=4 30842 B18R2.3665 Fc1cc(cc(c1)CNCc2cccnc2)Br 2230a_100020611034_100000741622 [0,2,0,0,0,0|2,0,0]=4 30843 B18R2.3665 Fc1cc(cc(c1)CNCc2cccnc2)Br 269862a_100000210453_100011794424 [0,2,0,0,0,0|2,0,0]=4 30844 B18R2.3665 Fc1cc(cc(c1)CNCc2cccnc2)Br 270004a_100000210453_100011794424 [0,2,0,0,0,0|2,0,0]=4 30845 B18R2.3665 Fc1cc(cc(c1)CNCc2cccnc2)Br 270004a_100020611034_100000209961 [0,2,0,0,0,0|2,0,0]=4 30846 B18R2.3665 Fc1cc(cc(c1)CNCc2cccnc2)Br 34a_100020611034_100000733263 [0,2,0,0,0,0|2,0,0]=4 30847 B18R2.3665 Fc1cc(cc(c1)CNCc2cccnc2)Cl 207a_100000210453_100000703917 [0,2,0,0,0,0|2,0,0]=4 30848 B18R2.3665 Fc1cc(cc(c1)CNCc2cccnc2)Cl 207a_100137329012_100000209961 [0,2,0,0,0,0|2,0,0]=4 30849 B18R2.3665 Fc1cc(cc(c1)CNCc2cccnc2)Cl 2230a_100137329012_100000741622 [0,2,0,0,0,0|2,0,0]=4 30850 B18R2.3665 Fc1cc(cc(c1)CNCc2cccnc2)Cl 269862a_100000210453_100000703917 [0,2,0,0,0,0|2,0,0]=4 30851 B18R2.3665 Fc1cc(cc(c1)CNCc2cccnc2)Cl 270004a_100000210453_100000703917 [0,2,0,0,0,0|2,0,0]=4 30852 B18R2.3665 Fc1cc(cc(c1)CNCc2cccnc2)Cl 270004a_100137329012_100000209961 [0,2,0,0,0,0|2,0,0]=4 30853 B18R2.3665 Fc1cc(cc(c1)CNCc2cccnc2)Cl 34a_100137329012_100000733263 [0,2,0,0,0,0|2,0,0]=4 30854 B18R2.3665 Fc1cc(cc(c1)CNCc2cccnc2)F 207a_100000210453_100000743029 [0,2,0,0,0,0|2,0,0]=4 30855 B18R2.3665 Fc1cc(cc(c1)CNCc2cccnc2)F 207a_100000737602_100000209961 [0,2,0,0,0,0|2,0,0]=4 30856 B18R2.3665 Fc1cc(cc(c1)CNCc2cccnc2)F 2230a_100000737602_100000741622 [0,2,0,0,0,0|2,0,0]=4 30857 B18R2.3665 Fc1cc(cc(c1)CNCc2cccnc2)F 269862a_100000210453_100000743029 [0,2,0,0,0,0|2,0,0]=4 30858 B18R2.3665 Fc1cc(cc(c1)CNCc2cccnc2)F 270004a_100000210453_100000743029 [0,2,0,0,0,0|2,0,0]=4 30859 B18R2.3665 Fc1cc(cc(c1)CNCc2cccnc2)F 270004a_100000737602_100000209961 [0,2,0,0,0,0|2,0,0]=4 30860 B18R2.3665 Fc1cc(cc(c1)CNCc2cccnc2)F 34a_100000737602_100000733263 [0,2,0,0,0,0|2,0,0]=4 30861 B18R2.3665 Fc1cc(cc(c1)CNCc2cccnc2)I 207a_100000210453_100010185655 [0,2,0,0,0,0|2,0,0]=4 30862 B18R2.3665 Fc1cc(cc(c1)CNCc2cccnc2)I 269862a_100000210453_100010185655 [0,2,0,0,0,0|2,0,0]=4 30863 B18R2.3665 Fc1cc(cc(c1)CNCc2cccnc2)I 270004a_100000210453_100010185655 [0,2,0,0,0,0|2,0,0]=4 30864 B18R2.3665 Fc1cc(cc(c1)CNCc2ccncc2)Br 207a_100020611034_100000186114 [0,2,0,0,0,0|2,0,0]=4 30865 B18R2.3665 Fc1cc(cc(c1)CNCc2ccncc2)Br 2230a_100020611034_100015193705 [0,2,0,0,0,0|2,0,0]=4 30866 B18R2.3665 Fc1cc(cc(c1)CNCc2ccncc2)Br 269862a_100000210450_100011794424 [0,2,0,0,0,0|2,0,0]=4 30867 B18R2.3665 Fc1cc(cc(c1)CNCc2ccncc2)Cl 207a_100137329012_100000186114 [0,2,0,0,0,0|2,0,0]=4 30868 B18R2.3665 Fc1cc(cc(c1)CNCc2ccncc2)Cl 2230a_100137329012_100015193705 [0,2,0,0,0,0|2,0,0]=4 30869 B18R2.3665 Fc1cc(cc(c1)CNCc2ccncc2)Cl 269862a_100000210450_100000703917 [0,2,0,0,0,0|2,0,0]=4 30870 B18R2.3665 Fc1cc(cc(c1)CNCc2ccncc2)F 207a_100000737602_100000186114 [0,2,0,0,0,0|2,0,0]=4 30871 B18R2.3665 Fc1cc(cc(c1)CNCc2ccncc2)F 2230a_100000737602_100015193705 [0,2,0,0,0,0|2,0,0]=4 30872 B18R2.3665 Fc1cc(cc(c1)CNCc2ccncc2)F 269862a_100000210450_100000743029 [0,2,0,0,0,0|2,0,0]=4 30873 B18R2.3665 Fc1cc(cc(c1)CNCc2ccncc2)I 269862a_100000210450_100010185655 [0,2,0,0,0,0|2,0,0]=4 30874 B18R2.3665 Fc1cc(cc(c1)COCc2ccccc2)Br 34a_100000210790_100000766940 [0,2,0,0,0,0|0,0,0]=2 30875 B18R2.3665 Fc1cc(cc(c1)COCc2ccccc2)Br 34a_100000766897_100015291786 [0,2,0,0,0,0|0,0,0]=2 30876 B18R2.3665 Fc1cc(cc(c1)COCc2ccccc2)Br 7a_100000210790_100000766940 [0,2,0,0,0,0|0,0,0]=2 30877 B18R2.3665 Fc1cc(cc(c1)COCc2ccccc2)Br 7a_100000766897_100000211182 [0,2,0,0,0,0|0,0,0]=2 30878 B18R2.3665 Fc1cc(cc(c1)COCc2ccccc2)Cl 34a_100000210790_100011219885 [0,2,0,0,0,0|0,0,0]=2 30879 B18R2.3665 Fc1cc(cc(c1)COCc2ccccc2)Cl 34a_100011217560_100015291786 [0,2,0,0,0,0|0,0,0]=2 30880 B18R2.3665 Fc1cc(cc(c1)COCc2ccccc2)Cl 7a_100000210790_100011219885 [0,2,0,0,0,0|0,0,0]=2 30881 B18R2.3665 Fc1cc(cc(c1)COCc2ccccc2)Cl 7a_100011217560_100000211182 [0,2,0,0,0,0|0,0,0]=2 30882 B18R2.3665 Fc1cc(cc(c1)COCc2ccccc2)F 34a_100000210790_100000697002 [0,2,0,0,0,0|0,0,0]=2 30883 B18R2.3665 Fc1cc(cc(c1)COCc2ccccc2)F 34a_100011215443_100015291786 [0,2,0,0,0,0|0,0,0]=2 30884 B18R2.3665 Fc1cc(cc(c1)COCc2ccccc2)F 7a_100000210790_100000697002 [0,2,0,0,0,0|0,0,0]=2 30885 B18R2.3665 Fc1cc(cc(c1)COCc2ccccc2)F 7a_100011215443_100000211182 [0,2,0,0,0,0|0,0,0]=2 30886 B18R2.3665 Fc1cc(cc(c1)COCc2ccccc2)I 34a_100000210790_100010149605 [0,2,0,0,0,0|0,0,0]=2 30887 B18R2.3665 Fc1cc(cc(c1)COCc2ccccc2)I 34a_100010149598_100015291786 [0,2,0,0,0,0|0,0,0]=2 30888 B18R2.3665 Fc1cc(cc(c1)COCc2ccccc2)I 7a_100000210790_100010149605 [0,2,0,0,0,0|0,0,0]=2 30889 B18R2.3665 Fc1cc(cc(c1)COCc2ccccc2)I 7a_100010149598_100000211182 [0,2,0,0,0,0|0,0,0]=2 30890 B18R2.3665 Fc1cc(cc(c1)COCc2ccccn2)Br 34a_100000766897_100000721315 [0,2,0,0,0,0|1,0,0]=3 30891 B18R2.3665 Fc1cc(cc(c1)COCc2ccccn2)Br 7a_100000766897_100000721315 [0,2,0,0,0,0|1,0,0]=3 30892 B18R2.3665 Fc1cc(cc(c1)COCc2ccccn2)Cl 34a_100011217560_100000721315 [0,2,0,0,0,0|1,0,0]=3 30893 B18R2.3665 Fc1cc(cc(c1)COCc2ccccn2)Cl 7a_100011217560_100000721315 [0,2,0,0,0,0|1,0,0]=3 30894 B18R2.3665 Fc1cc(cc(c1)COCc2ccccn2)F 34a_100011215443_100000721315 [0,2,0,0,0,0|1,0,0]=3 30895 B18R2.3665 Fc1cc(cc(c1)COCc2ccccn2)F 7a_100011215443_100000721315 [0,2,0,0,0,0|1,0,0]=3 30896 B18R2.3665 Fc1cc(cc(c1)COCc2ccccn2)I 34a_100010149598_100000721315 [0,2,0,0,0,0|1,0,0]=3 30897 B18R2.3665 Fc1cc(cc(c1)COCc2ccccn2)I 7a_100010149598_100000721315 [0,2,0,0,0,0|1,0,0]=3 30898 B18R2.3665 Fc1cc(cc(c1)COCc2cccnc2)Br 34a_100000766897_100000733263 [0,2,0,0,0,0|1,0,0]=3 30899 B18R2.3665 Fc1cc(cc(c1)COCc2cccnc2)Br 7a_100000766897_100000741622 [0,2,0,0,0,0|1,0,0]=3 30900 B18R2.3665 Fc1cc(cc(c1)COCc2cccnc2)Cl 34a_100011217560_100000733263 [0,2,0,0,0,0|1,0,0]=3 30901 B18R2.3665 Fc1cc(cc(c1)COCc2cccnc2)Cl 7a_100011217560_100000741622 [0,2,0,0,0,0|1,0,0]=3 30902 B18R2.3665 Fc1cc(cc(c1)COCc2cccnc2)F 34a_100011215443_100000733263 [0,2,0,0,0,0|1,0,0]=3 30903 B18R2.3665 Fc1cc(cc(c1)COCc2cccnc2)F 7a_100011215443_100000741622 [0,2,0,0,0,0|1,0,0]=3 30904 B18R2.3665 Fc1cc(cc(c1)COCc2cccnc2)I 34a_100010149598_100000733263 [0,2,0,0,0,0|1,0,0]=3 30905 B18R2.3665 Fc1cc(cc(c1)COCc2cccnc2)I 7a_100010149598_100000741622 [0,2,0,0,0,0|1,0,0]=3 30906 B18R2.3665 Fc1cc(cc(c1)COCc2cccnn2)Br 34a_100000766897_100016990269 [0,2,0,0,0,0|2,0,0]=4 30907 B18R2.3665 Fc1cc(cc(c1)COCc2cccnn2)Br 7a_100000766897_100016990269 [0,2,0,0,0,0|2,0,0]=4 30908 B18R2.3665 Fc1cc(cc(c1)COCc2cccnn2)Cl 34a_100011217560_100016990269 [0,2,0,0,0,0|2,0,0]=4 30909 B18R2.3665 Fc1cc(cc(c1)COCc2cccnn2)Cl 7a_100011217560_100016990269 [0,2,0,0,0,0|2,0,0]=4 30910 B18R2.3665 Fc1cc(cc(c1)COCc2cccnn2)F 34a_100011215443_100016990269 [0,2,0,0,0,0|2,0,0]=4 30911 B18R2.3665 Fc1cc(cc(c1)COCc2cccnn2)F 7a_100011215443_100016990269 [0,2,0,0,0,0|2,0,0]=4 30912 B18R2.3665 Fc1cc(cc(c1)COCc2cccnn2)I 34a_100010149598_100016990269 [0,2,0,0,0,0|2,0,0]=4 30913 B18R2.3665 Fc1cc(cc(c1)COCc2cccnn2)I 7a_100010149598_100016990269 [0,2,0,0,0,0|2,0,0]=4 30914 B18R2.3665 Fc1cc(cc(c1)COCc2ccncc2)Br 7a_100000766897_100015193705 [0,2,0,0,0,0|1,0,0]=3 30915 B18R2.3665 Fc1cc(cc(c1)COCc2ccncc2)Cl 7a_100011217560_100015193705 [0,2,0,0,0,0|1,0,0]=3 30916 B18R2.3665 Fc1cc(cc(c1)COCc2ccncc2)F 7a_100011215443_100015193705 [0,2,0,0,0,0|1,0,0]=3 30917 B18R2.3665 Fc1cc(cc(c1)COCc2ccncc2)I 7a_100010149598_100015193705 [0,2,0,0,0,0|1,0,0]=3 30918 B18R2.3665 Fc1cc(cc(c1)COCc2cnccn2)Br 34a_100000766897_100016995436 [0,2,0,0,0,0|2,0,0]=4 30919 B18R2.3665 Fc1cc(cc(c1)COCc2cnccn2)Br 7a_100000766897_100016995436 [0,2,0,0,0,0|2,0,0]=4 30920 B18R2.3665 Fc1cc(cc(c1)COCc2cnccn2)Cl 34a_100011217560_100016995436 [0,2,0,0,0,0|2,0,0]=4 30921 B18R2.3665 Fc1cc(cc(c1)COCc2cnccn2)Cl 7a_100011217560_100016995436 [0,2,0,0,0,0|2,0,0]=4 30922 B18R2.3665 Fc1cc(cc(c1)COCc2cnccn2)F 34a_100011215443_100016995436 [0,2,0,0,0,0|2,0,0]=4 30923 B18R2.3665 Fc1cc(cc(c1)COCc2cnccn2)F 7a_100011215443_100016995436 [0,2,0,0,0,0|2,0,0]=4 30924 B18R2.3665 Fc1cc(cc(c1)COCc2cnccn2)I 34a_100010149598_100016995436 [0,2,0,0,0,0|2,0,0]=4 30925 B18R2.3665 Fc1cc(cc(c1)COCc2cnccn2)I 7a_100010149598_100016995436 [0,2,0,0,0,0|2,0,0]=4 30926 B18R2.3665 Fc1cc(cc(c1)COCc2cncnc2)Br 34a_100000766897_100015196519 [0,2,0,0,0,0|2,0,0]=4 30927 B18R2.3665 Fc1cc(cc(c1)COCc2cncnc2)Br 7a_100000766897_100015196519 [0,2,0,0,0,0|2,0,0]=4 30928 B18R2.3665 Fc1cc(cc(c1)COCc2cncnc2)Cl 34a_100011217560_100015196519 [0,2,0,0,0,0|2,0,0]=4 30929 B18R2.3665 Fc1cc(cc(c1)COCc2cncnc2)Cl 7a_100011217560_100015196519 [0,2,0,0,0,0|2,0,0]=4 30930 B18R2.3665 Fc1cc(cc(c1)COCc2cncnc2)F 34a_100011215443_100015196519 [0,2,0,0,0,0|2,0,0]=4 30931 B18R2.3665 Fc1cc(cc(c1)COCc2cncnc2)F 7a_100011215443_100015196519 [0,2,0,0,0,0|2,0,0]=4 30932 B18R2.3665 Fc1cc(cc(c1)COCc2cncnc2)I 34a_100010149598_100015196519 [0,2,0,0,0,0|2,0,0]=4 30933 B18R2.3665 Fc1cc(cc(c1)COCc2cncnc2)I 7a_100010149598_100015196519 [0,2,0,0,0,0|2,0,0]=4 30934 B18R2.3665 Fc1cc(cc(c1)COCc2ncccn2)Br 34a_100000766897_100000703007 [0,2,0,0,0,0|2,0,0]=4 30935 B18R2.3665 Fc1cc(cc(c1)COCc2ncccn2)Br 7a_100000766897_100000703007 [0,2,0,0,0,0|2,0,0]=4 30936 B18R2.3665 Fc1cc(cc(c1)COCc2ncccn2)Cl 34a_100011217560_100000703007 [0,2,0,0,0,0|2,0,0]=4 30937 B18R2.3665 Fc1cc(cc(c1)COCc2ncccn2)Cl 7a_100011217560_100000703007 [0,2,0,0,0,0|2,0,0]=4 30938 B18R2.3665 Fc1cc(cc(c1)COCc2ncccn2)F 34a_100011215443_100000703007 [0,2,0,0,0,0|2,0,0]=4 30939 B18R2.3665 Fc1cc(cc(c1)COCc2ncccn2)F 7a_100011215443_100000703007 [0,2,0,0,0,0|2,0,0]=4 30940 B18R2.3665 Fc1cc(cc(c1)COCc2ncccn2)I 34a_100010149598_100000703007 [0,2,0,0,0,0|2,0,0]=4 30941 B18R2.3665 Fc1cc(cc(c1)COCc2ncccn2)I 7a_100010149598_100000703007 [0,2,0,0,0,0|2,0,0]=4 30942 B18R2.3665 Fc1cc(cc(c1)CSCc2ccccc2)Br 62a_100000211182_100000766940 [0,2,0,0,0,0|0,1,0]=3 30943 B18R2.3665 Fc1cc(cc(c1)CSCc2ccccc2)Br 62a_100000766940_100015291786 [0,2,0,0,0,0|0,1,0]=3 30944 B18R2.3665 Fc1cc(cc(c1)CSCc2ccccc2)Cl 62a_100000211182_100011219885 [0,2,0,0,0,0|0,1,0]=3 30945 B18R2.3665 Fc1cc(cc(c1)CSCc2ccccc2)Cl 62a_100011219885_100015291786 [0,2,0,0,0,0|0,1,0]=3 30946 B18R2.3665 Fc1cc(cc(c1)CSCc2ccccc2)F 62a_100000211182_100000697002 [0,2,0,0,0,0|0,1,0]=3 30947 B18R2.3665 Fc1cc(cc(c1)CSCc2ccccc2)F 62a_100000697002_100015291786 [0,2,0,0,0,0|0,1,0]=3 30948 B18R2.3665 Fc1cc(cc(c1)CSCc2ccccc2)I 62a_100000211182_100010149605 [0,2,0,0,0,0|0,1,0]=3 30949 B18R2.3665 Fc1cc(cc(c1)CSCc2ccccc2)I 62a_100010149605_100015291786 [0,2,0,0,0,0|0,1,0]=3 30950 B18R2.3665 Fc1cc(cc(c1)CSCc2ccccn2)Br 62a_100000721315_100000766940 [0,2,0,0,0,0|1,1,0]=4 30951 B18R2.3665 Fc1cc(cc(c1)CSCc2ccccn2)Br 62a_100000766940_100000721315 [0,2,0,0,0,0|1,1,0]=4 30952 B18R2.3665 Fc1cc(cc(c1)CSCc2ccccn2)Cl 62a_100000721315_100011219885 [0,2,0,0,0,0|1,1,0]=4 30953 B18R2.3665 Fc1cc(cc(c1)CSCc2ccccn2)Cl 62a_100011219885_100000721315 [0,2,0,0,0,0|1,1,0]=4 30954 B18R2.3665 Fc1cc(cc(c1)CSCc2ccccn2)F 62a_100000697002_100000721315 [0,2,0,0,0,0|1,1,0]=4 30955 B18R2.3665 Fc1cc(cc(c1)CSCc2ccccn2)F 62a_100000721315_100000697002 [0,2,0,0,0,0|1,1,0]=4 30956 B18R2.3665 Fc1cc(cc(c1)CSCc2ccccn2)I 62a_100000721315_100010149605 [0,2,0,0,0,0|1,1,0]=4 30957 B18R2.3665 Fc1cc(cc(c1)CSCc2ccccn2)I 62a_100010149605_100000721315 [0,2,0,0,0,0|1,1,0]=4 30958 B18R2.3665 Fc1cc(cc(c1)CSCc2cccnc2)Br 62a_100000741622_100000766940 [0,2,0,0,0,0|1,1,0]=4 30959 B18R2.3665 Fc1cc(cc(c1)CSCc2cccnc2)Br 62a_100000766940_100000741622 [0,2,0,0,0,0|1,1,0]=4 30960 B18R2.3665 Fc1cc(cc(c1)CSCc2cccnc2)Cl 62a_100000741622_100011219885 [0,2,0,0,0,0|1,1,0]=4 30961 B18R2.3665 Fc1cc(cc(c1)CSCc2cccnc2)Cl 62a_100011219885_100000741622 [0,2,0,0,0,0|1,1,0]=4 30962 B18R2.3665 Fc1cc(cc(c1)CSCc2cccnc2)F 62a_100000697002_100000741622 [0,2,0,0,0,0|1,1,0]=4 30963 B18R2.3665 Fc1cc(cc(c1)CSCc2cccnc2)F 62a_100000741622_100000697002 [0,2,0,0,0,0|1,1,0]=4 30964 B18R2.3665 Fc1cc(cc(c1)CSCc2cccnc2)I 62a_100000741622_100010149605 [0,2,0,0,0,0|1,1,0]=4 30965 B18R2.3665 Fc1cc(cc(c1)CSCc2cccnc2)I 62a_100010149605_100000741622 [0,2,0,0,0,0|1,1,0]=4 30966 B18R2.3665 Fc1cc(cc(c1)CSCc2ccncc2)Br 62a_100000766940_100015193705 [0,2,0,0,0,0|1,1,0]=4 30967 B18R2.3665 Fc1cc(cc(c1)CSCc2ccncc2)Br 62a_100015193705_100000766940 [0,2,0,0,0,0|1,1,0]=4 30968 B18R2.3665 Fc1cc(cc(c1)CSCc2ccncc2)Cl 62a_100011219885_100015193705 [0,2,0,0,0,0|1,1,0]=4 30969 B18R2.3665 Fc1cc(cc(c1)CSCc2ccncc2)Cl 62a_100015193705_100011219885 [0,2,0,0,0,0|1,1,0]=4 30970 B18R2.3665 Fc1cc(cc(c1)CSCc2ccncc2)F 62a_100000697002_100015193705 [0,2,0,0,0,0|1,1,0]=4 30971 B18R2.3665 Fc1cc(cc(c1)CSCc2ccncc2)F 62a_100015193705_100000697002 [0,2,0,0,0,0|1,1,0]=4 30972 B18R2.3665 Fc1cc(cc(c1)CSCc2ccncc2)I 62a_100010149605_100015193705 [0,2,0,0,0,0|1,1,0]=4 30973 B18R2.3665 Fc1cc(cc(c1)CSCc2ccncc2)I 62a_100015193705_100010149605 [0,2,0,0,0,0|1,1,0]=4 30974 B18R2.3665 Fc1cc(cc(c1)NCCc2ccccc2)Br 34a_100000705686_100000765856 [0,2,0,0,0,0|2,0,0]=4 30975 B18R2.3665 Fc1cc(cc(c1)NCCc2ccccc2)Br 7a_100000705686_100000765856 [0,2,0,0,0,0|2,0,0]=4 30976 B18R2.3665 Fc1cc(cc(c1)NCCc2ccccc2)Cl 34a_100000686136_100000765856 [0,2,0,0,0,0|2,0,0]=4 30977 B18R2.3665 Fc1cc(cc(c1)NCCc2ccccc2)Cl 7a_100000686136_100000765856 [0,2,0,0,0,0|2,0,0]=4 30978 B18R2.3665 Fc1cc(cc(c1)NCCc2ccccc2)F 34a_100000233717_100000765856 [0,2,0,0,0,0|2,0,0]=4 30979 B18R2.3665 Fc1cc(cc(c1)NCCc2ccccc2)F 7a_100000233717_100000765856 [0,2,0,0,0,0|2,0,0]=4 30980 B18R2.3665 Fc1cc(cc(c1)NCCc2ccccc2)I 34a_100011356972_100000765856 [0,2,0,0,0,0|2,0,0]=4 30981 B18R2.3665 Fc1cc(cc(c1)NCCc2ccccc2)I 7a_100011356972_100000765856 [0,2,0,0,0,0|2,0,0]=4 30982 B18R2.3665 Fc1cc(cc(c1)OCCc2ccccc2)Br 34a_100000688818_100000765856 [0,2,0,0,0,0|2,0,0]=4 30983 B18R2.3665 Fc1cc(cc(c1)OCCc2ccccc2)Br 7a_100000688818_100000765856 [0,2,0,0,0,0|2,0,0]=4 30984 B18R2.3665 Fc1cc(cc(c1)OCCc2ccccc2)Cl 34a_100011219751_100000765856 [0,2,0,0,0,0|2,0,0]=4 30985 B18R2.3665 Fc1cc(cc(c1)OCCc2ccccc2)Cl 7a_100011219751_100000765856 [0,2,0,0,0,0|2,0,0]=4 30986 B18R2.3665 Fc1cc(cc(c1)OCCc2ccccc2)F 34a_100000747503_100000765856 [0,2,0,0,0,0|2,0,0]=4 30987 B18R2.3665 Fc1cc(cc(c1)OCCc2ccccc2)F 7a_100000747503_100000765856 [0,2,0,0,0,0|2,0,0]=4 30988 B18R2.3665 Fc1cc(cc(c1)OCCc2ccccc2)I 34a_100000717995_100000765856 [0,2,0,0,0,0|2,0,0]=4 30989 B18R2.3665 Fc1cc(cc(c1)OCCc2ccccc2)I 7a_100000717995_100000765856 [0,2,0,0,0,0|2,0,0]=4 30990 B18R2.3665 Fc1cc(cc(c1)SCCc2ccccc2)Br 62a_100000765856_100009814764 [0,2,0,0,0,0|2,0,0]=4 30991 B18R2.3665 Fc1cc(cc(c1)SCCc2ccccc2)Br 62a_100009814764_100011218657 [0,2,0,0,0,0|2,0,0]=4 30992 B18R2.3665 Fc1cc(cc(c1)SCCc2ccccc2)Cl 62a_100000765856_100013859453 [0,2,0,0,0,0|2,0,0]=4 30993 B18R2.3665 Fc1cc(cc(c1)SCCc2ccccc2)Cl 62a_100013859453_100011218657 [0,2,0,0,0,0|2,0,0]=4 30994 B18R2.3665 Fc1cc(cc(c1)SCCc2ccccc2)F 62a_100000233788_100011218657 [0,2,0,0,0,0|2,0,0]=4 30995 B18R2.3665 Fc1cc(cc(c1)SCCc2ccccc2)F 62a_100000765856_100000233788 [0,2,0,0,0,0|2,0,0]=4 30996 B18R2.3665 Ic1cc(cc(c1)CNCc2ccccc2)I 207a_100015324214_100010185653 [0,2,0,0,0,0|1,0,0]=3 30997 B18R2.3665 Ic1cc(cc(c1)CNCc2ccccc2)I 269862a_100015324214_100010185653 [0,2,0,0,0,0|1,0,0]=3 30998 B18R2.3665 Ic1cc(cc(c1)CNCc2cccnc2)I 207a_100000210453_100010185653 [0,2,0,0,0,0|2,0,0]=4 30999 B18R2.3665 Ic1cc(cc(c1)CNCc2cccnc2)I 269862a_100000210453_100010185653 [0,2,0,0,0,0|2,0,0]=4 31000 B18R2.3665 Ic1cc(cc(c1)CNCc2ccncc2)I 269862a_100000210450_100010185653 [0,2,0,0,0,0|2,0,0]=4 31001 B18R2.3665 Ic1cc(cc(c1)COCc2ccccc2)I 7a_100010205817_100000211182 [0,2,0,0,0,0|0,0,0]=2 31002 B18R2.3665 Ic1cc(cc(c1)COCc2ccccn2)I 7a_100010205817_100000721315 [0,2,0,0,0,0|1,0,0]=3 31003 B18R2.3665 Ic1cc(cc(c1)COCc2cccnc2)I 7a_100010205817_100000741622 [0,2,0,0,0,0|1,0,0]=3 31004 B18R2.3665 Ic1cc(cc(c1)COCc2cccnn2)I 7a_100010205817_100016990269 [0,2,0,0,0,0|2,0,0]=4 31005 B18R2.3665 Ic1cc(cc(c1)COCc2ccncc2)I 7a_100010205817_100015193705 [0,2,0,0,0,0|1,0,0]=3 31006 B18R2.3665 Ic1cc(cc(c1)COCc2cnccn2)I 7a_100010205817_100016995436 [0,2,0,0,0,0|2,0,0]=4 31007 B18R2.3665 Ic1cc(cc(c1)COCc2cncnc2)I 7a_100010205817_100015196519 [0,2,0,0,0,0|2,0,0]=4 31008 B18R2.3665 Ic1cc(cc(c1)COCc2ncccn2)I 7a_100010205817_100000703007 [0,2,0,0,0,0|2,0,0]=4 31009 B18R2.3665 Ic1cc(cc(c1)NCCc2ccccc2)I 7a_200000696836_100000765856 [0,2,0,0,0,0|2,0,0]=4 31010 B18R2.3665 Nc1cc(cc(c1)C=CCc2ccccc2)Br 271570a_200016263579_100009814763 [0,2,0,0,0,0|1,0,1]=4 31011 B18R2.3665 Nc1cc(cc(c1)C=CCc2ccccc2)Cl 271570a_200016263579_100010147676 [0,2,0,0,0,0|1,0,1]=4 31012 B18R2.3665 Nc1cc(cc(c1)C=CCc2ccccc2)F 271570a_200016263579_100011356972 [0,2,0,0,0,0|1,0,1]=4 31013 B18R2.3665 Nc1cc(cc(c1)C=CCc2ccccc2)N 271570a_200016263579_100011999608 [0,2,0,0,0,0|1,0,1]=4 31014 B18R2.3665 Nc1cc(cc(c1)COCc2ccccc2)Cl 34a_100012002482_100015291786 [0,2,0,0,0,0|0,0,0]=2 31015 B18R2.3665 Nc1cc(cc(c1)COCc2ccccc2)Cl 7a_100012002482_100000211182 [0,2,0,0,0,0|0,0,0]=2 31016 B18R2.3665 Nc1cc(cc(c1)COCc2ccccc2)N 34a_100000032468_100015291786 [0,2,0,0,0,0|0,0,0]=2 31017 B18R2.3665 Nc1cc(cc(c1)COCc2ccccn2)Cl 34a_100012002482_100000721315 [0,2,0,0,0,0|1,0,0]=3 31018 B18R2.3665 Nc1cc(cc(c1)COCc2ccccn2)Cl 7a_100012002482_100000721315 [0,2,0,0,0,0|1,0,0]=3 31019 B18R2.3665 Nc1cc(cc(c1)COCc2ccccn2)N 34a_100000032468_100000721315 [0,2,0,0,0,0|1,0,0]=3 31020 B18R2.3665 Nc1cc(cc(c1)COCc2cccnc2)Cl 34a_100012002482_100000733263 [0,2,0,0,0,0|1,0,0]=3 31021 B18R2.3665 Nc1cc(cc(c1)COCc2cccnc2)Cl 7a_100012002482_100000741622 [0,2,0,0,0,0|1,0,0]=3 31022 B18R2.3665 Nc1cc(cc(c1)COCc2cccnc2)N 34a_100000032468_100000733263 [0,2,0,0,0,0|1,0,0]=3 31023 B18R2.3665 Nc1cc(cc(c1)COCc2cccnn2)Cl 34a_100012002482_100016990269 [0,2,0,0,0,0|2,0,0]=4 31024 B18R2.3665 Nc1cc(cc(c1)COCc2cccnn2)Cl 7a_100012002482_100016990269 [0,2,0,0,0,0|2,0,0]=4 31025 B18R2.3665 Nc1cc(cc(c1)COCc2cccnn2)N 34a_100000032468_100016990269 [0,2,0,0,0,0|2,0,0]=4 31026 B18R2.3665 Nc1cc(cc(c1)COCc2ccncc2)Cl 7a_100012002482_100015193705 [0,2,0,0,0,0|1,0,0]=3 31027 B18R2.3665 Nc1cc(cc(c1)COCc2cnccn2)Cl 34a_100012002482_100016995436 [0,2,0,0,0,0|2,0,0]=4 31028 B18R2.3665 Nc1cc(cc(c1)COCc2cnccn2)Cl 7a_100012002482_100016995436 [0,2,0,0,0,0|2,0,0]=4 31029 B18R2.3665 Nc1cc(cc(c1)COCc2cnccn2)N 34a_100000032468_100016995436 [0,2,0,0,0,0|2,0,0]=4 31030 B18R2.3665 Nc1cc(cc(c1)COCc2cncnc2)Cl 34a_100012002482_100015196519 [0,2,0,0,0,0|2,0,0]=4 31031 B18R2.3665 Nc1cc(cc(c1)COCc2cncnc2)Cl 7a_100012002482_100015196519 [0,2,0,0,0,0|2,0,0]=4 31032 B18R2.3665 Nc1cc(cc(c1)COCc2cncnc2)N 34a_100000032468_100015196519 [0,2,0,0,0,0|2,0,0]=4 31033 B18R2.3665 Nc1cc(cc(c1)COCc2ncccn2)Cl 34a_100012002482_100000703007 [0,2,0,0,0,0|2,0,0]=4 31034 B18R2.3665 Nc1cc(cc(c1)COCc2ncccn2)Cl 7a_100012002482_100000703007 [0,2,0,0,0,0|2,0,0]=4 31035 B18R2.3665 Nc1cc(cc(c1)COCc2ncccn2)N 34a_100000032468_100000703007 [0,2,0,0,0,0|2,0,0]=4 31036 B18R2.3665 Nc1cc(cc(c1)OCCc2ccccc2)Cl 34a_100000123917_100000765856 [0,2,0,0,0,0|2,0,0]=4 31037 B18R2.3665 Nc1cc(cc(c1)OCCc2ccccc2)Cl 7a_100000123917_100000765856 [0,2,0,0,0,0|2,0,0]=4 31038 B18R2.3665 Nc1cc(cc(c1)SCCc2ccccc2)Br 62a_100000765856_100009814763 [0,2,0,0,0,0|2,0,0]=4 31039 B18R2.3665 Nc1cc(cc(c1)SCCc2ccccc2)Br 62a_100009814763_100011218657 [0,2,0,0,0,0|2,0,0]=4 31040 B18R2.3665 Nc1cc(cc(c1)SCCc2ccccc2)Cl 62a_100000765856_100010147676 [0,2,0,0,0,0|2,0,0]=4 31041 B18R2.3665 Nc1cc(cc(c1)SCCc2ccccc2)Cl 62a_100010147676_100011218657 [0,2,0,0,0,0|2,0,0]=4 31042 B18R2.3665 Nc1cc(cc(c1)SCCc2ccccc2)F 62a_100000765856_100011356972 [0,2,0,0,0,0|2,0,0]=4 31043 B18R2.3665 Nc1cc(cc(c1)SCCc2ccccc2)F 62a_100011356972_100011218657 [0,2,0,0,0,0|2,0,0]=4 31044 B18R2.3665 Nc1cc(cc(c1)SCCc2ccccc2)N 62a_100000765856_100011999608 [0,2,0,0,0,0|2,0,0]=4 31045 B18R2.3665 Nc1cc(cc(c1)SCCc2ccccc2)N 62a_100011999608_100011218657 [0,2,0,0,0,0|2,0,0]=4 31046 B18R2.3665 O=c1cc(nc([nH]1)O)COCc2ccccc2 34a_100000210790_100000185147 [0,2,0,0,0,0|2,0,0]=4 31047 B18R2.3665 O=c1cc(nc([nH]1)O)COCc2ccccc2 7a_100000210790_100000185147 [0,2,0,0,0,0|2,0,0]=4 31048 B18R2.3665 Oc1cc(cc(c1)C=CCc2ccccc2)Br 271570a_200016263579_100010068917 [0,2,0,0,0,0|1,0,1]=4 31049 B18R2.3665 Oc1cc(cc(c1)C=CCc2ccccc2)Cl 271570a_200016263579_100010068924 [0,2,0,0,0,0|1,0,1]=4 31050 B18R2.3665 Oc1cc(cc(c1)C=CCc2ccccc2)F 271570a_200016263579_100000717995 [0,2,0,0,0,0|1,0,1]=4 31051 B18R2.3665 Oc1cc(cc(c1)C=CCc2ccccc2)O 271570a_200016263579_100009868816 [0,2,0,0,0,0|1,0,1]=4 31052 B18R2.3665 Oc1cc(cc(c1)CNCc2ccccc2)Br 207a_100015324214_100010176088 [0,2,0,0,0,0|1,0,0]=3 31053 B18R2.3665 Oc1cc(cc(c1)CNCc2ccccc2)Br 270004a_100015324214_100010176088 [0,2,0,0,0,0|1,0,0]=3 31054 B18R2.3665 Oc1cc(cc(c1)CNCc2ccccc2)Cl 207a_100015324214_100000050827 [0,2,0,0,0,0|1,0,0]=3 31055 B18R2.3665 Oc1cc(cc(c1)CNCc2ccccc2)Cl 2230a_107254831445_100015291786 [0,2,0,0,0,0|1,0,0]=3 31056 B18R2.3665 Oc1cc(cc(c1)CNCc2ccccc2)Cl 270004a_100015324214_100000050827 [0,2,0,0,0,0|1,0,0]=3 31057 B18R2.3665 Oc1cc(cc(c1)CNCc2ccccc2)Cl 270004a_107254831445_100015611070 [0,2,0,0,0,0|1,0,0]=3 31058 B18R2.3665 Oc1cc(cc(c1)CNCc2ccccc2)Cl 34a_107254831445_100015291786 [0,2,0,0,0,0|1,0,0]=3 31059 B18R2.3665 Oc1cc(cc(c1)CNCc2ccccc2)F 207a_100015324214_100000703664 [0,2,0,0,0,0|1,0,0]=3 31060 B18R2.3665 Oc1cc(cc(c1)CNCc2ccccc2)F 2230a_100160469513_100015291786 [0,2,0,0,0,0|1,0,0]=3 31061 B18R2.3665 Oc1cc(cc(c1)CNCc2ccccc2)F 270004a_100015324214_100000703664 [0,2,0,0,0,0|1,0,0]=3 31062 B18R2.3665 Oc1cc(cc(c1)CNCc2ccccc2)F 34a_100160469513_100015291786 [0,2,0,0,0,0|1,0,0]=3 31063 B18R2.3665 Oc1cc(cc(c1)CNCc2ccccc2)O 207a_100015324214_100000043415 [0,2,0,0,0,0|1,0,0]=3 31064 B18R2.3665 Oc1cc(cc(c1)CNCc2ccccc2)O 2230a_100159270720_100015291786 [0,2,0,0,0,0|1,0,0]=3 31065 B18R2.3665 Oc1cc(cc(c1)CNCc2ccccc2)O 34a_100159270720_100015291786 [0,2,0,0,0,0|1,0,0]=3 31066 B18R2.3665 Oc1cc(cc(c1)CNCc2ccccn2)Br 270004a_100000210449_100010176088 [0,2,0,0,0,0|2,0,0]=4 31067 B18R2.3665 Oc1cc(cc(c1)CNCc2ccccn2)Cl 2230a_107254831445_100000721315 [0,2,0,0,0,0|2,0,0]=4 31068 B18R2.3665 Oc1cc(cc(c1)CNCc2ccccn2)Cl 270004a_100000210449_100000050827 [0,2,0,0,0,0|2,0,0]=4 31069 B18R2.3665 Oc1cc(cc(c1)CNCc2ccccn2)Cl 270004a_107254831445_100000209966 [0,2,0,0,0,0|2,0,0]=4 31070 B18R2.3665 Oc1cc(cc(c1)CNCc2ccccn2)Cl 34a_107254831445_100000721315 [0,2,0,0,0,0|2,0,0]=4 31071 B18R2.3665 Oc1cc(cc(c1)CNCc2ccccn2)F 2230a_100160469513_100000721315 [0,2,0,0,0,0|2,0,0]=4 31072 B18R2.3665 Oc1cc(cc(c1)CNCc2ccccn2)F 270004a_100000210449_100000703664 [0,2,0,0,0,0|2,0,0]=4 31073 B18R2.3665 Oc1cc(cc(c1)CNCc2ccccn2)F 34a_100160469513_100000721315 [0,2,0,0,0,0|2,0,0]=4 31074 B18R2.3665 Oc1cc(cc(c1)CNCc2ccccn2)O 2230a_100159270720_100000721315 [0,2,0,0,0,0|2,0,0]=4 31075 B18R2.3665 Oc1cc(cc(c1)CNCc2ccccn2)O 34a_100159270720_100000721315 [0,2,0,0,0,0|2,0,0]=4 31076 B18R2.3665 Oc1cc(cc(c1)CNCc2cccnc2)Br 207a_100000210453_100010176088 [0,2,0,0,0,0|2,0,0]=4 31077 B18R2.3665 Oc1cc(cc(c1)CNCc2cccnc2)Br 270004a_100000210453_100010176088 [0,2,0,0,0,0|2,0,0]=4 31078 B18R2.3665 Oc1cc(cc(c1)CNCc2cccnc2)Cl 207a_100000210453_100000050827 [0,2,0,0,0,0|2,0,0]=4 31079 B18R2.3665 Oc1cc(cc(c1)CNCc2cccnc2)Cl 2230a_107254831445_100000741622 [0,2,0,0,0,0|2,0,0]=4 31080 B18R2.3665 Oc1cc(cc(c1)CNCc2cccnc2)Cl 270004a_100000210453_100000050827 [0,2,0,0,0,0|2,0,0]=4 31081 B18R2.3665 Oc1cc(cc(c1)CNCc2cccnc2)Cl 270004a_107254831445_100000209961 [0,2,0,0,0,0|2,0,0]=4 31082 B18R2.3665 Oc1cc(cc(c1)CNCc2cccnc2)Cl 34a_107254831445_100000733263 [0,2,0,0,0,0|2,0,0]=4 31083 B18R2.3665 Oc1cc(cc(c1)CNCc2cccnc2)F 207a_100000210453_100000703664 [0,2,0,0,0,0|2,0,0]=4 31084 B18R2.3665 Oc1cc(cc(c1)CNCc2cccnc2)F 2230a_100160469513_100000741622 [0,2,0,0,0,0|2,0,0]=4 31085 B18R2.3665 Oc1cc(cc(c1)CNCc2cccnc2)F 270004a_100000210453_100000703664 [0,2,0,0,0,0|2,0,0]=4 31086 B18R2.3665 Oc1cc(cc(c1)CNCc2cccnc2)F 34a_100160469513_100000733263 [0,2,0,0,0,0|2,0,0]=4 31087 B18R2.3665 Oc1cc(cc(c1)CNCc2cccnc2)O 207a_100000210453_100000043415 [0,2,0,0,0,0|2,0,0]=4 31088 B18R2.3665 Oc1cc(cc(c1)CNCc2cccnc2)O 2230a_100159270720_100000741622 [0,2,0,0,0,0|2,0,0]=4 31089 B18R2.3665 Oc1cc(cc(c1)CNCc2cccnc2)O 34a_100159270720_100000733263 [0,2,0,0,0,0|2,0,0]=4 31090 B18R2.3665 Oc1cc(cc(c1)CNCc2ccncc2)Cl 2230a_107254831445_100015193705 [0,2,0,0,0,0|2,0,0]=4 31091 B18R2.3665 Oc1cc(cc(c1)CNCc2ccncc2)F 2230a_100160469513_100015193705 [0,2,0,0,0,0|2,0,0]=4 31092 B18R2.3665 Oc1cc(cc(c1)CNCc2ccncc2)O 2230a_100159270720_100015193705 [0,2,0,0,0,0|2,0,0]=4 31093 B18R2.3665 Oc1cc(cc(c1)NCCc2ccccc2)Cl 34a_100000123917_100000765856 [0,2,0,0,0,0|2,0,0]=4 31094 B18R2.3665 Oc1cc(cc(c1)NCCc2ccccc2)Cl 7a_100000123917_100000765856 [0,2,0,0,0,0|2,0,0]=4 31095 B18R2.3665 Oc1cc(cc(c1)NCCc2ccccc2)O 34a_100000043371_100000765856 [0,2,0,0,0,0|2,0,0]=4 31096 B18R2.3665 Oc1cc(cc(c1)SCCc2ccccc2)Br 62a_100000765856_100010068917 [0,2,0,0,0,0|2,0,0]=4 31097 B18R2.3665 Oc1cc(cc(c1)SCCc2ccccc2)Br 62a_100010068917_100011218657 [0,2,0,0,0,0|2,0,0]=4 31098 B18R2.3665 Oc1cc(cc(c1)SCCc2ccccc2)Cl 62a_100000765856_100010068924 [0,2,0,0,0,0|2,0,0]=4 31099 B18R2.3665 Oc1cc(cc(c1)SCCc2ccccc2)Cl 62a_100010068924_100011218657 [0,2,0,0,0,0|2,0,0]=4 31100 B18R2.3665 Oc1cc(cc(c1)SCCc2ccccc2)F 62a_100000688818_100011218657 [0,2,0,0,0,0|2,0,0]=4 31101 B18R2.3665 Oc1cc(cc(c1)SCCc2ccccc2)F 62a_100000765856_100000688818 [0,2,0,0,0,0|2,0,0]=4 31102 B18R2.3665 Oc1cc(cc(c1)SCCc2ccccc2)O 62a_100000765856_100009868816 [0,2,0,0,0,0|2,0,0]=4 31103 B18R2.6482 Brc1cc(ccn1)CNCc2cccc(c2)I 2230a_100000106179_100010243470 [0,2,0,0,0,0|2,0,0]=4 31104 B18R2.6482 Brc1cc(ccn1)CNCc2cccc(c2)I 2230a_100025757509_100011218688 [0,2,0,0,0,0|2,0,0]=4 31105 B18R2.6482 Brc1cc(ccn1)CNCc2cccc(c2)I 270004a_100000106179_100009814634 [0,2,0,0,0,0|2,0,0]=4 31106 B18R2.6482 Brc1cc(ccn1)CNCc2cccc(c2)I 270004a_100025757509_100000014684 [0,2,0,0,0,0|2,0,0]=4 31107 B18R2.6482 Brc1cc(ccn1)CNCc2cccc(c2)I 34a_100000106179_100010243470 [0,2,0,0,0,0|2,0,0]=4 31108 B18R2.6482 Brc1cc(ccn1)CNCc2cccc(c2)I 34a_100025757509_100011218688 [0,2,0,0,0,0|2,0,0]=4 31109 B18R2.6482 Brc1cc(ccn1)COCc2cccc(c2)I 34a_100009814636_100011218688 [0,2,0,0,0,0|1,0,0]=3 31110 B18R2.6482 Brc1cc(ccn1)COCc2cccc(c2)I 34a_100011215336_100010243470 [0,2,0,0,0,0|1,0,0]=3 31111 B18R2.6482 Brc1cc(ccn1)COCc2cccc(c2)I 7a_100009814636_100011218688 [0,2,0,0,0,0|1,0,0]=3 31112 B18R2.6482 Brc1cc(ccn1)COCc2cccc(c2)I 7a_100011215336_100010254460 [0,2,0,0,0,0|1,0,0]=3 31113 B18R2.6482 Brc1cc(ccn1)COCc2cccc(n2)Br 34a_100000694195_100010243470 [0,2,0,0,0,0|2,0,0]=4 31114 B18R2.6482 Brc1cc(ccn1)COCc2cccc(n2)Br 34a_100009814636_100009889011 [0,2,0,0,0,0|2,0,0]=4 31115 B18R2.6482 Brc1cc(ccn1)COCc2cccc(n2)Br 7a_100009814636_100009889011 [0,2,0,0,0,0|2,0,0]=4 31116 B18R2.6482 Brc1cc(ccn1)COCc2ccnc(c2)Br 34a_100009814636_100010243470 [0,2,0,0,0,0|2,0,0]=4 31117 B18R2.6482 Brc1cc(ccn1)COCc2ccnc(c2)Br 7a_100009814636_100010254460 [0,2,0,0,0,0|2,0,0]=4 31118 B18R2.6482 Brc1cc(ccn1)CSCc2cccc(c2)I 62a_100010254460_100011218688 [0,2,0,0,0,0|1,1,0]=4 31119 B18R2.6482 Brc1cc(ccn1)CSCc2cccc(c2)I 62a_100011218688_100010243470 [0,2,0,0,0,0|1,1,0]=4 31120 B18R2.6482 Brc1cccc(c1)CCNc2cccc(c2)Br 34a_100000210019_100011740638 [0,2,0,0,0,0|2,0,0]=4 31121 B18R2.6482 Brc1cccc(c1)CCNc2cccc(c2)I 34a_100000211102_100011740638 [0,2,0,0,0,0|2,0,0]=4 31122 B18R2.6482 Brc1cccc(c1)CCOc2cccc(c2)Br 34a_100000210342_100011740638 [0,2,0,0,0,0|2,0,0]=4 31123 B18R2.6482 Brc1cccc(c1)CCOc2cccc(c2)Br 7a_100000210342_100011740638 [0,2,0,0,0,0|2,0,0]=4 31124 B18R2.6482 Brc1cccc(c1)CCOc2cccc(c2)I 34a_100000211634_100011740638 [0,2,0,0,0,0|2,0,0]=4 31125 B18R2.6482 Brc1cccc(c1)CCOc2cccc(c2)I 7a_100000211634_100011740638 [0,2,0,0,0,0|2,0,0]=4 31126 B18R2.6482 Brc1cccc(c1)CCSc2cccc(c2)Br 62a_100000691529_100011740638 [0,2,0,0,0,0|2,0,0]=4 31127 B18R2.6482 Brc1cccc(c1)CCSc2cccc(c2)Br 62a_100011740638_100000691529 [0,2,0,0,0,0|2,0,0]=4 31128 B18R2.6482 Brc1cccc(c1)CNCc2cc(ccn2)Br 2230a_100000174977_100010173614 [0,2,0,0,0,0|2,0,0]=4 31129 B18R2.6482 Brc1cccc(c1)CNCc2cc(ccn2)Br 270004a_100000174977_100009818557 [0,2,0,0,0,0|2,0,0]=4 31130 B18R2.6482 Brc1cccc(c1)CNCc2cc(ccn2)Br 34a_100000174977_100010173614 [0,2,0,0,0,0|2,0,0]=4 31131 B18R2.6482 Brc1cccc(c1)CNCc2cccc(c2)Br 207a_100000174977_100000210085 [0,2,0,0,0,0|1,0,0]=3 31132 B18R2.6482 Brc1cccc(c1)CNCc2cccc(c2)Br 2230a_100000174977_100000698116 [0,2,0,0,0,0|1,0,0]=3 31133 B18R2.6482 Brc1cccc(c1)CNCc2cccc(c2)Br 26a_100000174977_100000210342 [0,2,0,0,0,0|1,0,0]=3 31134 B18R2.6482 Brc1cccc(c1)CNCc2cccc(c2)Br 270004a_100000174977_100000210085 [0,2,0,0,0,0|1,0,0]=3 31135 B18R2.6482 Brc1cccc(c1)CNCc2cccc(c2)Br 34a_100000174977_100000698116 [0,2,0,0,0,0|1,0,0]=3 31136 B18R2.6482 Brc1cccc(c1)CNCc2cccc(c2)I 207a_100000106179_100000210085 [0,2,0,0,0,0|1,0,0]=3 31137 B18R2.6482 Brc1cccc(c1)CNCc2cccc(c2)I 207a_100000174977_100000014684 [0,2,0,0,0,0|1,0,0]=3 31138 B18R2.6482 Brc1cccc(c1)CNCc2cccc(c2)I 2230a_100000106179_100000698116 [0,2,0,0,0,0|1,0,0]=3 31139 B18R2.6482 Brc1cccc(c1)CNCc2cccc(c2)I 2230a_100000174977_100011218688 [0,2,0,0,0,0|1,0,0]=3 31140 B18R2.6482 Brc1cccc(c1)CNCc2cccc(c2)I 270004a_100000106179_100000210085 [0,2,0,0,0,0|1,0,0]=3 31141 B18R2.6482 Brc1cccc(c1)CNCc2cccc(c2)I 270004a_100000174977_100000014684 [0,2,0,0,0,0|1,0,0]=3 31142 B18R2.6482 Brc1cccc(c1)CNCc2cccc(c2)I 34a_100000106179_100000698116 [0,2,0,0,0,0|1,0,0]=3 31143 B18R2.6482 Brc1cccc(c1)CNCc2cccc(c2)I 34a_100000174977_100011218688 [0,2,0,0,0,0|1,0,0]=3 31144 B18R2.6482 Brc1cccc(c1)CNCc2cccc(n2)Br 2230a_100000174977_100009889011 [0,2,0,0,0,0|2,0,0]=4 31145 B18R2.6482 Brc1cccc(c1)CNCc2cccc(n2)Br 2230a_100016987751_100000698116 [0,2,0,0,0,0|2,0,0]=4 31146 B18R2.6482 Brc1cccc(c1)CNCc2cccc(n2)Br 270004a_100000174977_100000688028 [0,2,0,0,0,0|2,0,0]=4 31147 B18R2.6482 Brc1cccc(c1)CNCc2cccc(n2)Br 34a_100000174977_100009889011 [0,2,0,0,0,0|2,0,0]=4 31148 B18R2.6482 Brc1cccc(c1)CNCc2ccnc(c2)Br 2230a_100000174977_100010243470 [0,2,0,0,0,0|2,0,0]=4 31149 B18R2.6482 Brc1cccc(c1)CNCc2ccnc(c2)Br 2230a_100025757509_100000698116 [0,2,0,0,0,0|2,0,0]=4 31150 B18R2.6482 Brc1cccc(c1)CNCc2ccnc(c2)Br 26a_100025757509_100000210342 [0,2,0,0,0,0|2,0,0]=4 31151 B18R2.6482 Brc1cccc(c1)CNCc2ccnc(c2)Br 270004a_100000174977_100009814634 [0,2,0,0,0,0|2,0,0]=4 31152 B18R2.6482 Brc1cccc(c1)CNCc2ccnc(c2)Br 270004a_100025757509_100000210085 [0,2,0,0,0,0|2,0,0]=4 31153 B18R2.6482 Brc1cccc(c1)CNCc2ccnc(c2)Br 34a_100000174977_100010243470 [0,2,0,0,0,0|2,0,0]=4 31154 B18R2.6482 Brc1cccc(c1)CNCc2ccnc(c2)Br 34a_100025757509_100000698116 [0,2,0,0,0,0|2,0,0]=4 31155 B18R2.6482 Brc1cccc(c1)CNCc2cncc(c2)Br 207a_100000174977_100000687066 [0,2,0,0,0,0|2,0,0]=4 31156 B18R2.6482 Brc1cccc(c1)CNCc2cncc(c2)Br 207a_100011249555_100000210085 [0,2,0,0,0,0|2,0,0]=4 31157 B18R2.6482 Brc1cccc(c1)CNCc2cncc(c2)Br 2230a_100000174977_100000738771 [0,2,0,0,0,0|2,0,0]=4 31158 B18R2.6482 Brc1cccc(c1)CNCc2cncc(c2)Br 270004a_100000174977_100000687066 [0,2,0,0,0,0|2,0,0]=4 31159 B18R2.6482 Brc1cccc(c1)CNCc2cncc(c2)Br 270004a_100011249555_100000210085 [0,2,0,0,0,0|2,0,0]=4 31160 B18R2.6482 Brc1cccc(c1)CNCc2cncc(c2)Br 34a_100000174977_100000738771 [0,2,0,0,0,0|2,0,0]=4 31161 B18R2.6482 Brc1cccc(c1)COCc2cc(ccn2)Br 34a_100000687537_100010173614 [0,2,0,0,0,0|1,0,0]=3 31162 B18R2.6482 Brc1cccc(c1)COCc2cc(ccn2)Br 7a_100000687537_100010173614 [0,2,0,0,0,0|1,0,0]=3 31163 B18R2.6482 Brc1cccc(c1)COCc2cccc(c2)Br 34a_100000687537_100000698116 [0,2,0,0,0,0|0,0,0]=2 31164 B18R2.6482 Brc1cccc(c1)COCc2cccc(c2)Br 7a_100000687537_100000211773 [0,2,0,0,0,0|0,0,0]=2 31165 B18R2.6482 Brc1cccc(c1)COCc2cccc(c2)I 34a_100000687537_100011218688 [0,2,0,0,0,0|0,0,0]=2 31166 B18R2.6482 Brc1cccc(c1)COCc2cccc(c2)I 34a_100011215336_100000698116 [0,2,0,0,0,0|0,0,0]=2 31167 B18R2.6482 Brc1cccc(c1)COCc2cccc(c2)I 7a_100000687537_100011218688 [0,2,0,0,0,0|0,0,0]=2 31168 B18R2.6482 Brc1cccc(c1)COCc2cccc(c2)I 7a_100011215336_100000211773 [0,2,0,0,0,0|0,0,0]=2 31169 B18R2.6482 Brc1cccc(c1)COCc2cccc(n2)Br 34a_100000687537_100009889011 [0,2,0,0,0,0|1,0,0]=3 31170 B18R2.6482 Brc1cccc(c1)COCc2cccc(n2)Br 34a_100000694195_100000698116 [0,2,0,0,0,0|1,0,0]=3 31171 B18R2.6482 Brc1cccc(c1)COCc2cccc(n2)Br 7a_100000687537_100009889011 [0,2,0,0,0,0|1,0,0]=3 31172 B18R2.6482 Brc1cccc(c1)COCc2ccnc(c2)Br 34a_100000687537_100010243470 [0,2,0,0,0,0|1,0,0]=3 31173 B18R2.6482 Brc1cccc(c1)COCc2ccnc(c2)Br 34a_100009814636_100000698116 [0,2,0,0,0,0|1,0,0]=3 31174 B18R2.6482 Brc1cccc(c1)COCc2ccnc(c2)Br 7a_100000687537_100010254460 [0,2,0,0,0,0|1,0,0]=3 31175 B18R2.6482 Brc1cccc(c1)COCc2ccnc(c2)Br 7a_100009814636_100000211773 [0,2,0,0,0,0|1,0,0]=3 31176 B18R2.6482 Brc1cccc(c1)COCc2cncc(c2)Br 34a_100000687537_100000738771 [0,2,0,0,0,0|1,0,0]=3 31177 B18R2.6482 Brc1cccc(c1)COCc2cncc(c2)Br 34a_100011259137_100000698116 [0,2,0,0,0,0|1,0,0]=3 31178 B18R2.6482 Brc1cccc(c1)COCc2cncc(c2)Br 7a_100000687537_100000738771 [0,2,0,0,0,0|1,0,0]=3 31179 B18R2.6482 Brc1cccc(c1)COCc2cncc(c2)Br 7a_100011259137_100000211773 [0,2,0,0,0,0|1,0,0]=3 31180 B18R2.6482 Brc1cccc(c1)CSCc2cc(ccn2)Br 62a_100000211773_100010173614 [0,2,0,0,0,0|1,1,0]=4 31181 B18R2.6482 Brc1cccc(c1)CSCc2cc(ccn2)Br 62a_100010173614_100000211773 [0,2,0,0,0,0|1,1,0]=4 31182 B18R2.6482 Brc1cccc(c1)CSCc2cccc(c2)Br 62a_100000211773_100000211773 [0,2,0,0,0,0|0,1,0]=3 31183 B18R2.6482 Brc1cccc(c1)CSCc2cccc(c2)I 62a_100000211773_100011218688 [0,2,0,0,0,0|0,1,0]=3 31184 B18R2.6482 Brc1cccc(c1)CSCc2cccc(c2)I 62a_100011218688_100000211773 [0,2,0,0,0,0|0,1,0]=3 31185 B18R2.6482 Brc1cccc(c1)CSCc2cccc(n2)Br 62a_100000211773_100009889011 [0,2,0,0,0,0|1,1,0]=4 31186 B18R2.6482 Brc1cccc(c1)CSCc2cccc(n2)Br 62a_100009889011_100000211773 [0,2,0,0,0,0|1,1,0]=4 31187 B18R2.6482 Brc1cccc(c1)CSCc2ccnc(c2)Br 62a_100000211773_100010243470 [0,2,0,0,0,0|1,1,0]=4 31188 B18R2.6482 Brc1cccc(c1)CSCc2ccnc(c2)Br 62a_100010254460_100000211773 [0,2,0,0,0,0|1,1,0]=4 31189 B18R2.6482 Brc1cccc(c1)CSCc2cncc(c2)Br 62a_100000211773_100000738771 [0,2,0,0,0,0|1,1,0]=4 31190 B18R2.6482 Brc1cccc(c1)CSCc2cncc(c2)Br 62a_100000738771_100000211773 [0,2,0,0,0,0|1,1,0]=4 31191 B18R2.6482 Brc1cccc(n1)CNCc2cccc(c2)I 2230a_100000106179_100009889011 [0,2,0,0,0,0|2,0,0]=4 31192 B18R2.6482 Brc1cccc(n1)CNCc2cccc(c2)I 2230a_100016987751_100011218688 [0,2,0,0,0,0|2,0,0]=4 31193 B18R2.6482 Brc1cccc(n1)CNCc2cccc(c2)I 270004a_100000106179_100000688028 [0,2,0,0,0,0|2,0,0]=4 31194 B18R2.6482 Brc1cccc(n1)CNCc2cccc(c2)I 34a_100000106179_100009889011 [0,2,0,0,0,0|2,0,0]=4 31195 B18R2.6482 Brc1cccc(n1)COCc2cccc(c2)I 34a_100000694195_100011218688 [0,2,0,0,0,0|1,0,0]=3 31196 B18R2.6482 Brc1cccc(n1)COCc2cccc(c2)I 34a_100011215336_100009889011 [0,2,0,0,0,0|1,0,0]=3 31197 B18R2.6482 Brc1cccc(n1)COCc2cccc(c2)I 7a_100011215336_100009889011 [0,2,0,0,0,0|1,0,0]=3 31198 B18R2.6482 Brc1cccc(n1)COCc2cccc(n2)Br 34a_100000694195_100009889011 [0,2,0,0,0,0|2,0,0]=4 31199 B18R2.6482 Brc1cccc(n1)CSCc2cccc(c2)I 62a_100009889011_100011218688 [0,2,0,0,0,0|1,1,0]=4 31200 B18R2.6482 Brc1cccc(n1)CSCc2cccc(c2)I 62a_100011218688_100009889011 [0,2,0,0,0,0|1,1,0]=4 31201 B18R2.6482 Brc1ccnc(c1)CNCc2cccc(c2)I 2230a_100000106179_100010173614 [0,2,0,0,0,0|2,0,0]=4 31202 B18R2.6482 Brc1ccnc(c1)CNCc2cccc(c2)I 270004a_100000106179_100009818557 [0,2,0,0,0,0|2,0,0]=4 31203 B18R2.6482 Brc1ccnc(c1)CNCc2cccc(c2)I 34a_100000106179_100010173614 [0,2,0,0,0,0|2,0,0]=4 31204 B18R2.6482 Brc1ccnc(c1)COCc2cccc(c2)I 34a_100011215336_100010173614 [0,2,0,0,0,0|1,0,0]=3 31205 B18R2.6482 Brc1ccnc(c1)COCc2cccc(c2)I 7a_100011215336_100010173614 [0,2,0,0,0,0|1,0,0]=3 31206 B18R2.6482 Brc1ccnc(c1)COCc2cccc(n2)Br 34a_100000694195_100010173614 [0,2,0,0,0,0|2,0,0]=4 31207 B18R2.6482 Brc1ccnc(c1)COCc2ccnc(c2)Br 34a_100009814636_100010173614 [0,2,0,0,0,0|2,0,0]=4 31208 B18R2.6482 Brc1ccnc(c1)COCc2ccnc(c2)Br 7a_100009814636_100010173614 [0,2,0,0,0,0|2,0,0]=4 31209 B18R2.6482 Brc1ccnc(c1)CSCc2cccc(c2)I 62a_100010173614_100011218688 [0,2,0,0,0,0|1,1,0]=4 31210 B18R2.6482 Brc1ccnc(c1)CSCc2cccc(c2)I 62a_100011218688_100010173614 [0,2,0,0,0,0|1,1,0]=4 31211 B18R2.6482 Brc1cncc(c1)CNCc2cccc(c2)I 207a_100000106179_100000687066 [0,2,0,0,0,0|2,0,0]=4 31212 B18R2.6482 Brc1cncc(c1)CNCc2cccc(c2)I 207a_100011249555_100000014684 [0,2,0,0,0,0|2,0,0]=4 31213 B18R2.6482 Brc1cncc(c1)CNCc2cccc(c2)I 2230a_100000106179_100000738771 [0,2,0,0,0,0|2,0,0]=4 31214 B18R2.6482 Brc1cncc(c1)CNCc2cccc(c2)I 270004a_100000106179_100000687066 [0,2,0,0,0,0|2,0,0]=4 31215 B18R2.6482 Brc1cncc(c1)CNCc2cccc(c2)I 270004a_100011249555_100000014684 [0,2,0,0,0,0|2,0,0]=4 31216 B18R2.6482 Brc1cncc(c1)CNCc2cccc(c2)I 34a_100000106179_100000738771 [0,2,0,0,0,0|2,0,0]=4 31217 B18R2.6482 Brc1cncc(c1)COCc2cc(ccn2)Br 34a_100011259137_100010173614 [0,2,0,0,0,0|2,0,0]=4 31218 B18R2.6482 Brc1cncc(c1)COCc2cc(ccn2)Br 7a_100011259137_100010173614 [0,2,0,0,0,0|2,0,0]=4 31219 B18R2.6482 Brc1cncc(c1)COCc2cccc(c2)I 34a_100011215336_100000738771 [0,2,0,0,0,0|1,0,0]=3 31220 B18R2.6482 Brc1cncc(c1)COCc2cccc(c2)I 34a_100011259137_100011218688 [0,2,0,0,0,0|1,0,0]=3 31221 B18R2.6482 Brc1cncc(c1)COCc2cccc(c2)I 7a_100011215336_100000738771 [0,2,0,0,0,0|1,0,0]=3 31222 B18R2.6482 Brc1cncc(c1)COCc2cccc(c2)I 7a_100011259137_100011218688 [0,2,0,0,0,0|1,0,0]=3 31223 B18R2.6482 Brc1cncc(c1)COCc2cccc(n2)Br 34a_100000694195_100000738771 [0,2,0,0,0,0|2,0,0]=4 31224 B18R2.6482 Brc1cncc(c1)COCc2cccc(n2)Br 34a_100011259137_100009889011 [0,2,0,0,0,0|2,0,0]=4 31225 B18R2.6482 Brc1cncc(c1)COCc2cccc(n2)Br 7a_100011259137_100009889011 [0,2,0,0,0,0|2,0,0]=4 31226 B18R2.6482 Brc1cncc(c1)COCc2ccnc(c2)Br 34a_100009814636_100000738771 [0,2,0,0,0,0|2,0,0]=4 31227 B18R2.6482 Brc1cncc(c1)COCc2ccnc(c2)Br 34a_100011259137_100010243470 [0,2,0,0,0,0|2,0,0]=4 31228 B18R2.6482 Brc1cncc(c1)COCc2ccnc(c2)Br 7a_100009814636_100000738771 [0,2,0,0,0,0|2,0,0]=4 31229 B18R2.6482 Brc1cncc(c1)COCc2ccnc(c2)Br 7a_100011259137_100010254460 [0,2,0,0,0,0|2,0,0]=4 31230 B18R2.6482 Brc1cncc(c1)COCc2cncc(c2)Br 34a_100011259137_100000738771 [0,2,0,0,0,0|2,0,0]=4 31231 B18R2.6482 Brc1cncc(c1)COCc2cncc(c2)Br 7a_100011259137_100000738771 [0,2,0,0,0,0|2,0,0]=4 31232 B18R2.6482 Brc1cncc(c1)CSCc2cccc(c2)I 62a_100000738771_100011218688 [0,2,0,0,0,0|1,1,0]=4 31233 B18R2.6482 Brc1cncc(c1)CSCc2cccc(c2)I 62a_100011218688_100000738771 [0,2,0,0,0,0|1,1,0]=4 31234 B18R2.6482 Cc1cc(ccn1)CNCc2cccc(c2)Br 207a_100000174977_100011361630 [0,2,0,0,0,0|2,0,0]=4 31235 B18R2.6482 Cc1cc(ccn1)CNCc2cccc(c2)Br 207a_100011934566_100000210085 [0,2,0,0,0,0|2,0,0]=4 31236 B18R2.6482 Cc1cc(ccn1)CNCc2cccc(c2)Br 2230a_100000174977_200020672517 [0,2,0,0,0,0|2,0,0]=4 31237 B18R2.6482 Cc1cc(ccn1)CNCc2cccc(c2)Br 270004a_100000174977_100011361630 [0,2,0,0,0,0|2,0,0]=4 31238 B18R2.6482 Cc1cc(ccn1)CNCc2cccc(c2)Br 270004a_100011934566_100000210085 [0,2,0,0,0,0|2,0,0]=4 31239 B18R2.6482 Cc1cc(ccn1)CNCc2cccc(c2)Br 34a_100000174977_200020672517 [0,2,0,0,0,0|2,0,0]=4 31240 B18R2.6482 Cc1cc(ccn1)CNCc2cccc(c2)Br 34a_100011934566_100000698116 [0,2,0,0,0,0|2,0,0]=4 31241 B18R2.6482 Cc1cc(ccn1)CNCc2cccc(c2)Cl 207a_100000174878_100011361630 [0,2,0,0,0,0|2,0,0]=4 31242 B18R2.6482 Cc1cc(ccn1)CNCc2cccc(c2)Cl 207a_100011934566_100000210801 [0,2,0,0,0,0|2,0,0]=4 31243 B18R2.6482 Cc1cc(ccn1)CNCc2cccc(c2)Cl 2230a_100000174878_200020672517 [0,2,0,0,0,0|2,0,0]=4 31244 B18R2.6482 Cc1cc(ccn1)CNCc2cccc(c2)Cl 270004a_100000174878_100011361630 [0,2,0,0,0,0|2,0,0]=4 31245 B18R2.6482 Cc1cc(ccn1)CNCc2cccc(c2)Cl 270004a_100011934566_100000210801 [0,2,0,0,0,0|2,0,0]=4 31246 B18R2.6482 Cc1cc(ccn1)CNCc2cccc(c2)Cl 34a_100000174878_200020672517 [0,2,0,0,0,0|2,0,0]=4 31247 B18R2.6482 Cc1cc(ccn1)CNCc2cccc(c2)Cl 34a_100011934566_100000187163 [0,2,0,0,0,0|2,0,0]=4 31248 B18R2.6482 Cc1cc(ccn1)CNCc2cccc(c2)F 207a_100000174948_100011361630 [0,2,0,0,0,0|2,0,0]=4 31249 B18R2.6482 Cc1cc(ccn1)CNCc2cccc(c2)F 207a_100011934566_100000210812 [0,2,0,0,0,0|2,0,0]=4 31250 B18R2.6482 Cc1cc(ccn1)CNCc2cccc(c2)F 2230a_100000174948_200020672517 [0,2,0,0,0,0|2,0,0]=4 31251 B18R2.6482 Cc1cc(ccn1)CNCc2cccc(c2)F 270004a_100000174948_100011361630 [0,2,0,0,0,0|2,0,0]=4 31252 B18R2.6482 Cc1cc(ccn1)CNCc2cccc(c2)F 270004a_100011934566_100000210812 [0,2,0,0,0,0|2,0,0]=4 31253 B18R2.6482 Cc1cc(ccn1)CNCc2cccc(c2)F 34a_100000174948_200020672517 [0,2,0,0,0,0|2,0,0]=4 31254 B18R2.6482 Cc1cc(ccn1)CNCc2cccc(c2)F 34a_100011934566_100000187166 [0,2,0,0,0,0|2,0,0]=4 31255 B18R2.6482 Cc1cc(ccn1)CNCc2cccc(c2)I 207a_100000106179_100011361630 [0,2,0,0,0,0|2,0,0]=4 31256 B18R2.6482 Cc1cc(ccn1)CNCc2cccc(c2)I 207a_100011934566_100000014684 [0,2,0,0,0,0|2,0,0]=4 31257 B18R2.6482 Cc1cc(ccn1)CNCc2cccc(c2)I 2230a_100000106179_200020672517 [0,2,0,0,0,0|2,0,0]=4 31258 B18R2.6482 Cc1cc(ccn1)CNCc2cccc(c2)I 270004a_100000106179_100011361630 [0,2,0,0,0,0|2,0,0]=4 31259 B18R2.6482 Cc1cc(ccn1)CNCc2cccc(c2)I 270004a_100011934566_100000014684 [0,2,0,0,0,0|2,0,0]=4 31260 B18R2.6482 Cc1cc(ccn1)CNCc2cccc(c2)I 34a_100000106179_200020672517 [0,2,0,0,0,0|2,0,0]=4 31261 B18R2.6482 Cc1cc(ccn1)CNCc2cccc(c2)I 34a_100011934566_100011218688 [0,2,0,0,0,0|2,0,0]=4 31262 B18R2.6482 Cc1cc(ccn1)CNCc2cccc(c2)O 207a_100000743036_100011361630 [0,2,0,0,0,0|2,0,0]=4 31263 B18R2.6482 Cc1cc(ccn1)CNCc2cccc(c2)O 207a_100011934566_100000188321 [0,2,0,0,0,0|2,0,0]=4 31264 B18R2.6482 Cc1cc(ccn1)CNCc2cccc(c2)O 2230a_100000743036_200020672517 [0,2,0,0,0,0|2,0,0]=4 31265 B18R2.6482 Cc1cc(ccn1)CNCc2cccc(c2)O 270004a_100000743036_100011361630 [0,2,0,0,0,0|2,0,0]=4 31266 B18R2.6482 Cc1cc(ccn1)CNCc2cccc(c2)O 270004a_100011934566_100000188321 [0,2,0,0,0,0|2,0,0]=4 31267 B18R2.6482 Cc1cc(ccn1)CNCc2cccc(c2)O 34a_100000743036_200020672517 [0,2,0,0,0,0|2,0,0]=4 31268 B18R2.6482 Cc1cc(ccn1)CNCc2cccc(c2)O 34a_100011934566_100011660834 [0,2,0,0,0,0|2,0,0]=4 31269 B18R2.6482 Cc1cc(ccn1)COCc2cc(ccn2)Br 34a_100011998630_100010173614 [0,2,0,0,0,0|2,0,0]=4 31270 B18R2.6482 Cc1cc(ccn1)COCc2cc(ccn2)Cl 34a_100000748867_200020672517 [0,2,0,0,0,0|2,0,0]=4 31271 B18R2.6482 Cc1cc(ccn1)COCc2cc(ccn2)Cl 34a_100011998630_100016988179 [0,2,0,0,0,0|2,0,0]=4 31272 B18R2.6482 Cc1cc(ccn1)COCc2cc(ccn2)N 34a_100000692640_200020672517 [0,2,0,0,0,0|2,0,0]=4 31273 B18R2.6482 Cc1cc(ccn1)COCc2ccc[n+](c2)[O-] 34a_100000037817_200020672517 [0,2,0,0,0,0|2,0,0]=4 31274 B18R2.6482 Cc1cc(ccn1)COCc2ccc[n+](c2)[O-] 7a_100000037817_200020672517 [0,2,0,0,0,0|2,0,0]=4 31275 B18R2.6482 Cc1cc(ccn1)COCc2cccc(c2)Br 34a_100000687537_200020672517 [0,2,0,0,0,0|1,0,0]=3 31276 B18R2.6482 Cc1cc(ccn1)COCc2cccc(c2)Br 34a_100011998630_100000698116 [0,2,0,0,0,0|1,0,0]=3 31277 B18R2.6482 Cc1cc(ccn1)COCc2cccc(c2)Br 7a_100000687537_200020672517 [0,2,0,0,0,0|1,0,0]=3 31278 B18R2.6482 Cc1cc(ccn1)COCc2cccc(c2)Cl 34a_100000241301_200020672517 [0,2,0,0,0,0|1,0,0]=3 31279 B18R2.6482 Cc1cc(ccn1)COCc2cccc(c2)Cl 34a_100011998630_100000187163 [0,2,0,0,0,0|1,0,0]=3 31280 B18R2.6482 Cc1cc(ccn1)COCc2cccc(c2)Cl 7a_100000241301_200020672517 [0,2,0,0,0,0|1,0,0]=3 31281 B18R2.6482 Cc1cc(ccn1)COCc2cccc(c2)F 34a_100000210976_200020672517 [0,2,0,0,0,0|1,0,0]=3 31282 B18R2.6482 Cc1cc(ccn1)COCc2cccc(c2)F 34a_100011998630_100000187166 [0,2,0,0,0,0|1,0,0]=3 31283 B18R2.6482 Cc1cc(ccn1)COCc2cccc(c2)F 7a_100000210976_200020672517 [0,2,0,0,0,0|1,0,0]=3 31284 B18R2.6482 Cc1cc(ccn1)COCc2cccc(c2)I 34a_100011215336_200020672517 [0,2,0,0,0,0|1,0,0]=3 31285 B18R2.6482 Cc1cc(ccn1)COCc2cccc(c2)I 34a_100011998630_100011218688 [0,2,0,0,0,0|1,0,0]=3 31286 B18R2.6482 Cc1cc(ccn1)COCc2cccc(c2)I 7a_100011215336_200020672517 [0,2,0,0,0,0|1,0,0]=3 31287 B18R2.6482 Cc1cc(ccn1)COCc2cccc(c2)N 34a_100000211919_200020672517 [0,2,0,0,0,0|1,0,0]=3 31288 B18R2.6482 Cc1cc(ccn1)COCc2cccc(c2)O 34a_100011998630_100011660834 [0,2,0,0,0,0|1,0,0]=3 31289 B18R2.6482 Cc1cc(ccn1)COCc2cccc(n2)Br 34a_100000694195_200020672517 [0,2,0,0,0,0|2,0,0]=4 31290 B18R2.6482 Cc1cc(ccn1)COCc2cccc(n2)Br 34a_100011998630_100009889011 [0,2,0,0,0,0|2,0,0]=4 31291 B18R2.6482 Cc1cc(ccn1)COCc2cccc(n2)C 34a_100000690600_200020672517 [0,2,0,0,0,0|2,0,0]=4 31292 B18R2.6482 Cc1cc(ccn1)COCc2cccc(n2)C 34a_100011998630_100000757606 [0,2,0,0,0,0|2,0,0]=4 31293 B18R2.6482 Cc1cc(ccn1)COCc2cccc(n2)Cl 34a_100011998359_200020672517 [0,2,0,0,0,0|2,0,0]=4 31294 B18R2.6482 Cc1cc(ccn1)COCc2cccc(n2)Cl 34a_100011998630_100000086093 [0,2,0,0,0,0|2,0,0]=4 31295 B18R2.6482 Cc1cc(ccn1)COCc2cccc(n2)F 34a_100000086748_200020672517 [0,2,0,0,0,0|2,0,0]=4 31296 B18R2.6482 Cc1cc(ccn1)COCc2cccc(n2)F 34a_100011998630_100009819644 [0,2,0,0,0,0|2,0,0]=4 31297 B18R2.6482 Cc1cc(ccn1)COCc2ccnc(c2)Br 34a_100009814636_200020672517 [0,2,0,0,0,0|2,0,0]=4 31298 B18R2.6482 Cc1cc(ccn1)COCc2ccnc(c2)Br 34a_100011998630_100010243470 [0,2,0,0,0,0|2,0,0]=4 31299 B18R2.6482 Cc1cc(ccn1)COCc2ccnc(c2)Br 7a_100009814636_200020672517 [0,2,0,0,0,0|2,0,0]=4 31300 B18R2.6482 Cc1cc(ccn1)COCc2ccnc(c2)C 34a_100011998630_200020672517 [0,2,0,0,0,0|2,0,0]=4 31301 B18R2.6482 Cc1cc(ccn1)COCc2ccnc(c2)Cl 34a_100000748751_200020672517 [0,2,0,0,0,0|2,0,0]=4 31302 B18R2.6482 Cc1cc(ccn1)COCc2ccnc(c2)Cl 34a_100011998630_100000764220 [0,2,0,0,0,0|2,0,0]=4 31303 B18R2.6482 Cc1cc(ccn1)COCc2ccnc(c2)F 34a_100000082451_200020672517 [0,2,0,0,0,0|2,0,0]=4 31304 B18R2.6482 Cc1cc(ccn1)COCc2cncc(c2)Br 34a_100011259137_200020672517 [0,2,0,0,0,0|2,0,0]=4 31305 B18R2.6482 Cc1cc(ccn1)COCc2cncc(c2)Br 34a_100011998630_100000738771 [0,2,0,0,0,0|2,0,0]=4 31306 B18R2.6482 Cc1cc(ccn1)COCc2cncc(c2)Br 7a_100011259137_200020672517 [0,2,0,0,0,0|2,0,0]=4 31307 B18R2.6482 Cc1cc(ccn1)COCc2cncc(c2)Cl 34a_100000092867_200020672517 [0,2,0,0,0,0|2,0,0]=4 31308 B18R2.6482 Cc1cc(ccn1)COCc2cncc(c2)Cl 34a_100011998630_100016992070 [0,2,0,0,0,0|2,0,0]=4 31309 B18R2.6482 Cc1cc(ccn1)COCc2cncc(c2)Cl 7a_100000092867_200020672517 [0,2,0,0,0,0|2,0,0]=4 31310 B18R2.6482 Cc1cc(ccn1)COCc2cncc(c2)F 34a_100011962875_200020672517 [0,2,0,0,0,0|2,0,0]=4 31311 B18R2.6482 Cc1cc(ccn1)COCc2cncc(c2)F 34a_100011998630_100000725299 [0,2,0,0,0,0|2,0,0]=4 31312 B18R2.6482 Cc1cc(ccn1)COCc2cncc(c2)F 7a_100011962875_200020672517 [0,2,0,0,0,0|2,0,0]=4 31313 B18R2.6482 Cc1cc(ccn1)COCc2cncc(c2)N 34a_100000085308_200020672517 [0,2,0,0,0,0|2,0,0]=4 31314 B18R2.6482 Cc1cc(ccn1)CSCc2cccc(c2)Br 62a_100000211773_200020672517 [0,2,0,0,0,0|1,1,0]=4 31315 B18R2.6482 Cc1cc(ccn1)CSCc2cccc(c2)Br 62a_200020672517_100000211773 [0,2,0,0,0,0|1,1,0]=4 31316 B18R2.6482 Cc1cc(ccn1)CSCc2cccc(c2)Cl 62a_100000187163_200020672517 [0,2,0,0,0,0|1,1,0]=4 31317 B18R2.6482 Cc1cc(ccn1)CSCc2cccc(c2)Cl 62a_200020672517_100000187163 [0,2,0,0,0,0|1,1,0]=4 31318 B18R2.6482 Cc1cc(ccn1)CSCc2cccc(c2)F 62a_100000230114_200020672517 [0,2,0,0,0,0|1,1,0]=4 31319 B18R2.6482 Cc1cc(ccn1)CSCc2cccc(c2)F 62a_200020672517_100000230114 [0,2,0,0,0,0|1,1,0]=4 31320 B18R2.6482 Cc1cc(ccn1)CSCc2cccc(c2)I 62a_100011218688_200020672517 [0,2,0,0,0,0|1,1,0]=4 31321 B18R2.6482 Cc1cc(ccn1)CSCc2cccc(c2)I 62a_200020672517_100011218688 [0,2,0,0,0,0|1,1,0]=4 31322 B18R2.6482 Cc1cc(ccn1)CSCc2cccc(c2)O 62a_100011660834_200020672517 [0,2,0,0,0,0|1,1,0]=4 31323 B18R2.6482 Cc1cc(ccn1)CSCc2cccc(c2)O 62a_200020672517_100011660834 [0,2,0,0,0,0|1,1,0]=4 31324 B18R2.6482 Cc1cccc(c1)CCNc2cccc(c2)Br 34a_100000210019_100011713685 [0,2,0,0,0,0|2,0,0]=4 31325 B18R2.6482 Cc1cccc(c1)CCNc2cccc(c2)C 2230a_100000188690_100011713685 [0,2,0,0,0,0|2,0,0]=4 31326 B18R2.6482 Cc1cccc(c1)CCNc2cccc(c2)C 34a_100000188690_100011713685 [0,2,0,0,0,0|2,0,0]=4 31327 B18R2.6482 Cc1cccc(c1)CCNc2cccc(c2)Cl 34a_100000185859_100011713685 [0,2,0,0,0,0|2,0,0]=4 31328 B18R2.6482 Cc1cccc(c1)CCNc2cccc(c2)F 34a_100000210047_100011713685 [0,2,0,0,0,0|2,0,0]=4 31329 B18R2.6482 Cc1cccc(c1)CCNc2cccc(c2)I 34a_100000211102_100011713685 [0,2,0,0,0,0|2,0,0]=4 31330 B18R2.6482 Cc1cccc(c1)CCNc2cccc(c2)O 34a_100000210217_100011713685 [0,2,0,0,0,0|2,0,0]=4 31331 B18R2.6482 Cc1cccc(c1)CCOc2cccc(c2)Br 34a_100000210342_100011713685 [0,2,0,0,0,0|2,0,0]=4 31332 B18R2.6482 Cc1cccc(c1)CCOc2cccc(c2)Br 7a_100000210342_100011713685 [0,2,0,0,0,0|2,0,0]=4 31333 B18R2.6482 Cc1cccc(c1)CCOc2cccc(c2)C 34a_100000210337_100011713685 [0,2,0,0,0,0|2,0,0]=4 31334 B18R2.6482 Cc1cccc(c1)CCOc2cccc(c2)C 7a_100000210337_100011713685 [0,2,0,0,0,0|2,0,0]=4 31335 B18R2.6482 Cc1cccc(c1)CCOc2cccc(c2)Cl 34a_100000210295_100011713685 [0,2,0,0,0,0|2,0,0]=4 31336 B18R2.6482 Cc1cccc(c1)CCOc2cccc(c2)Cl 7a_100000210295_100011713685 [0,2,0,0,0,0|2,0,0]=4 31337 B18R2.6482 Cc1cccc(c1)CCOc2cccc(c2)F 34a_100000210426_100011713685 [0,2,0,0,0,0|2,0,0]=4 31338 B18R2.6482 Cc1cccc(c1)CCOc2cccc(c2)F 7a_100000210426_100011713685 [0,2,0,0,0,0|2,0,0]=4 31339 B18R2.6482 Cc1cccc(c1)CCOc2cccc(c2)I 34a_100000211634_100011713685 [0,2,0,0,0,0|2,0,0]=4 31340 B18R2.6482 Cc1cccc(c1)CCOc2cccc(c2)I 7a_100000211634_100011713685 [0,2,0,0,0,0|2,0,0]=4 31341 B18R2.6482 Cc1cccc(c1)CCOc2cccc(c2)N 34a_100000210217_100011713685 [0,2,0,0,0,0|2,0,0]=4 31342 B18R2.6482 Cc1cccc(c1)CCSc2cccc(c2)Br 62a_100000691529_100011713685 [0,2,0,0,0,0|2,0,0]=4 31343 B18R2.6482 Cc1cccc(c1)CCSc2cccc(c2)Br 62a_100011713685_100000691529 [0,2,0,0,0,0|2,0,0]=4 31344 B18R2.6482 Cc1cccc(c1)CCSc2cccc(c2)C 62a_100011215228_100011713685 [0,2,0,0,0,0|2,0,0]=4 31345 B18R2.6482 Cc1cccc(c1)CCSc2cccc(c2)C 62a_100011713685_100011215228 [0,2,0,0,0,0|2,0,0]=4 31346 B18R2.6482 Cc1cccc(c1)CCSc2cccc(c2)Cl 62a_100000699651_100011713685 [0,2,0,0,0,0|2,0,0]=4 31347 B18R2.6482 Cc1cccc(c1)CCSc2cccc(c2)Cl 62a_100011713685_100000699651 [0,2,0,0,0,0|2,0,0]=4 31348 B18R2.6482 Cc1cccc(c1)CCSc2cccc(c2)F 62a_100000685547_100011713685 [0,2,0,0,0,0|2,0,0]=4 31349 B18R2.6482 Cc1cccc(c1)CCSc2cccc(c2)F 62a_100011713685_100000685547 [0,2,0,0,0,0|2,0,0]=4 31350 B18R2.6482 Cc1cccc(c1)CCSc2cccc(c2)N 62a_100000210019_100011713685 [0,2,0,0,0,0|2,0,0]=4 31351 B18R2.6482 Cc1cccc(c1)CCSc2cccc(c2)N 62a_100011713685_100000210019 [0,2,0,0,0,0|2,0,0]=4 31352 B18R2.6482 Cc1cccc(c1)CCSc2cccc(c2)O 62a_100011713685_100000211634 [0,2,0,0,0,0|2,0,0]=4 31353 B18R2.6482 Cc1cccc(c1)CCSc2cccc(c2)[S] 62a_100011713685_114929384022 [0,2,0,0,0,0|2,0,0]=4 31354 B18R2.6482 Cc1cccc(c1)CCSc2cccc(c2)[S] 62a_114929384022_100011713685 [0,2,0,0,0,0|2,0,0]=4 31355 B18R2.6482 Cc1cccc(c1)CNCc2cc(ccn2)Br 2230a_100000185548_100010173614 [0,2,0,0,0,0|2,0,0]=4 31356 B18R2.6482 Cc1cccc(c1)CNCc2cc(ccn2)Br 270004a_100000185548_100009818557 [0,2,0,0,0,0|2,0,0]=4 31357 B18R2.6482 Cc1cccc(c1)CNCc2cc(ccn2)Br 34a_100000185548_100010173614 [0,2,0,0,0,0|2,0,0]=4 31358 B18R2.6482 Cc1cccc(c1)CNCc2cc(ccn2)C 207a_100000185548_100011361488 [0,2,0,0,0,0|2,0,0]=4 31359 B18R2.6482 Cc1cccc(c1)CNCc2cc(ccn2)C 2230a_100000185548_100000718516 [0,2,0,0,0,0|2,0,0]=4 31360 B18R2.6482 Cc1cccc(c1)CNCc2cc(ccn2)C 270004a_100000185548_100011361488 [0,2,0,0,0,0|2,0,0]=4 31361 B18R2.6482 Cc1cccc(c1)CNCc2cc(ccn2)C 34a_100000185548_100000718516 [0,2,0,0,0,0|2,0,0]=4 31362 B18R2.6482 Cc1cccc(c1)CNCc2cc(ccn2)Cl 2230a_100000185548_100016988179 [0,2,0,0,0,0|2,0,0]=4 31363 B18R2.6482 Cc1cccc(c1)CNCc2cc(ccn2)Cl 270004a_100000185548_100011998288 [0,2,0,0,0,0|2,0,0]=4 31364 B18R2.6482 Cc1cccc(c1)CNCc2cc(ccn2)Cl 34a_100000185548_100016988179 [0,2,0,0,0,0|2,0,0]=4 31365 B18R2.6482 Cc1cccc(c1)CNCc2cccc(=O)[nH]2 207a_100000185548_100011935257 [0,2,0,0,0,0|2,0,0]=4 31366 B18R2.6482 Cc1cccc(c1)CNCc2cccc(=O)[nH]2 2230a_100000696482_100000211840 [0,2,0,0,0,0|2,0,0]=4 31367 B18R2.6482 Cc1cccc(c1)CNCc2cccc(c2)Br 207a_100000174977_100000211157 [0,2,0,0,0,0|1,0,0]=3 31368 B18R2.6482 Cc1cccc(c1)CNCc2cccc(c2)Br 207a_100000185548_100000210085 [0,2,0,0,0,0|1,0,0]=3 31369 B18R2.6482 Cc1cccc(c1)CNCc2cccc(c2)Br 2230a_100000174977_100000211840 [0,2,0,0,0,0|1,0,0]=3 31370 B18R2.6482 Cc1cccc(c1)CNCc2cccc(c2)Br 2230a_100000185548_100000698116 [0,2,0,0,0,0|1,0,0]=3 31371 B18R2.6482 Cc1cccc(c1)CNCc2cccc(c2)Br 270004a_100000174977_100000211157 [0,2,0,0,0,0|1,0,0]=3 31372 B18R2.6482 Cc1cccc(c1)CNCc2cccc(c2)Br 270004a_100000185548_100000210085 [0,2,0,0,0,0|1,0,0]=3 31373 B18R2.6482 Cc1cccc(c1)CNCc2cccc(c2)Br 34a_100000174977_100000211840 [0,2,0,0,0,0|1,0,0]=3 31374 B18R2.6482 Cc1cccc(c1)CNCc2cccc(c2)Br 34a_100000185548_100000698116 [0,2,0,0,0,0|1,0,0]=3 31375 B18R2.6482 Cc1cccc(c1)CNCc2cccc(c2)C 207a_100000185548_100000211157 [0,2,0,0,0,0|1,0,0]=3 31376 B18R2.6482 Cc1cccc(c1)CNCc2cccc(c2)C 2230a_100000185548_100000211840 [0,2,0,0,0,0|1,0,0]=3 31377 B18R2.6482 Cc1cccc(c1)CNCc2cccc(c2)C 270004a_100000185548_100000211157 [0,2,0,0,0,0|1,0,0]=3 31378 B18R2.6482 Cc1cccc(c1)CNCc2cccc(c2)C 34a_100000185548_100000211840 [0,2,0,0,0,0|1,0,0]=3 31379 B18R2.6482 Cc1cccc(c1)CNCc2cccc(c2)Cl 207a_100000174878_100000211157 [0,2,0,0,0,0|1,0,0]=3 31380 B18R2.6482 Cc1cccc(c1)CNCc2cccc(c2)Cl 207a_100000185548_100000210801 [0,2,0,0,0,0|1,0,0]=3 31381 B18R2.6482 Cc1cccc(c1)CNCc2cccc(c2)Cl 2230a_100000174878_100000211840 [0,2,0,0,0,0|1,0,0]=3 31382 B18R2.6482 Cc1cccc(c1)CNCc2cccc(c2)Cl 2230a_100000185548_100000181238 [0,2,0,0,0,0|1,0,0]=3 31383 B18R2.6482 Cc1cccc(c1)CNCc2cccc(c2)Cl 270004a_100000174878_100000211157 [0,2,0,0,0,0|1,0,0]=3 31384 B18R2.6482 Cc1cccc(c1)CNCc2cccc(c2)Cl 270004a_100000185548_100000210801 [0,2,0,0,0,0|1,0,0]=3 31385 B18R2.6482 Cc1cccc(c1)CNCc2cccc(c2)Cl 34a_100000174878_100000211840 [0,2,0,0,0,0|1,0,0]=3 31386 B18R2.6482 Cc1cccc(c1)CNCc2cccc(c2)Cl 34a_100000185548_100000187163 [0,2,0,0,0,0|1,0,0]=3 31387 B18R2.6482 Cc1cccc(c1)CNCc2cccc(c2)F 207a_100000174948_100000211157 [0,2,0,0,0,0|1,0,0]=3 31388 B18R2.6482 Cc1cccc(c1)CNCc2cccc(c2)F 207a_100000185548_100000210812 [0,2,0,0,0,0|1,0,0]=3 31389 B18R2.6482 Cc1cccc(c1)CNCc2cccc(c2)F 2230a_100000174948_100000211840 [0,2,0,0,0,0|1,0,0]=3 31390 B18R2.6482 Cc1cccc(c1)CNCc2cccc(c2)F 2230a_100000185548_100000230114 [0,2,0,0,0,0|1,0,0]=3 31391 B18R2.6482 Cc1cccc(c1)CNCc2cccc(c2)F 270004a_100000174948_100000211157 [0,2,0,0,0,0|1,0,0]=3 31392 B18R2.6482 Cc1cccc(c1)CNCc2cccc(c2)F 270004a_100000185548_100000210812 [0,2,0,0,0,0|1,0,0]=3 31393 B18R2.6482 Cc1cccc(c1)CNCc2cccc(c2)F 34a_100000174948_100000211840 [0,2,0,0,0,0|1,0,0]=3 31394 B18R2.6482 Cc1cccc(c1)CNCc2cccc(c2)F 34a_100000185548_100000187166 [0,2,0,0,0,0|1,0,0]=3 31395 B18R2.6482 Cc1cccc(c1)CNCc2cccc(c2)I 207a_100000106179_100000211157 [0,2,0,0,0,0|1,0,0]=3 31396 B18R2.6482 Cc1cccc(c1)CNCc2cccc(c2)I 207a_100000185548_100000014684 [0,2,0,0,0,0|1,0,0]=3 31397 B18R2.6482 Cc1cccc(c1)CNCc2cccc(c2)I 2230a_100000106179_100000211840 [0,2,0,0,0,0|1,0,0]=3 31398 B18R2.6482 Cc1cccc(c1)CNCc2cccc(c2)I 2230a_100000185548_100011218688 [0,2,0,0,0,0|1,0,0]=3 31399 B18R2.6482 Cc1cccc(c1)CNCc2cccc(c2)I 270004a_100000106179_100000211157 [0,2,0,0,0,0|1,0,0]=3 31400 B18R2.6482 Cc1cccc(c1)CNCc2cccc(c2)I 270004a_100000185548_100000014684 [0,2,0,0,0,0|1,0,0]=3 31401 B18R2.6482 Cc1cccc(c1)CNCc2cccc(c2)I 34a_100000106179_100000211840 [0,2,0,0,0,0|1,0,0]=3 31402 B18R2.6482 Cc1cccc(c1)CNCc2cccc(c2)I 34a_100000185548_100011218688 [0,2,0,0,0,0|1,0,0]=3 31403 B18R2.6482 Cc1cccc(c1)CNCc2cccc(c2)O 207a_100000185548_100000188321 [0,2,0,0,0,0|1,0,0]=3 31404 B18R2.6482 Cc1cccc(c1)CNCc2cccc(c2)O 207a_100000743036_100000211157 [0,2,0,0,0,0|1,0,0]=3 31405 B18R2.6482 Cc1cccc(c1)CNCc2cccc(c2)O 2230a_100000185548_100011660834 [0,2,0,0,0,0|1,0,0]=3 31406 B18R2.6482 Cc1cccc(c1)CNCc2cccc(c2)O 2230a_100000743036_100000211840 [0,2,0,0,0,0|1,0,0]=3 31407 B18R2.6482 Cc1cccc(c1)CNCc2cccc(c2)O 270004a_100000185548_100000188321 [0,2,0,0,0,0|1,0,0]=3 31408 B18R2.6482 Cc1cccc(c1)CNCc2cccc(c2)O 270004a_100000743036_100000211157 [0,2,0,0,0,0|1,0,0]=3 31409 B18R2.6482 Cc1cccc(c1)CNCc2cccc(c2)O 34a_100000185548_100011660834 [0,2,0,0,0,0|1,0,0]=3 31410 B18R2.6482 Cc1cccc(c1)CNCc2cccc(c2)O 34a_100000743036_100000211840 [0,2,0,0,0,0|1,0,0]=3 31411 B18R2.6482 Cc1cccc(c1)CNCc2cccc(n2)Br 2230a_100000185548_100009889011 [0,2,0,0,0,0|2,0,0]=4 31412 B18R2.6482 Cc1cccc(c1)CNCc2cccc(n2)Br 2230a_100016987751_100000211840 [0,2,0,0,0,0|2,0,0]=4 31413 B18R2.6482 Cc1cccc(c1)CNCc2cccc(n2)Br 270004a_100000185548_100000688028 [0,2,0,0,0,0|2,0,0]=4 31414 B18R2.6482 Cc1cccc(c1)CNCc2cccc(n2)Br 34a_100000185548_100009889011 [0,2,0,0,0,0|2,0,0]=4 31415 B18R2.6482 Cc1cccc(c1)CNCc2cccc(n2)C 207a_100000185548_100011215050 [0,2,0,0,0,0|2,0,0]=4 31416 B18R2.6482 Cc1cccc(c1)CNCc2cccc(n2)C 2230a_100000185548_100000757606 [0,2,0,0,0,0|2,0,0]=4 31417 B18R2.6482 Cc1cccc(c1)CNCc2cccc(n2)C 270004a_100000185548_100011215050 [0,2,0,0,0,0|2,0,0]=4 31418 B18R2.6482 Cc1cccc(c1)CNCc2cccc(n2)C 34a_100000185548_100000757606 [0,2,0,0,0,0|2,0,0]=4 31419 B18R2.6482 Cc1cccc(c1)CNCc2cccc(n2)C 34a_100000701342_100000211840 [0,2,0,0,0,0|2,0,0]=4 31420 B18R2.6482 Cc1cccc(c1)CNCc2cccc(n2)Cl 2230a_100000185548_100000086093 [0,2,0,0,0,0|2,0,0]=4 31421 B18R2.6482 Cc1cccc(c1)CNCc2cccc(n2)Cl 2230a_100016990191_100000211840 [0,2,0,0,0,0|2,0,0]=4 31422 B18R2.6482 Cc1cccc(c1)CNCc2cccc(n2)Cl 270004a_100000185548_100011361687 [0,2,0,0,0,0|2,0,0]=4 31423 B18R2.6482 Cc1cccc(c1)CNCc2cccc(n2)Cl 34a_100000185548_100000086093 [0,2,0,0,0,0|2,0,0]=4 31424 B18R2.6482 Cc1cccc(c1)CNCc2cccc(n2)F 2230a_100000185548_100009819644 [0,2,0,0,0,0|2,0,0]=4 31425 B18R2.6482 Cc1cccc(c1)CNCc2cccc(n2)F 2230a_100015188798_100000211840 [0,2,0,0,0,0|2,0,0]=4 31426 B18R2.6482 Cc1cccc(c1)CNCc2cccc(n2)F 270004a_100000185548_100000050434 [0,2,0,0,0,0|2,0,0]=4 31427 B18R2.6482 Cc1cccc(c1)CNCc2cccc(n2)F 34a_100000185548_100009819644 [0,2,0,0,0,0|2,0,0]=4 31428 B18R2.6482 Cc1cccc(c1)CNCc2cccc(n2)F 34a_100015188798_100000211840 [0,2,0,0,0,0|2,0,0]=4 31429 B18R2.6482 Cc1cccc(c1)CNCc2ccnc(c2)Br 2230a_100000185548_100010243470 [0,2,0,0,0,0|2,0,0]=4 31430 B18R2.6482 Cc1cccc(c1)CNCc2ccnc(c2)Br 2230a_100025757509_100000211840 [0,2,0,0,0,0|2,0,0]=4 31431 B18R2.6482 Cc1cccc(c1)CNCc2ccnc(c2)Br 270004a_100000185548_100009814634 [0,2,0,0,0,0|2,0,0]=4 31432 B18R2.6482 Cc1cccc(c1)CNCc2ccnc(c2)Br 270004a_100025757509_100000211157 [0,2,0,0,0,0|2,0,0]=4 31433 B18R2.6482 Cc1cccc(c1)CNCc2ccnc(c2)Br 34a_100000185548_100010243470 [0,2,0,0,0,0|2,0,0]=4 31434 B18R2.6482 Cc1cccc(c1)CNCc2ccnc(c2)Br 34a_100025757509_100000211840 [0,2,0,0,0,0|2,0,0]=4 31435 B18R2.6482 Cc1cccc(c1)CNCc2ccnc(c2)C 207a_100000185548_100011361630 [0,2,0,0,0,0|2,0,0]=4 31436 B18R2.6482 Cc1cccc(c1)CNCc2ccnc(c2)C 207a_100011934566_100000211157 [0,2,0,0,0,0|2,0,0]=4 31437 B18R2.6482 Cc1cccc(c1)CNCc2ccnc(c2)C 2230a_100000185548_200020672517 [0,2,0,0,0,0|2,0,0]=4 31438 B18R2.6482 Cc1cccc(c1)CNCc2ccnc(c2)C 270004a_100000185548_100011361630 [0,2,0,0,0,0|2,0,0]=4 31439 B18R2.6482 Cc1cccc(c1)CNCc2ccnc(c2)C 270004a_100011934566_100000211157 [0,2,0,0,0,0|2,0,0]=4 31440 B18R2.6482 Cc1cccc(c1)CNCc2ccnc(c2)C 34a_100000185548_200020672517 [0,2,0,0,0,0|2,0,0]=4 31441 B18R2.6482 Cc1cccc(c1)CNCc2ccnc(c2)C 34a_100011934566_100000211840 [0,2,0,0,0,0|2,0,0]=4 31442 B18R2.6482 Cc1cccc(c1)CNCc2ccnc(c2)Cl 2230a_100000185548_100000764220 [0,2,0,0,0,0|2,0,0]=4 31443 B18R2.6482 Cc1cccc(c1)CNCc2ccnc(c2)Cl 2230a_100015205668_100000211840 [0,2,0,0,0,0|2,0,0]=4 31444 B18R2.6482 Cc1cccc(c1)CNCc2ccnc(c2)Cl 270004a_100000185548_100011290808 [0,2,0,0,0,0|2,0,0]=4 31445 B18R2.6482 Cc1cccc(c1)CNCc2ccnc(c2)Cl 270004a_100015205668_100000211157 [0,2,0,0,0,0|2,0,0]=4 31446 B18R2.6482 Cc1cccc(c1)CNCc2ccnc(c2)Cl 34a_100000185548_100000764220 [0,2,0,0,0,0|2,0,0]=4 31447 B18R2.6482 Cc1cccc(c1)CNCc2ccnc(c2)Cl 34a_100015205668_100000211840 [0,2,0,0,0,0|2,0,0]=4 31448 B18R2.6482 Cc1cccc(c1)CNCc2ccnc(c2)F 2230a_100015188774_100000211840 [0,2,0,0,0,0|2,0,0]=4 31449 B18R2.6482 Cc1cccc(c1)CNCc2ccnc(c2)F 270004a_100000185548_100000068331 [0,2,0,0,0,0|2,0,0]=4 31450 B18R2.6482 Cc1cccc(c1)CNCc2ccnc(c2)F 270004a_100015188774_100000211157 [0,2,0,0,0,0|2,0,0]=4 31451 B18R2.6482 Cc1cccc(c1)CNCc2ccnc(c2)F 34a_100015188774_100000211840 [0,2,0,0,0,0|2,0,0]=4 31452 B18R2.6482 Cc1cccc(c1)CNCc2ccnc(c2)O 207a_100000185548_100000688113 [0,2,0,0,0,0|2,0,0]=4 31453 B18R2.6482 Cc1cccc(c1)CNCc2cncc(c2)Br 207a_100000185548_100000687066 [0,2,0,0,0,0|2,0,0]=4 31454 B18R2.6482 Cc1cccc(c1)CNCc2cncc(c2)Br 207a_100011249555_100000211157 [0,2,0,0,0,0|2,0,0]=4 31455 B18R2.6482 Cc1cccc(c1)CNCc2cncc(c2)Br 2230a_100000185548_100000738771 [0,2,0,0,0,0|2,0,0]=4 31456 B18R2.6482 Cc1cccc(c1)CNCc2cncc(c2)Br 270004a_100000185548_100000687066 [0,2,0,0,0,0|2,0,0]=4 31457 B18R2.6482 Cc1cccc(c1)CNCc2cncc(c2)Br 270004a_100011249555_100000211157 [0,2,0,0,0,0|2,0,0]=4 31458 B18R2.6482 Cc1cccc(c1)CNCc2cncc(c2)Br 34a_100000185548_100000738771 [0,2,0,0,0,0|2,0,0]=4 31459 B18R2.6482 Cc1cccc(c1)CNCc2cncc(c2)C 207a_100000185548_100011998712 [0,2,0,0,0,0|2,0,0]=4 31460 B18R2.6482 Cc1cccc(c1)CNCc2cncc(c2)C 207a_100000692839_100000211157 [0,2,0,0,0,0|2,0,0]=4 31461 B18R2.6482 Cc1cccc(c1)CNCc2cncc(c2)C 2230a_100000185548_100000716715 [0,2,0,0,0,0|2,0,0]=4 31462 B18R2.6482 Cc1cccc(c1)CNCc2cncc(c2)C 2230a_100000692839_100000211840 [0,2,0,0,0,0|2,0,0]=4 31463 B18R2.6482 Cc1cccc(c1)CNCc2cncc(c2)C 270004a_100000185548_100011998712 [0,2,0,0,0,0|2,0,0]=4 31464 B18R2.6482 Cc1cccc(c1)CNCc2cncc(c2)C 270004a_100000692839_100000211157 [0,2,0,0,0,0|2,0,0]=4 31465 B18R2.6482 Cc1cccc(c1)CNCc2cncc(c2)C 34a_100000185548_100000716715 [0,2,0,0,0,0|2,0,0]=4 31466 B18R2.6482 Cc1cccc(c1)CNCc2cncc(c2)C 34a_100000692839_100000211840 [0,2,0,0,0,0|2,0,0]=4 31467 B18R2.6482 Cc1cccc(c1)CNCc2cncc(c2)Cl 207a_100000185548_100000088910 [0,2,0,0,0,0|2,0,0]=4 31468 B18R2.6482 Cc1cccc(c1)CNCc2cncc(c2)Cl 207a_200020614424_100000211157 [0,2,0,0,0,0|2,0,0]=4 31469 B18R2.6482 Cc1cccc(c1)CNCc2cncc(c2)Cl 2230a_100000185548_100016992070 [0,2,0,0,0,0|2,0,0]=4 31470 B18R2.6482 Cc1cccc(c1)CNCc2cncc(c2)Cl 2230a_200020614424_100000211840 [0,2,0,0,0,0|2,0,0]=4 31471 B18R2.6482 Cc1cccc(c1)CNCc2cncc(c2)Cl 270004a_100000185548_100000088910 [0,2,0,0,0,0|2,0,0]=4 31472 B18R2.6482 Cc1cccc(c1)CNCc2cncc(c2)Cl 270004a_200020614424_100000211157 [0,2,0,0,0,0|2,0,0]=4 31473 B18R2.6482 Cc1cccc(c1)CNCc2cncc(c2)Cl 34a_100000185548_100016992070 [0,2,0,0,0,0|2,0,0]=4 31474 B18R2.6482 Cc1cccc(c1)CNCc2cncc(c2)F 207a_100000185548_100011361476 [0,2,0,0,0,0|2,0,0]=4 31475 B18R2.6482 Cc1cccc(c1)CNCc2cncc(c2)F 207a_100011962886_100000211157 [0,2,0,0,0,0|2,0,0]=4 31476 B18R2.6482 Cc1cccc(c1)CNCc2cncc(c2)F 2230a_100000185548_100000725299 [0,2,0,0,0,0|2,0,0]=4 31477 B18R2.6482 Cc1cccc(c1)CNCc2cncc(c2)F 2230a_100011962886_100000211840 [0,2,0,0,0,0|2,0,0]=4 31478 B18R2.6482 Cc1cccc(c1)CNCc2cncc(c2)F 270004a_100000185548_100011361476 [0,2,0,0,0,0|2,0,0]=4 31479 B18R2.6482 Cc1cccc(c1)CNCc2cncc(c2)F 270004a_100011962886_100000211157 [0,2,0,0,0,0|2,0,0]=4 31480 B18R2.6482 Cc1cccc(c1)CNCc2cncc(c2)F 34a_100000185548_100000725299 [0,2,0,0,0,0|2,0,0]=4 31481 B18R2.6482 Cc1cccc(c1)CNCc2cncc(c2)F 34a_100011962886_100000211840 [0,2,0,0,0,0|2,0,0]=4 31482 B18R2.6482 Cc1cccc(c1)CNCc2cncc(c2)O 207a_100000185548_100012187055 [0,2,0,0,0,0|2,0,0]=4 31483 B18R2.6482 Cc1cccc(c1)CNCc2cncc(c2)O 270004a_100000185548_100012187055 [0,2,0,0,0,0|2,0,0]=4 31484 B18R2.6482 Cc1cccc(c1)COCc2cc(ccn2)Br 34a_100011217746_100010173614 [0,2,0,0,0,0|1,0,0]=3 31485 B18R2.6482 Cc1cccc(c1)COCc2cc(ccn2)Br 7a_100011217746_100010173614 [0,2,0,0,0,0|1,0,0]=3 31486 B18R2.6482 Cc1cccc(c1)COCc2cc(ccn2)C 34a_100011217746_100000718516 [0,2,0,0,0,0|1,0,0]=3 31487 B18R2.6482 Cc1cccc(c1)COCc2cc(ccn2)C 34a_100011998357_100000211840 [0,2,0,0,0,0|1,0,0]=3 31488 B18R2.6482 Cc1cccc(c1)COCc2cc(ccn2)C 7a_100011217746_100000718516 [0,2,0,0,0,0|1,0,0]=3 31489 B18R2.6482 Cc1cccc(c1)COCc2cc(ccn2)Cl 34a_100000748867_100000211840 [0,2,0,0,0,0|1,0,0]=3 31490 B18R2.6482 Cc1cccc(c1)COCc2cc(ccn2)Cl 34a_100011217746_100016988179 [0,2,0,0,0,0|1,0,0]=3 31491 B18R2.6482 Cc1cccc(c1)COCc2cc(ccn2)Cl 7a_100011217746_100016988179 [0,2,0,0,0,0|1,0,0]=3 31492 B18R2.6482 Cc1cccc(c1)COCc2cc(ccn2)N 34a_100000692640_100000211840 [0,2,0,0,0,0|1,0,0]=3 31493 B18R2.6482 Cc1cccc(c1)COCc2cc(cnn2)C 34a_100016212594_100000211840 [0,2,0,0,0,0|2,0,0]=4 31494 B18R2.6482 Cc1cccc(c1)COCc2ccc[n+](c2)[O-] 34a_100000037817_100000211840 [0,2,0,0,0,0|1,0,0]=3 31495 B18R2.6482 Cc1cccc(c1)COCc2ccc[n+](c2)[O-] 7a_100000037817_100000211840 [0,2,0,0,0,0|1,0,0]=3 31496 B18R2.6482 Cc1cccc(c1)COCc2cccc(c2)Br 34a_100000687537_100000211840 [0,2,0,0,0,0|0,0,0]=2 31497 B18R2.6482 Cc1cccc(c1)COCc2cccc(c2)Br 34a_100011217746_100000698116 [0,2,0,0,0,0|0,0,0]=2 31498 B18R2.6482 Cc1cccc(c1)COCc2cccc(c2)Br 7a_100000687537_100000211840 [0,2,0,0,0,0|0,0,0]=2 31499 B18R2.6482 Cc1cccc(c1)COCc2cccc(c2)Br 7a_100011217746_100000211773 [0,2,0,0,0,0|0,0,0]=2 31500 B18R2.6482 Cc1cccc(c1)COCc2cccc(c2)C 34a_100011217746_100000211840 [0,2,0,0,0,0|0,0,0]=2 31501 B18R2.6482 Cc1cccc(c1)COCc2cccc(c2)C 7a_100011217746_100000211840 [0,2,0,0,0,0|0,0,0]=2 31502 B18R2.6482 Cc1cccc(c1)COCc2cccc(c2)Cl 34a_100000241301_100000211840 [0,2,0,0,0,0|0,0,0]=2 31503 B18R2.6482 Cc1cccc(c1)COCc2cccc(c2)Cl 34a_100011217746_100000187163 [0,2,0,0,0,0|0,0,0]=2 31504 B18R2.6482 Cc1cccc(c1)COCc2cccc(c2)Cl 7a_100000241301_100000211840 [0,2,0,0,0,0|0,0,0]=2 31505 B18R2.6482 Cc1cccc(c1)COCc2cccc(c2)Cl 7a_100011217746_100000187163 [0,2,0,0,0,0|0,0,0]=2 31506 B18R2.6482 Cc1cccc(c1)COCc2cccc(c2)F 34a_100000210976_100000211840 [0,2,0,0,0,0|0,0,0]=2 31507 B18R2.6482 Cc1cccc(c1)COCc2cccc(c2)F 34a_100011217746_100000187166 [0,2,0,0,0,0|0,0,0]=2 31508 B18R2.6482 Cc1cccc(c1)COCc2cccc(c2)F 7a_100000210976_100000211840 [0,2,0,0,0,0|0,0,0]=2 31509 B18R2.6482 Cc1cccc(c1)COCc2cccc(c2)F 7a_100011217746_100000230114 [0,2,0,0,0,0|0,0,0]=2 31510 B18R2.6482 Cc1cccc(c1)COCc2cccc(c2)I 34a_100011215336_100000211840 [0,2,0,0,0,0|0,0,0]=2 31511 B18R2.6482 Cc1cccc(c1)COCc2cccc(c2)I 34a_100011217746_100011218688 [0,2,0,0,0,0|0,0,0]=2 31512 B18R2.6482 Cc1cccc(c1)COCc2cccc(c2)I 7a_100011215336_100000211840 [0,2,0,0,0,0|0,0,0]=2 31513 B18R2.6482 Cc1cccc(c1)COCc2cccc(c2)I 7a_100011217746_100011218688 [0,2,0,0,0,0|0,0,0]=2 31514 B18R2.6482 Cc1cccc(c1)COCc2cccc(c2)N 34a_100000211919_100000211840 [0,2,0,0,0,0|0,0,0]=2 31515 B18R2.6482 Cc1cccc(c1)COCc2cccc(c2)O 34a_100011217746_100011660834 [0,2,0,0,0,0|0,0,0]=2 31516 B18R2.6482 Cc1cccc(c1)COCc2cccc(c2)O 7a_100011217746_100000084143 [0,2,0,0,0,0|0,0,0]=2 31517 B18R2.6482 Cc1cccc(c1)COCc2cccc(n2)Br 34a_100000694195_100000211840 [0,2,0,0,0,0|1,0,0]=3 31518 B18R2.6482 Cc1cccc(c1)COCc2cccc(n2)Br 34a_100011217746_100009889011 [0,2,0,0,0,0|1,0,0]=3 31519 B18R2.6482 Cc1cccc(c1)COCc2cccc(n2)Br 7a_100011217746_100009889011 [0,2,0,0,0,0|1,0,0]=3 31520 B18R2.6482 Cc1cccc(c1)COCc2cccc(n2)C 34a_100000690600_100000211840 [0,2,0,0,0,0|1,0,0]=3 31521 B18R2.6482 Cc1cccc(c1)COCc2cccc(n2)C 34a_100011217746_100000757606 [0,2,0,0,0,0|1,0,0]=3 31522 B18R2.6482 Cc1cccc(c1)COCc2cccc(n2)C 7a_100011217746_100000757606 [0,2,0,0,0,0|1,0,0]=3 31523 B18R2.6482 Cc1cccc(c1)COCc2cccc(n2)Cl 34a_100011217746_100000086093 [0,2,0,0,0,0|1,0,0]=3 31524 B18R2.6482 Cc1cccc(c1)COCc2cccc(n2)Cl 34a_100011998359_100000211840 [0,2,0,0,0,0|1,0,0]=3 31525 B18R2.6482 Cc1cccc(c1)COCc2cccc(n2)Cl 7a_100011217746_100000086093 [0,2,0,0,0,0|1,0,0]=3 31526 B18R2.6482 Cc1cccc(c1)COCc2cccc(n2)F 34a_100000086748_100000211840 [0,2,0,0,0,0|1,0,0]=3 31527 B18R2.6482 Cc1cccc(c1)COCc2cccc(n2)F 34a_100011217746_100009819644 [0,2,0,0,0,0|1,0,0]=3 31528 B18R2.6482 Cc1cccc(c1)COCc2cccc(n2)F 7a_100011217746_100009819644 [0,2,0,0,0,0|1,0,0]=3 31529 B18R2.6482 Cc1cccc(c1)COCc2ccnc(c2)Br 34a_100009814636_100000211840 [0,2,0,0,0,0|1,0,0]=3 31530 B18R2.6482 Cc1cccc(c1)COCc2ccnc(c2)Br 34a_100011217746_100010243470 [0,2,0,0,0,0|1,0,0]=3 31531 B18R2.6482 Cc1cccc(c1)COCc2ccnc(c2)Br 7a_100009814636_100000211840 [0,2,0,0,0,0|1,0,0]=3 31532 B18R2.6482 Cc1cccc(c1)COCc2ccnc(c2)Br 7a_100011217746_100010254460 [0,2,0,0,0,0|1,0,0]=3 31533 B18R2.6482 Cc1cccc(c1)COCc2ccnc(c2)C 34a_100011217746_200020672517 [0,2,0,0,0,0|1,0,0]=3 31534 B18R2.6482 Cc1cccc(c1)COCc2ccnc(c2)C 34a_100011998630_100000211840 [0,2,0,0,0,0|1,0,0]=3 31535 B18R2.6482 Cc1cccc(c1)COCc2ccnc(c2)C 7a_100011217746_200020672517 [0,2,0,0,0,0|1,0,0]=3 31536 B18R2.6482 Cc1cccc(c1)COCc2ccnc(c2)Cl 34a_100000748751_100000211840 [0,2,0,0,0,0|1,0,0]=3 31537 B18R2.6482 Cc1cccc(c1)COCc2ccnc(c2)Cl 34a_100011217746_100000764220 [0,2,0,0,0,0|1,0,0]=3 31538 B18R2.6482 Cc1cccc(c1)COCc2ccnc(c2)Cl 7a_100011217746_100000764220 [0,2,0,0,0,0|1,0,0]=3 31539 B18R2.6482 Cc1cccc(c1)COCc2ccnc(c2)F 34a_100000082451_100000211840 [0,2,0,0,0,0|1,0,0]=3 31540 B18R2.6482 Cc1cccc(c1)COCc2ccnc(n2)Cl 34a_100011217746_100000099655 [0,2,0,0,0,0|2,0,0]=4 31541 B18R2.6482 Cc1cccc(c1)COCc2ccnc(n2)Cl 7a_100011217746_100000099655 [0,2,0,0,0,0|2,0,0]=4 31542 B18R2.6482 Cc1cccc(c1)COCc2cncc(c2)Br 34a_100011217746_100000738771 [0,2,0,0,0,0|1,0,0]=3 31543 B18R2.6482 Cc1cccc(c1)COCc2cncc(c2)Br 34a_100011259137_100000211840 [0,2,0,0,0,0|1,0,0]=3 31544 B18R2.6482 Cc1cccc(c1)COCc2cncc(c2)Br 7a_100011217746_100000738771 [0,2,0,0,0,0|1,0,0]=3 31545 B18R2.6482 Cc1cccc(c1)COCc2cncc(c2)Br 7a_100011259137_100000211840 [0,2,0,0,0,0|1,0,0]=3 31546 B18R2.6482 Cc1cccc(c1)COCc2cncc(c2)C 34a_100011217746_100000716715 [0,2,0,0,0,0|1,0,0]=3 31547 B18R2.6482 Cc1cccc(c1)COCc2cncc(c2)C 34a_100011998709_100000211840 [0,2,0,0,0,0|1,0,0]=3 31548 B18R2.6482 Cc1cccc(c1)COCc2cncc(c2)C 7a_100011217746_100000716715 [0,2,0,0,0,0|1,0,0]=3 31549 B18R2.6482 Cc1cccc(c1)COCc2cncc(c2)C 7a_100011998709_100000211840 [0,2,0,0,0,0|1,0,0]=3 31550 B18R2.6482 Cc1cccc(c1)COCc2cncc(c2)Cl 34a_100000092867_100000211840 [0,2,0,0,0,0|1,0,0]=3 31551 B18R2.6482 Cc1cccc(c1)COCc2cncc(c2)Cl 34a_100011217746_100016992070 [0,2,0,0,0,0|1,0,0]=3 31552 B18R2.6482 Cc1cccc(c1)COCc2cncc(c2)Cl 7a_100000092867_100000211840 [0,2,0,0,0,0|1,0,0]=3 31553 B18R2.6482 Cc1cccc(c1)COCc2cncc(c2)Cl 7a_100011217746_100016992070 [0,2,0,0,0,0|1,0,0]=3 31554 B18R2.6482 Cc1cccc(c1)COCc2cncc(c2)F 34a_100011217746_100000725299 [0,2,0,0,0,0|1,0,0]=3 31555 B18R2.6482 Cc1cccc(c1)COCc2cncc(c2)F 34a_100011962875_100000211840 [0,2,0,0,0,0|1,0,0]=3 31556 B18R2.6482 Cc1cccc(c1)COCc2cncc(c2)F 7a_100011217746_100000725299 [0,2,0,0,0,0|1,0,0]=3 31557 B18R2.6482 Cc1cccc(c1)COCc2cncc(c2)F 7a_100011962875_100000211840 [0,2,0,0,0,0|1,0,0]=3 31558 B18R2.6482 Cc1cccc(c1)COCc2cncc(c2)N 34a_100000085308_100000211840 [0,2,0,0,0,0|1,0,0]=3 31559 B18R2.6482 Cc1cccc(c1)CSCc2cc(ccn2)Br 62a_100000211840_100010173614 [0,2,0,0,0,0|1,1,0]=4 31560 B18R2.6482 Cc1cccc(c1)CSCc2cc(ccn2)Br 62a_100010173614_100000211840 [0,2,0,0,0,0|1,1,0]=4 31561 B18R2.6482 Cc1cccc(c1)CSCc2cc(ccn2)C 62a_100000211840_100000718516 [0,2,0,0,0,0|1,1,0]=4 31562 B18R2.6482 Cc1cccc(c1)CSCc2cc(ccn2)C 62a_100000718516_100000211840 [0,2,0,0,0,0|1,1,0]=4 31563 B18R2.6482 Cc1cccc(c1)CSCc2cc(ccn2)Cl 62a_100000211840_100016988179 [0,2,0,0,0,0|1,1,0]=4 31564 B18R2.6482 Cc1cccc(c1)CSCc2cc(ccn2)Cl 62a_100016988179_100000211840 [0,2,0,0,0,0|1,1,0]=4 31565 B18R2.6482 Cc1cccc(c1)CSCc2cccc(c2)Br 62a_100000211773_100000211840 [0,2,0,0,0,0|0,1,0]=3 31566 B18R2.6482 Cc1cccc(c1)CSCc2cccc(c2)Br 62a_100000211840_100000211773 [0,2,0,0,0,0|0,1,0]=3 31567 B18R2.6482 Cc1cccc(c1)CSCc2cccc(c2)C 62a_100000211840_100000211840 [0,2,0,0,0,0|0,1,0]=3 31568 B18R2.6482 Cc1cccc(c1)CSCc2cccc(c2)Cl 62a_100000187163_100000211840 [0,2,0,0,0,0|0,1,0]=3 31569 B18R2.6482 Cc1cccc(c1)CSCc2cccc(c2)Cl 62a_100000211840_100000187163 [0,2,0,0,0,0|0,1,0]=3 31570 B18R2.6482 Cc1cccc(c1)CSCc2cccc(c2)F 62a_100000211840_100000230114 [0,2,0,0,0,0|0,1,0]=3 31571 B18R2.6482 Cc1cccc(c1)CSCc2cccc(c2)F 62a_100000230114_100000211840 [0,2,0,0,0,0|0,1,0]=3 31572 B18R2.6482 Cc1cccc(c1)CSCc2cccc(c2)I 62a_100000211840_100011218688 [0,2,0,0,0,0|0,1,0]=3 31573 B18R2.6482 Cc1cccc(c1)CSCc2cccc(c2)I 62a_100011218688_100000211840 [0,2,0,0,0,0|0,1,0]=3 31574 B18R2.6482 Cc1cccc(c1)CSCc2cccc(c2)O 62a_100000211840_100011660834 [0,2,0,0,0,0|0,1,0]=3 31575 B18R2.6482 Cc1cccc(c1)CSCc2cccc(c2)O 62a_100011660834_100000211840 [0,2,0,0,0,0|0,1,0]=3 31576 B18R2.6482 Cc1cccc(c1)CSCc2cccc(n2)Br 62a_100000211840_100009889011 [0,2,0,0,0,0|1,1,0]=4 31577 B18R2.6482 Cc1cccc(c1)CSCc2cccc(n2)Br 62a_100009889011_100000211840 [0,2,0,0,0,0|1,1,0]=4 31578 B18R2.6482 Cc1cccc(c1)CSCc2cccc(n2)C 62a_100000211840_100000757606 [0,2,0,0,0,0|1,1,0]=4 31579 B18R2.6482 Cc1cccc(c1)CSCc2cccc(n2)C 62a_100000757606_100000211840 [0,2,0,0,0,0|1,1,0]=4 31580 B18R2.6482 Cc1cccc(c1)CSCc2cccc(n2)Cl 62a_100000086093_100000211840 [0,2,0,0,0,0|1,1,0]=4 31581 B18R2.6482 Cc1cccc(c1)CSCc2cccc(n2)Cl 62a_100000211840_100000086093 [0,2,0,0,0,0|1,1,0]=4 31582 B18R2.6482 Cc1cccc(c1)CSCc2cccc(n2)F 62a_100000211840_100009819644 [0,2,0,0,0,0|1,1,0]=4 31583 B18R2.6482 Cc1cccc(c1)CSCc2cccc(n2)F 62a_100009819644_100000211840 [0,2,0,0,0,0|1,1,0]=4 31584 B18R2.6482 Cc1cccc(c1)CSCc2ccnc(c2)Br 62a_100000211840_100010243470 [0,2,0,0,0,0|1,1,0]=4 31585 B18R2.6482 Cc1cccc(c1)CSCc2ccnc(c2)Br 62a_100010254460_100000211840 [0,2,0,0,0,0|1,1,0]=4 31586 B18R2.6482 Cc1cccc(c1)CSCc2ccnc(c2)C 62a_100000211840_200020672517 [0,2,0,0,0,0|1,1,0]=4 31587 B18R2.6482 Cc1cccc(c1)CSCc2ccnc(c2)C 62a_200020672517_100000211840 [0,2,0,0,0,0|1,1,0]=4 31588 B18R2.6482 Cc1cccc(c1)CSCc2ccnc(c2)Cl 62a_100000211840_100000764220 [0,2,0,0,0,0|1,1,0]=4 31589 B18R2.6482 Cc1cccc(c1)CSCc2ccnc(c2)Cl 62a_100000764220_100000211840 [0,2,0,0,0,0|1,1,0]=4 31590 B18R2.6482 Cc1cccc(c1)CSCc2cncc(c2)Br 62a_100000211840_100000738771 [0,2,0,0,0,0|1,1,0]=4 31591 B18R2.6482 Cc1cccc(c1)CSCc2cncc(c2)Br 62a_100000738771_100000211840 [0,2,0,0,0,0|1,1,0]=4 31592 B18R2.6482 Cc1cccc(c1)CSCc2cncc(c2)C 62a_100000211840_100000716715 [0,2,0,0,0,0|1,1,0]=4 31593 B18R2.6482 Cc1cccc(c1)CSCc2cncc(c2)C 62a_100000716715_100000211840 [0,2,0,0,0,0|1,1,0]=4 31594 B18R2.6482 Cc1cccc(c1)CSCc2cncc(c2)Cl 62a_100000211840_100016992070 [0,2,0,0,0,0|1,1,0]=4 31595 B18R2.6482 Cc1cccc(c1)CSCc2cncc(c2)Cl 62a_100016992070_100000211840 [0,2,0,0,0,0|1,1,0]=4 31596 B18R2.6482 Cc1cccc(c1)CSCc2cncc(c2)F 62a_100000211840_100000725299 [0,2,0,0,0,0|1,1,0]=4 31597 B18R2.6482 Cc1cccc(c1)CSCc2cncc(c2)F 62a_100000725299_100000211840 [0,2,0,0,0,0|1,1,0]=4 31598 B18R2.6482 Cc1cccc(c1)NCCc2cccc(c2)Br 2230a_100000188690_100011740638 [0,2,0,0,0,0|2,0,0]=4 31599 B18R2.6482 Cc1cccc(c1)NCCc2cccc(c2)Br 34a_100000188690_100011740638 [0,2,0,0,0,0|2,0,0]=4 31600 B18R2.6482 Cc1cccc(c1)NCCc2cccc(c2)Cl 2230a_100000188690_100011713710 [0,2,0,0,0,0|2,0,0]=4 31601 B18R2.6482 Cc1cccc(c1)NCCc2cccc(c2)Cl 34a_100000188690_100011713710 [0,2,0,0,0,0|2,0,0]=4 31602 B18R2.6482 Cc1cccc(c1)NCCc2cccc(c2)F 2230a_100000188690_100011217235 [0,2,0,0,0,0|2,0,0]=4 31603 B18R2.6482 Cc1cccc(c1)NCCc2cccc(c2)F 34a_100000188690_100011217235 [0,2,0,0,0,0|2,0,0]=4 31604 B18R2.6482 Cc1cccc(c1)OCCc2cccc(c2)Br 34a_100000210337_100011740638 [0,2,0,0,0,0|2,0,0]=4 31605 B18R2.6482 Cc1cccc(c1)OCCc2cccc(c2)Br 7a_100000210337_100011740638 [0,2,0,0,0,0|2,0,0]=4 31606 B18R2.6482 Cc1cccc(c1)OCCc2cccc(c2)Cl 34a_100000210337_100011713710 [0,2,0,0,0,0|2,0,0]=4 31607 B18R2.6482 Cc1cccc(c1)OCCc2cccc(c2)Cl 7a_100000210337_100011713710 [0,2,0,0,0,0|2,0,0]=4 31608 B18R2.6482 Cc1cccc(c1)OCCc2cccc(c2)F 34a_100000210337_100011217235 [0,2,0,0,0,0|2,0,0]=4 31609 B18R2.6482 Cc1cccc(c1)OCCc2cccc(c2)F 7a_100000210337_100011217235 [0,2,0,0,0,0|2,0,0]=4 31610 B18R2.6482 Cc1cccc(c1)SCCc2cccc(c2)Br 62a_100011215228_100011740638 [0,2,0,0,0,0|2,0,0]=4 31611 B18R2.6482 Cc1cccc(c1)SCCc2cccc(c2)Br 62a_100011740638_100011215228 [0,2,0,0,0,0|2,0,0]=4 31612 B18R2.6482 Cc1cccc(c1)SCCc2cccc(c2)Cl 62a_100011215228_100011713710 [0,2,0,0,0,0|2,0,0]=4 31613 B18R2.6482 Cc1cccc(c1)SCCc2cccc(c2)Cl 62a_100011713710_100011215228 [0,2,0,0,0,0|2,0,0]=4 31614 B18R2.6482 Cc1cccc(c1)SCCc2cccc(c2)F 62a_100011215228_100011217235 [0,2,0,0,0,0|2,0,0]=4 31615 B18R2.6482 Cc1cccc(c1)SCCc2cccc(c2)F 62a_100011217235_100011215228 [0,2,0,0,0,0|2,0,0]=4 31616 B18R2.6482 Cc1cccc(n1)CNCc2cccc(c2)Br 207a_100000174977_100011215050 [0,2,0,0,0,0|2,0,0]=4 31617 B18R2.6482 Cc1cccc(n1)CNCc2cccc(c2)Br 2230a_100000174977_100000757606 [0,2,0,0,0,0|2,0,0]=4 31618 B18R2.6482 Cc1cccc(n1)CNCc2cccc(c2)Br 270004a_100000174977_100011215050 [0,2,0,0,0,0|2,0,0]=4 31619 B18R2.6482 Cc1cccc(n1)CNCc2cccc(c2)Br 34a_100000174977_100000757606 [0,2,0,0,0,0|2,0,0]=4 31620 B18R2.6482 Cc1cccc(n1)CNCc2cccc(c2)Br 34a_100000701342_100000698116 [0,2,0,0,0,0|2,0,0]=4 31621 B18R2.6482 Cc1cccc(n1)CNCc2cccc(c2)Cl 207a_100000174878_100011215050 [0,2,0,0,0,0|2,0,0]=4 31622 B18R2.6482 Cc1cccc(n1)CNCc2cccc(c2)Cl 2230a_100000174878_100000757606 [0,2,0,0,0,0|2,0,0]=4 31623 B18R2.6482 Cc1cccc(n1)CNCc2cccc(c2)Cl 270004a_100000174878_100011215050 [0,2,0,0,0,0|2,0,0]=4 31624 B18R2.6482 Cc1cccc(n1)CNCc2cccc(c2)Cl 34a_100000174878_100000757606 [0,2,0,0,0,0|2,0,0]=4 31625 B18R2.6482 Cc1cccc(n1)CNCc2cccc(c2)Cl 34a_100000701342_100000187163 [0,2,0,0,0,0|2,0,0]=4 31626 B18R2.6482 Cc1cccc(n1)CNCc2cccc(c2)F 207a_100000174948_100011215050 [0,2,0,0,0,0|2,0,0]=4 31627 B18R2.6482 Cc1cccc(n1)CNCc2cccc(c2)F 2230a_100000174948_100000757606 [0,2,0,0,0,0|2,0,0]=4 31628 B18R2.6482 Cc1cccc(n1)CNCc2cccc(c2)F 270004a_100000174948_100011215050 [0,2,0,0,0,0|2,0,0]=4 31629 B18R2.6482 Cc1cccc(n1)CNCc2cccc(c2)F 34a_100000174948_100000757606 [0,2,0,0,0,0|2,0,0]=4 31630 B18R2.6482 Cc1cccc(n1)CNCc2cccc(c2)F 34a_100000701342_100000187166 [0,2,0,0,0,0|2,0,0]=4 31631 B18R2.6482 Cc1cccc(n1)CNCc2cccc(c2)I 207a_100000106179_100011215050 [0,2,0,0,0,0|2,0,0]=4 31632 B18R2.6482 Cc1cccc(n1)CNCc2cccc(c2)I 2230a_100000106179_100000757606 [0,2,0,0,0,0|2,0,0]=4 31633 B18R2.6482 Cc1cccc(n1)CNCc2cccc(c2)I 270004a_100000106179_100011215050 [0,2,0,0,0,0|2,0,0]=4 31634 B18R2.6482 Cc1cccc(n1)CNCc2cccc(c2)I 34a_100000106179_100000757606 [0,2,0,0,0,0|2,0,0]=4 31635 B18R2.6482 Cc1cccc(n1)CNCc2cccc(c2)I 34a_100000701342_100011218688 [0,2,0,0,0,0|2,0,0]=4 31636 B18R2.6482 Cc1cccc(n1)CNCc2cccc(c2)O 207a_100000743036_100011215050 [0,2,0,0,0,0|2,0,0]=4 31637 B18R2.6482 Cc1cccc(n1)CNCc2cccc(c2)O 2230a_100000743036_100000757606 [0,2,0,0,0,0|2,0,0]=4 31638 B18R2.6482 Cc1cccc(n1)CNCc2cccc(c2)O 270004a_100000743036_100011215050 [0,2,0,0,0,0|2,0,0]=4 31639 B18R2.6482 Cc1cccc(n1)CNCc2cccc(c2)O 34a_100000701342_100011660834 [0,2,0,0,0,0|2,0,0]=4 31640 B18R2.6482 Cc1cccc(n1)CNCc2cccc(c2)O 34a_100000743036_100000757606 [0,2,0,0,0,0|2,0,0]=4 31641 B18R2.6482 Cc1cccc(n1)COCc2cc(ccn2)Br 34a_100000690600_100010173614 [0,2,0,0,0,0|2,0,0]=4 31642 B18R2.6482 Cc1cccc(n1)COCc2cc(ccn2)Cl 34a_100000690600_100016988179 [0,2,0,0,0,0|2,0,0]=4 31643 B18R2.6482 Cc1cccc(n1)COCc2cc(ccn2)Cl 34a_100000748867_100000757606 [0,2,0,0,0,0|2,0,0]=4 31644 B18R2.6482 Cc1cccc(n1)COCc2cc(ccn2)N 34a_100000692640_100000757606 [0,2,0,0,0,0|2,0,0]=4 31645 B18R2.6482 Cc1cccc(n1)COCc2ccc[n+](c2)[O-] 34a_100000037817_100000757606 [0,2,0,0,0,0|2,0,0]=4 31646 B18R2.6482 Cc1cccc(n1)COCc2ccc[n+](c2)[O-] 7a_100000037817_100000757606 [0,2,0,0,0,0|2,0,0]=4 31647 B18R2.6482 Cc1cccc(n1)COCc2cccc(c2)Br 34a_100000687537_100000757606 [0,2,0,0,0,0|1,0,0]=3 31648 B18R2.6482 Cc1cccc(n1)COCc2cccc(c2)Br 34a_100000690600_100000698116 [0,2,0,0,0,0|1,0,0]=3 31649 B18R2.6482 Cc1cccc(n1)COCc2cccc(c2)Br 7a_100000687537_100000757606 [0,2,0,0,0,0|1,0,0]=3 31650 B18R2.6482 Cc1cccc(n1)COCc2cccc(c2)Cl 34a_100000241301_100000757606 [0,2,0,0,0,0|1,0,0]=3 31651 B18R2.6482 Cc1cccc(n1)COCc2cccc(c2)Cl 34a_100000690600_100000187163 [0,2,0,0,0,0|1,0,0]=3 31652 B18R2.6482 Cc1cccc(n1)COCc2cccc(c2)Cl 7a_100000241301_100000757606 [0,2,0,0,0,0|1,0,0]=3 31653 B18R2.6482 Cc1cccc(n1)COCc2cccc(c2)F 34a_100000210976_100000757606 [0,2,0,0,0,0|1,0,0]=3 31654 B18R2.6482 Cc1cccc(n1)COCc2cccc(c2)F 34a_100000690600_100000187166 [0,2,0,0,0,0|1,0,0]=3 31655 B18R2.6482 Cc1cccc(n1)COCc2cccc(c2)F 7a_100000210976_100000757606 [0,2,0,0,0,0|1,0,0]=3 31656 B18R2.6482 Cc1cccc(n1)COCc2cccc(c2)I 34a_100000690600_100011218688 [0,2,0,0,0,0|1,0,0]=3 31657 B18R2.6482 Cc1cccc(n1)COCc2cccc(c2)I 34a_100011215336_100000757606 [0,2,0,0,0,0|1,0,0]=3 31658 B18R2.6482 Cc1cccc(n1)COCc2cccc(c2)I 7a_100011215336_100000757606 [0,2,0,0,0,0|1,0,0]=3 31659 B18R2.6482 Cc1cccc(n1)COCc2cccc(c2)N 34a_100000211919_100000757606 [0,2,0,0,0,0|1,0,0]=3 31660 B18R2.6482 Cc1cccc(n1)COCc2cccc(c2)O 34a_100000690600_100011660834 [0,2,0,0,0,0|1,0,0]=3 31661 B18R2.6482 Cc1cccc(n1)COCc2cccc(n2)Br 34a_100000690600_100009889011 [0,2,0,0,0,0|2,0,0]=4 31662 B18R2.6482 Cc1cccc(n1)COCc2cccc(n2)Br 34a_100000694195_100000757606 [0,2,0,0,0,0|2,0,0]=4 31663 B18R2.6482 Cc1cccc(n1)COCc2cccc(n2)C 34a_100000690600_100000757606 [0,2,0,0,0,0|2,0,0]=4 31664 B18R2.6482 Cc1cccc(n1)COCc2cccc(n2)Cl 34a_100000690600_100000086093 [0,2,0,0,0,0|2,0,0]=4 31665 B18R2.6482 Cc1cccc(n1)COCc2cccc(n2)Cl 34a_100011998359_100000757606 [0,2,0,0,0,0|2,0,0]=4 31666 B18R2.6482 Cc1cccc(n1)COCc2cccc(n2)F 34a_100000086748_100000757606 [0,2,0,0,0,0|2,0,0]=4 31667 B18R2.6482 Cc1cccc(n1)COCc2cccc(n2)F 34a_100000690600_100009819644 [0,2,0,0,0,0|2,0,0]=4 31668 B18R2.6482 Cc1cccc(n1)COCc2ccnc(c2)Br 34a_100000690600_100010243470 [0,2,0,0,0,0|2,0,0]=4 31669 B18R2.6482 Cc1cccc(n1)COCc2ccnc(c2)Br 34a_100009814636_100000757606 [0,2,0,0,0,0|2,0,0]=4 31670 B18R2.6482 Cc1cccc(n1)COCc2ccnc(c2)Br 7a_100009814636_100000757606 [0,2,0,0,0,0|2,0,0]=4 31671 B18R2.6482 Cc1cccc(n1)COCc2ccnc(c2)Cl 34a_100000690600_100000764220 [0,2,0,0,0,0|2,0,0]=4 31672 B18R2.6482 Cc1cccc(n1)COCc2ccnc(c2)Cl 34a_100000748751_100000757606 [0,2,0,0,0,0|2,0,0]=4 31673 B18R2.6482 Cc1cccc(n1)COCc2ccnc(c2)F 34a_100000082451_100000757606 [0,2,0,0,0,0|2,0,0]=4 31674 B18R2.6482 Cc1cccc(n1)COCc2cncc(c2)Br 34a_100000690600_100000738771 [0,2,0,0,0,0|2,0,0]=4 31675 B18R2.6482 Cc1cccc(n1)COCc2cncc(c2)Br 34a_100011259137_100000757606 [0,2,0,0,0,0|2,0,0]=4 31676 B18R2.6482 Cc1cccc(n1)COCc2cncc(c2)Br 7a_100011259137_100000757606 [0,2,0,0,0,0|2,0,0]=4 31677 B18R2.6482 Cc1cccc(n1)COCc2cncc(c2)Cl 34a_100000092867_100000757606 [0,2,0,0,0,0|2,0,0]=4 31678 B18R2.6482 Cc1cccc(n1)COCc2cncc(c2)Cl 34a_100000690600_100016992070 [0,2,0,0,0,0|2,0,0]=4 31679 B18R2.6482 Cc1cccc(n1)COCc2cncc(c2)Cl 7a_100000092867_100000757606 [0,2,0,0,0,0|2,0,0]=4 31680 B18R2.6482 Cc1cccc(n1)COCc2cncc(c2)F 34a_100000690600_100000725299 [0,2,0,0,0,0|2,0,0]=4 31681 B18R2.6482 Cc1cccc(n1)COCc2cncc(c2)F 34a_100011962875_100000757606 [0,2,0,0,0,0|2,0,0]=4 31682 B18R2.6482 Cc1cccc(n1)COCc2cncc(c2)F 7a_100011962875_100000757606 [0,2,0,0,0,0|2,0,0]=4 31683 B18R2.6482 Cc1cccc(n1)COCc2cncc(c2)N 34a_100000085308_100000757606 [0,2,0,0,0,0|2,0,0]=4 31684 B18R2.6482 Cc1cccc(n1)CSCc2cccc(c2)Br 62a_100000211773_100000757606 [0,2,0,0,0,0|1,1,0]=4 31685 B18R2.6482 Cc1cccc(n1)CSCc2cccc(c2)Br 62a_100000757606_100000211773 [0,2,0,0,0,0|1,1,0]=4 31686 B18R2.6482 Cc1cccc(n1)CSCc2cccc(c2)Cl 62a_100000187163_100000757606 [0,2,0,0,0,0|1,1,0]=4 31687 B18R2.6482 Cc1cccc(n1)CSCc2cccc(c2)Cl 62a_100000757606_100000187163 [0,2,0,0,0,0|1,1,0]=4 31688 B18R2.6482 Cc1cccc(n1)CSCc2cccc(c2)F 62a_100000230114_100000757606 [0,2,0,0,0,0|1,1,0]=4 31689 B18R2.6482 Cc1cccc(n1)CSCc2cccc(c2)F 62a_100000757606_100000230114 [0,2,0,0,0,0|1,1,0]=4 31690 B18R2.6482 Cc1cccc(n1)CSCc2cccc(c2)I 62a_100000757606_100011218688 [0,2,0,0,0,0|1,1,0]=4 31691 B18R2.6482 Cc1cccc(n1)CSCc2cccc(c2)I 62a_100011218688_100000757606 [0,2,0,0,0,0|1,1,0]=4 31692 B18R2.6482 Cc1cccc(n1)CSCc2cccc(c2)O 62a_100000757606_100011660834 [0,2,0,0,0,0|1,1,0]=4 31693 B18R2.6482 Cc1cccc(n1)CSCc2cccc(c2)O 62a_100011660834_100000757606 [0,2,0,0,0,0|1,1,0]=4 31694 B18R2.6482 Cc1ccnc(c1)CNCc2cccc(c2)Br 207a_100000174977_100011361488 [0,2,0,0,0,0|2,0,0]=4 31695 B18R2.6482 Cc1ccnc(c1)CNCc2cccc(c2)Br 2230a_100000174977_100000718516 [0,2,0,0,0,0|2,0,0]=4 31696 B18R2.6482 Cc1ccnc(c1)CNCc2cccc(c2)Br 270004a_100000174977_100011361488 [0,2,0,0,0,0|2,0,0]=4 31697 B18R2.6482 Cc1ccnc(c1)CNCc2cccc(c2)Br 34a_100000174977_100000718516 [0,2,0,0,0,0|2,0,0]=4 31698 B18R2.6482 Cc1ccnc(c1)CNCc2cccc(c2)Cl 207a_100000174878_100011361488 [0,2,0,0,0,0|2,0,0]=4 31699 B18R2.6482 Cc1ccnc(c1)CNCc2cccc(c2)Cl 2230a_100000174878_100000718516 [0,2,0,0,0,0|2,0,0]=4 31700 B18R2.6482 Cc1ccnc(c1)CNCc2cccc(c2)Cl 270004a_100000174878_100011361488 [0,2,0,0,0,0|2,0,0]=4 31701 B18R2.6482 Cc1ccnc(c1)CNCc2cccc(c2)Cl 34a_100000174878_100000718516 [0,2,0,0,0,0|2,0,0]=4 31702 B18R2.6482 Cc1ccnc(c1)CNCc2cccc(c2)F 207a_100000174948_100011361488 [0,2,0,0,0,0|2,0,0]=4 31703 B18R2.6482 Cc1ccnc(c1)CNCc2cccc(c2)F 2230a_100000174948_100000718516 [0,2,0,0,0,0|2,0,0]=4 31704 B18R2.6482 Cc1ccnc(c1)CNCc2cccc(c2)F 270004a_100000174948_100011361488 [0,2,0,0,0,0|2,0,0]=4 31705 B18R2.6482 Cc1ccnc(c1)CNCc2cccc(c2)F 34a_100000174948_100000718516 [0,2,0,0,0,0|2,0,0]=4 31706 B18R2.6482 Cc1ccnc(c1)CNCc2cccc(c2)I 207a_100000106179_100011361488 [0,2,0,0,0,0|2,0,0]=4 31707 B18R2.6482 Cc1ccnc(c1)CNCc2cccc(c2)I 2230a_100000106179_100000718516 [0,2,0,0,0,0|2,0,0]=4 31708 B18R2.6482 Cc1ccnc(c1)CNCc2cccc(c2)I 270004a_100000106179_100011361488 [0,2,0,0,0,0|2,0,0]=4 31709 B18R2.6482 Cc1ccnc(c1)CNCc2cccc(c2)I 34a_100000106179_100000718516 [0,2,0,0,0,0|2,0,0]=4 31710 B18R2.6482 Cc1ccnc(c1)CNCc2cccc(c2)O 207a_100000743036_100011361488 [0,2,0,0,0,0|2,0,0]=4 31711 B18R2.6482 Cc1ccnc(c1)CNCc2cccc(c2)O 2230a_100000743036_100000718516 [0,2,0,0,0,0|2,0,0]=4 31712 B18R2.6482 Cc1ccnc(c1)CNCc2cccc(c2)O 270004a_100000743036_100011361488 [0,2,0,0,0,0|2,0,0]=4 31713 B18R2.6482 Cc1ccnc(c1)CNCc2cccc(c2)O 34a_100000743036_100000718516 [0,2,0,0,0,0|2,0,0]=4 31714 B18R2.6482 Cc1ccnc(c1)COCc2cc(ccn2)Br 34a_100011998357_100010173614 [0,2,0,0,0,0|2,0,0]=4 31715 B18R2.6482 Cc1ccnc(c1)COCc2cc(ccn2)C 34a_100011998357_100000718516 [0,2,0,0,0,0|2,0,0]=4 31716 B18R2.6482 Cc1ccnc(c1)COCc2cc(ccn2)Cl 34a_100000748867_100000718516 [0,2,0,0,0,0|2,0,0]=4 31717 B18R2.6482 Cc1ccnc(c1)COCc2cc(ccn2)Cl 34a_100011998357_100016988179 [0,2,0,0,0,0|2,0,0]=4 31718 B18R2.6482 Cc1ccnc(c1)COCc2cc(ccn2)N 34a_100000692640_100000718516 [0,2,0,0,0,0|2,0,0]=4 31719 B18R2.6482 Cc1ccnc(c1)COCc2ccc[n+](c2)[O-] 34a_100000037817_100000718516 [0,2,0,0,0,0|2,0,0]=4 31720 B18R2.6482 Cc1ccnc(c1)COCc2ccc[n+](c2)[O-] 7a_100000037817_100000718516 [0,2,0,0,0,0|2,0,0]=4 31721 B18R2.6482 Cc1ccnc(c1)COCc2cccc(c2)Br 34a_100000687537_100000718516 [0,2,0,0,0,0|1,0,0]=3 31722 B18R2.6482 Cc1ccnc(c1)COCc2cccc(c2)Br 34a_100011998357_100000698116 [0,2,0,0,0,0|1,0,0]=3 31723 B18R2.6482 Cc1ccnc(c1)COCc2cccc(c2)Br 7a_100000687537_100000718516 [0,2,0,0,0,0|1,0,0]=3 31724 B18R2.6482 Cc1ccnc(c1)COCc2cccc(c2)Cl 34a_100000241301_100000718516 [0,2,0,0,0,0|1,0,0]=3 31725 B18R2.6482 Cc1ccnc(c1)COCc2cccc(c2)Cl 34a_100011998357_100000187163 [0,2,0,0,0,0|1,0,0]=3 31726 B18R2.6482 Cc1ccnc(c1)COCc2cccc(c2)Cl 7a_100000241301_100000718516 [0,2,0,0,0,0|1,0,0]=3 31727 B18R2.6482 Cc1ccnc(c1)COCc2cccc(c2)F 34a_100000210976_100000718516 [0,2,0,0,0,0|1,0,0]=3 31728 B18R2.6482 Cc1ccnc(c1)COCc2cccc(c2)F 34a_100011998357_100000187166 [0,2,0,0,0,0|1,0,0]=3 31729 B18R2.6482 Cc1ccnc(c1)COCc2cccc(c2)F 7a_100000210976_100000718516 [0,2,0,0,0,0|1,0,0]=3 31730 B18R2.6482 Cc1ccnc(c1)COCc2cccc(c2)I 34a_100011215336_100000718516 [0,2,0,0,0,0|1,0,0]=3 31731 B18R2.6482 Cc1ccnc(c1)COCc2cccc(c2)I 34a_100011998357_100011218688 [0,2,0,0,0,0|1,0,0]=3 31732 B18R2.6482 Cc1ccnc(c1)COCc2cccc(c2)I 7a_100011215336_100000718516 [0,2,0,0,0,0|1,0,0]=3 31733 B18R2.6482 Cc1ccnc(c1)COCc2cccc(c2)N 34a_100000211919_100000718516 [0,2,0,0,0,0|1,0,0]=3 31734 B18R2.6482 Cc1ccnc(c1)COCc2cccc(c2)O 34a_100011998357_100011660834 [0,2,0,0,0,0|1,0,0]=3 31735 B18R2.6482 Cc1ccnc(c1)COCc2cccc(n2)Br 34a_100000694195_100000718516 [0,2,0,0,0,0|2,0,0]=4 31736 B18R2.6482 Cc1ccnc(c1)COCc2cccc(n2)Br 34a_100011998357_100009889011 [0,2,0,0,0,0|2,0,0]=4 31737 B18R2.6482 Cc1ccnc(c1)COCc2cccc(n2)C 34a_100000690600_100000718516 [0,2,0,0,0,0|2,0,0]=4 31738 B18R2.6482 Cc1ccnc(c1)COCc2cccc(n2)C 34a_100011998357_100000757606 [0,2,0,0,0,0|2,0,0]=4 31739 B18R2.6482 Cc1ccnc(c1)COCc2cccc(n2)Cl 34a_100011998357_100000086093 [0,2,0,0,0,0|2,0,0]=4 31740 B18R2.6482 Cc1ccnc(c1)COCc2cccc(n2)Cl 34a_100011998359_100000718516 [0,2,0,0,0,0|2,0,0]=4 31741 B18R2.6482 Cc1ccnc(c1)COCc2cccc(n2)F 34a_100000086748_100000718516 [0,2,0,0,0,0|2,0,0]=4 31742 B18R2.6482 Cc1ccnc(c1)COCc2cccc(n2)F 34a_100011998357_100009819644 [0,2,0,0,0,0|2,0,0]=4 31743 B18R2.6482 Cc1ccnc(c1)COCc2ccnc(c2)Br 34a_100009814636_100000718516 [0,2,0,0,0,0|2,0,0]=4 31744 B18R2.6482 Cc1ccnc(c1)COCc2ccnc(c2)Br 34a_100011998357_100010243470 [0,2,0,0,0,0|2,0,0]=4 31745 B18R2.6482 Cc1ccnc(c1)COCc2ccnc(c2)Br 7a_100009814636_100000718516 [0,2,0,0,0,0|2,0,0]=4 31746 B18R2.6482 Cc1ccnc(c1)COCc2ccnc(c2)C 34a_100011998357_200020672517 [0,2,0,0,0,0|2,0,0]=4 31747 B18R2.6482 Cc1ccnc(c1)COCc2ccnc(c2)C 34a_100011998630_100000718516 [0,2,0,0,0,0|2,0,0]=4 31748 B18R2.6482 Cc1ccnc(c1)COCc2ccnc(c2)Cl 34a_100000748751_100000718516 [0,2,0,0,0,0|2,0,0]=4 31749 B18R2.6482 Cc1ccnc(c1)COCc2ccnc(c2)Cl 34a_100011998357_100000764220 [0,2,0,0,0,0|2,0,0]=4 31750 B18R2.6482 Cc1ccnc(c1)COCc2ccnc(c2)F 34a_100000082451_100000718516 [0,2,0,0,0,0|2,0,0]=4 31751 B18R2.6482 Cc1ccnc(c1)COCc2cncc(c2)Br 34a_100011259137_100000718516 [0,2,0,0,0,0|2,0,0]=4 31752 B18R2.6482 Cc1ccnc(c1)COCc2cncc(c2)Br 34a_100011998357_100000738771 [0,2,0,0,0,0|2,0,0]=4 31753 B18R2.6482 Cc1ccnc(c1)COCc2cncc(c2)Br 7a_100011259137_100000718516 [0,2,0,0,0,0|2,0,0]=4 31754 B18R2.6482 Cc1ccnc(c1)COCc2cncc(c2)Cl 34a_100000092867_100000718516 [0,2,0,0,0,0|2,0,0]=4 31755 B18R2.6482 Cc1ccnc(c1)COCc2cncc(c2)Cl 34a_100011998357_100016992070 [0,2,0,0,0,0|2,0,0]=4 31756 B18R2.6482 Cc1ccnc(c1)COCc2cncc(c2)Cl 7a_100000092867_100000718516 [0,2,0,0,0,0|2,0,0]=4 31757 B18R2.6482 Cc1ccnc(c1)COCc2cncc(c2)F 34a_100011962875_100000718516 [0,2,0,0,0,0|2,0,0]=4 31758 B18R2.6482 Cc1ccnc(c1)COCc2cncc(c2)F 34a_100011998357_100000725299 [0,2,0,0,0,0|2,0,0]=4 31759 B18R2.6482 Cc1ccnc(c1)COCc2cncc(c2)F 7a_100011962875_100000718516 [0,2,0,0,0,0|2,0,0]=4 31760 B18R2.6482 Cc1ccnc(c1)COCc2cncc(c2)N 34a_100000085308_100000718516 [0,2,0,0,0,0|2,0,0]=4 31761 B18R2.6482 Cc1ccnc(c1)CSCc2cccc(c2)Br 62a_100000211773_100000718516 [0,2,0,0,0,0|1,1,0]=4 31762 B18R2.6482 Cc1ccnc(c1)CSCc2cccc(c2)Br 62a_100000718516_100000211773 [0,2,0,0,0,0|1,1,0]=4 31763 B18R2.6482 Cc1ccnc(c1)CSCc2cccc(c2)Cl 62a_100000187163_100000718516 [0,2,0,0,0,0|1,1,0]=4 31764 B18R2.6482 Cc1ccnc(c1)CSCc2cccc(c2)Cl 62a_100000718516_100000187163 [0,2,0,0,0,0|1,1,0]=4 31765 B18R2.6482 Cc1ccnc(c1)CSCc2cccc(c2)F 62a_100000230114_100000718516 [0,2,0,0,0,0|1,1,0]=4 31766 B18R2.6482 Cc1ccnc(c1)CSCc2cccc(c2)F 62a_100000718516_100000230114 [0,2,0,0,0,0|1,1,0]=4 31767 B18R2.6482 Cc1ccnc(c1)CSCc2cccc(c2)I 62a_100000718516_100011218688 [0,2,0,0,0,0|1,1,0]=4 31768 B18R2.6482 Cc1ccnc(c1)CSCc2cccc(c2)I 62a_100011218688_100000718516 [0,2,0,0,0,0|1,1,0]=4 31769 B18R2.6482 Cc1ccnc(c1)CSCc2cccc(c2)O 62a_100000718516_100011660834 [0,2,0,0,0,0|1,1,0]=4 31770 B18R2.6482 Cc1ccnc(c1)CSCc2cccc(c2)O 62a_100011660834_100000718516 [0,2,0,0,0,0|1,1,0]=4 31771 B18R2.6482 Cc1cncc(c1)CNCc2cccc(c2)Br 207a_100000174977_100011998712 [0,2,0,0,0,0|2,0,0]=4 31772 B18R2.6482 Cc1cncc(c1)CNCc2cccc(c2)Br 207a_100000692839_100000210085 [0,2,0,0,0,0|2,0,0]=4 31773 B18R2.6482 Cc1cncc(c1)CNCc2cccc(c2)Br 2230a_100000174977_100000716715 [0,2,0,0,0,0|2,0,0]=4 31774 B18R2.6482 Cc1cncc(c1)CNCc2cccc(c2)Br 2230a_100000692839_100000698116 [0,2,0,0,0,0|2,0,0]=4 31775 B18R2.6482 Cc1cncc(c1)CNCc2cccc(c2)Br 270004a_100000174977_100011998712 [0,2,0,0,0,0|2,0,0]=4 31776 B18R2.6482 Cc1cncc(c1)CNCc2cccc(c2)Br 270004a_100000692839_100000210085 [0,2,0,0,0,0|2,0,0]=4 31777 B18R2.6482 Cc1cncc(c1)CNCc2cccc(c2)Br 34a_100000174977_100000716715 [0,2,0,0,0,0|2,0,0]=4 31778 B18R2.6482 Cc1cncc(c1)CNCc2cccc(c2)Br 34a_100000692839_100000698116 [0,2,0,0,0,0|2,0,0]=4 31779 B18R2.6482 Cc1cncc(c1)CNCc2cccc(c2)Cl 207a_100000174878_100011998712 [0,2,0,0,0,0|2,0,0]=4 31780 B18R2.6482 Cc1cncc(c1)CNCc2cccc(c2)Cl 207a_100000692839_100000210801 [0,2,0,0,0,0|2,0,0]=4 31781 B18R2.6482 Cc1cncc(c1)CNCc2cccc(c2)Cl 2230a_100000174878_100000716715 [0,2,0,0,0,0|2,0,0]=4 31782 B18R2.6482 Cc1cncc(c1)CNCc2cccc(c2)Cl 2230a_100000692839_100000181238 [0,2,0,0,0,0|2,0,0]=4 31783 B18R2.6482 Cc1cncc(c1)CNCc2cccc(c2)Cl 270004a_100000174878_100011998712 [0,2,0,0,0,0|2,0,0]=4 31784 B18R2.6482 Cc1cncc(c1)CNCc2cccc(c2)Cl 270004a_100000692839_100000210801 [0,2,0,0,0,0|2,0,0]=4 31785 B18R2.6482 Cc1cncc(c1)CNCc2cccc(c2)Cl 34a_100000174878_100000716715 [0,2,0,0,0,0|2,0,0]=4 31786 B18R2.6482 Cc1cncc(c1)CNCc2cccc(c2)Cl 34a_100000692839_100000187163 [0,2,0,0,0,0|2,0,0]=4 31787 B18R2.6482 Cc1cncc(c1)CNCc2cccc(c2)F 207a_100000174948_100011998712 [0,2,0,0,0,0|2,0,0]=4 31788 B18R2.6482 Cc1cncc(c1)CNCc2cccc(c2)F 207a_100000692839_100000210812 [0,2,0,0,0,0|2,0,0]=4 31789 B18R2.6482 Cc1cncc(c1)CNCc2cccc(c2)F 2230a_100000174948_100000716715 [0,2,0,0,0,0|2,0,0]=4 31790 B18R2.6482 Cc1cncc(c1)CNCc2cccc(c2)F 2230a_100000692839_100000230114 [0,2,0,0,0,0|2,0,0]=4 31791 B18R2.6482 Cc1cncc(c1)CNCc2cccc(c2)F 270004a_100000174948_100011998712 [0,2,0,0,0,0|2,0,0]=4 31792 B18R2.6482 Cc1cncc(c1)CNCc2cccc(c2)F 270004a_100000692839_100000210812 [0,2,0,0,0,0|2,0,0]=4 31793 B18R2.6482 Cc1cncc(c1)CNCc2cccc(c2)F 34a_100000174948_100000716715 [0,2,0,0,0,0|2,0,0]=4 31794 B18R2.6482 Cc1cncc(c1)CNCc2cccc(c2)F 34a_100000692839_100000187166 [0,2,0,0,0,0|2,0,0]=4 31795 B18R2.6482 Cc1cncc(c1)CNCc2cccc(c2)I 207a_100000106179_100011998712 [0,2,0,0,0,0|2,0,0]=4 31796 B18R2.6482 Cc1cncc(c1)CNCc2cccc(c2)I 207a_100000692839_100000014684 [0,2,0,0,0,0|2,0,0]=4 31797 B18R2.6482 Cc1cncc(c1)CNCc2cccc(c2)I 2230a_100000106179_100000716715 [0,2,0,0,0,0|2,0,0]=4 31798 B18R2.6482 Cc1cncc(c1)CNCc2cccc(c2)I 2230a_100000692839_100011218688 [0,2,0,0,0,0|2,0,0]=4 31799 B18R2.6482 Cc1cncc(c1)CNCc2cccc(c2)I 270004a_100000106179_100011998712 [0,2,0,0,0,0|2,0,0]=4 31800 B18R2.6482 Cc1cncc(c1)CNCc2cccc(c2)I 270004a_100000692839_100000014684 [0,2,0,0,0,0|2,0,0]=4 31801 B18R2.6482 Cc1cncc(c1)CNCc2cccc(c2)I 34a_100000106179_100000716715 [0,2,0,0,0,0|2,0,0]=4 31802 B18R2.6482 Cc1cncc(c1)CNCc2cccc(c2)I 34a_100000692839_100011218688 [0,2,0,0,0,0|2,0,0]=4 31803 B18R2.6482 Cc1cncc(c1)CNCc2cccc(c2)O 207a_100000692839_100000188321 [0,2,0,0,0,0|2,0,0]=4 31804 B18R2.6482 Cc1cncc(c1)CNCc2cccc(c2)O 207a_100000743036_100011998712 [0,2,0,0,0,0|2,0,0]=4 31805 B18R2.6482 Cc1cncc(c1)CNCc2cccc(c2)O 2230a_100000692839_100011660834 [0,2,0,0,0,0|2,0,0]=4 31806 B18R2.6482 Cc1cncc(c1)CNCc2cccc(c2)O 2230a_100000743036_100000716715 [0,2,0,0,0,0|2,0,0]=4 31807 B18R2.6482 Cc1cncc(c1)CNCc2cccc(c2)O 270004a_100000692839_100000188321 [0,2,0,0,0,0|2,0,0]=4 31808 B18R2.6482 Cc1cncc(c1)CNCc2cccc(c2)O 270004a_100000743036_100011998712 [0,2,0,0,0,0|2,0,0]=4 31809 B18R2.6482 Cc1cncc(c1)CNCc2cccc(c2)O 34a_100000692839_100011660834 [0,2,0,0,0,0|2,0,0]=4 31810 B18R2.6482 Cc1cncc(c1)CNCc2cccc(c2)O 34a_100000743036_100000716715 [0,2,0,0,0,0|2,0,0]=4 31811 B18R2.6482 Cc1cncc(c1)COCc2cc(ccn2)Br 34a_100011998709_100010173614 [0,2,0,0,0,0|2,0,0]=4 31812 B18R2.6482 Cc1cncc(c1)COCc2cc(ccn2)Br 7a_100011998709_100010173614 [0,2,0,0,0,0|2,0,0]=4 31813 B18R2.6482 Cc1cncc(c1)COCc2cc(ccn2)C 34a_100011998357_100000716715 [0,2,0,0,0,0|2,0,0]=4 31814 B18R2.6482 Cc1cncc(c1)COCc2cc(ccn2)C 34a_100011998709_100000718516 [0,2,0,0,0,0|2,0,0]=4 31815 B18R2.6482 Cc1cncc(c1)COCc2cc(ccn2)C 7a_100011998709_100000718516 [0,2,0,0,0,0|2,0,0]=4 31816 B18R2.6482 Cc1cncc(c1)COCc2cc(ccn2)Cl 34a_100000748867_100000716715 [0,2,0,0,0,0|2,0,0]=4 31817 B18R2.6482 Cc1cncc(c1)COCc2cc(ccn2)Cl 34a_100011998709_100016988179 [0,2,0,0,0,0|2,0,0]=4 31818 B18R2.6482 Cc1cncc(c1)COCc2cc(ccn2)Cl 7a_100011998709_100016988179 [0,2,0,0,0,0|2,0,0]=4 31819 B18R2.6482 Cc1cncc(c1)COCc2cc(ccn2)N 34a_100000692640_100000716715 [0,2,0,0,0,0|2,0,0]=4 31820 B18R2.6482 Cc1cncc(c1)COCc2ccc[n+](c2)[O-] 34a_100000037817_100000716715 [0,2,0,0,0,0|2,0,0]=4 31821 B18R2.6482 Cc1cncc(c1)COCc2ccc[n+](c2)[O-] 7a_100000037817_100000716715 [0,2,0,0,0,0|2,0,0]=4 31822 B18R2.6482 Cc1cncc(c1)COCc2cccc(c2)Br 34a_100000687537_100000716715 [0,2,0,0,0,0|1,0,0]=3 31823 B18R2.6482 Cc1cncc(c1)COCc2cccc(c2)Br 34a_100011998709_100000698116 [0,2,0,0,0,0|1,0,0]=3 31824 B18R2.6482 Cc1cncc(c1)COCc2cccc(c2)Br 7a_100000687537_100000716715 [0,2,0,0,0,0|1,0,0]=3 31825 B18R2.6482 Cc1cncc(c1)COCc2cccc(c2)Br 7a_100011998709_100000211773 [0,2,0,0,0,0|1,0,0]=3 31826 B18R2.6482 Cc1cncc(c1)COCc2cccc(c2)Cl 34a_100000241301_100000716715 [0,2,0,0,0,0|1,0,0]=3 31827 B18R2.6482 Cc1cncc(c1)COCc2cccc(c2)Cl 34a_100011998709_100000187163 [0,2,0,0,0,0|1,0,0]=3 31828 B18R2.6482 Cc1cncc(c1)COCc2cccc(c2)Cl 7a_100000241301_100000716715 [0,2,0,0,0,0|1,0,0]=3 31829 B18R2.6482 Cc1cncc(c1)COCc2cccc(c2)Cl 7a_100011998709_100000187163 [0,2,0,0,0,0|1,0,0]=3 31830 B18R2.6482 Cc1cncc(c1)COCc2cccc(c2)F 34a_100000210976_100000716715 [0,2,0,0,0,0|1,0,0]=3 31831 B18R2.6482 Cc1cncc(c1)COCc2cccc(c2)F 34a_100011998709_100000187166 [0,2,0,0,0,0|1,0,0]=3 31832 B18R2.6482 Cc1cncc(c1)COCc2cccc(c2)F 7a_100000210976_100000716715 [0,2,0,0,0,0|1,0,0]=3 31833 B18R2.6482 Cc1cncc(c1)COCc2cccc(c2)F 7a_100011998709_100000230114 [0,2,0,0,0,0|1,0,0]=3 31834 B18R2.6482 Cc1cncc(c1)COCc2cccc(c2)I 34a_100011215336_100000716715 [0,2,0,0,0,0|1,0,0]=3 31835 B18R2.6482 Cc1cncc(c1)COCc2cccc(c2)I 34a_100011998709_100011218688 [0,2,0,0,0,0|1,0,0]=3 31836 B18R2.6482 Cc1cncc(c1)COCc2cccc(c2)I 7a_100011215336_100000716715 [0,2,0,0,0,0|1,0,0]=3 31837 B18R2.6482 Cc1cncc(c1)COCc2cccc(c2)I 7a_100011998709_100011218688 [0,2,0,0,0,0|1,0,0]=3 31838 B18R2.6482 Cc1cncc(c1)COCc2cccc(c2)N 34a_100000211919_100000716715 [0,2,0,0,0,0|1,0,0]=3 31839 B18R2.6482 Cc1cncc(c1)COCc2cccc(c2)O 34a_100011998709_100011660834 [0,2,0,0,0,0|1,0,0]=3 31840 B18R2.6482 Cc1cncc(c1)COCc2cccc(c2)O 7a_100011998709_100000084143 [0,2,0,0,0,0|1,0,0]=3 31841 B18R2.6482 Cc1cncc(c1)COCc2cccc(n2)Br 34a_100000694195_100000716715 [0,2,0,0,0,0|2,0,0]=4 31842 B18R2.6482 Cc1cncc(c1)COCc2cccc(n2)Br 34a_100011998709_100009889011 [0,2,0,0,0,0|2,0,0]=4 31843 B18R2.6482 Cc1cncc(c1)COCc2cccc(n2)Br 7a_100011998709_100009889011 [0,2,0,0,0,0|2,0,0]=4 31844 B18R2.6482 Cc1cncc(c1)COCc2cccc(n2)C 34a_100000690600_100000716715 [0,2,0,0,0,0|2,0,0]=4 31845 B18R2.6482 Cc1cncc(c1)COCc2cccc(n2)C 34a_100011998709_100000757606 [0,2,0,0,0,0|2,0,0]=4 31846 B18R2.6482 Cc1cncc(c1)COCc2cccc(n2)C 7a_100011998709_100000757606 [0,2,0,0,0,0|2,0,0]=4 31847 B18R2.6482 Cc1cncc(c1)COCc2cccc(n2)Cl 34a_100011998359_100000716715 [0,2,0,0,0,0|2,0,0]=4 31848 B18R2.6482 Cc1cncc(c1)COCc2cccc(n2)Cl 34a_100011998709_100000086093 [0,2,0,0,0,0|2,0,0]=4 31849 B18R2.6482 Cc1cncc(c1)COCc2cccc(n2)Cl 7a_100011998709_100000086093 [0,2,0,0,0,0|2,0,0]=4 31850 B18R2.6482 Cc1cncc(c1)COCc2cccc(n2)F 34a_100000086748_100000716715 [0,2,0,0,0,0|2,0,0]=4 31851 B18R2.6482 Cc1cncc(c1)COCc2cccc(n2)F 34a_100011998709_100009819644 [0,2,0,0,0,0|2,0,0]=4 31852 B18R2.6482 Cc1cncc(c1)COCc2cccc(n2)F 7a_100011998709_100009819644 [0,2,0,0,0,0|2,0,0]=4 31853 B18R2.6482 Cc1cncc(c1)COCc2ccnc(c2)Br 34a_100009814636_100000716715 [0,2,0,0,0,0|2,0,0]=4 31854 B18R2.6482 Cc1cncc(c1)COCc2ccnc(c2)Br 34a_100011998709_100010243470 [0,2,0,0,0,0|2,0,0]=4 31855 B18R2.6482 Cc1cncc(c1)COCc2ccnc(c2)Br 7a_100009814636_100000716715 [0,2,0,0,0,0|2,0,0]=4 31856 B18R2.6482 Cc1cncc(c1)COCc2ccnc(c2)Br 7a_100011998709_100010254460 [0,2,0,0,0,0|2,0,0]=4 31857 B18R2.6482 Cc1cncc(c1)COCc2ccnc(c2)C 34a_100011998630_100000716715 [0,2,0,0,0,0|2,0,0]=4 31858 B18R2.6482 Cc1cncc(c1)COCc2ccnc(c2)C 34a_100011998709_200020672517 [0,2,0,0,0,0|2,0,0]=4 31859 B18R2.6482 Cc1cncc(c1)COCc2ccnc(c2)C 7a_100011998709_200020672517 [0,2,0,0,0,0|2,0,0]=4 31860 B18R2.6482 Cc1cncc(c1)COCc2ccnc(c2)Cl 34a_100000748751_100000716715 [0,2,0,0,0,0|2,0,0]=4 31861 B18R2.6482 Cc1cncc(c1)COCc2ccnc(c2)Cl 34a_100011998709_100000764220 [0,2,0,0,0,0|2,0,0]=4 31862 B18R2.6482 Cc1cncc(c1)COCc2ccnc(c2)Cl 7a_100011998709_100000764220 [0,2,0,0,0,0|2,0,0]=4 31863 B18R2.6482 Cc1cncc(c1)COCc2ccnc(c2)F 34a_100000082451_100000716715 [0,2,0,0,0,0|2,0,0]=4 31864 B18R2.6482 Cc1cncc(c1)COCc2cncc(c2)Br 34a_100011259137_100000716715 [0,2,0,0,0,0|2,0,0]=4 31865 B18R2.6482 Cc1cncc(c1)COCc2cncc(c2)Br 34a_100011998709_100000738771 [0,2,0,0,0,0|2,0,0]=4 31866 B18R2.6482 Cc1cncc(c1)COCc2cncc(c2)Br 7a_100011259137_100000716715 [0,2,0,0,0,0|2,0,0]=4 31867 B18R2.6482 Cc1cncc(c1)COCc2cncc(c2)Br 7a_100011998709_100000738771 [0,2,0,0,0,0|2,0,0]=4 31868 B18R2.6482 Cc1cncc(c1)COCc2cncc(c2)C 34a_100011998709_100000716715 [0,2,0,0,0,0|2,0,0]=4 31869 B18R2.6482 Cc1cncc(c1)COCc2cncc(c2)C 7a_100011998709_100000716715 [0,2,0,0,0,0|2,0,0]=4 31870 B18R2.6482 Cc1cncc(c1)COCc2cncc(c2)Cl 34a_100000092867_100000716715 [0,2,0,0,0,0|2,0,0]=4 31871 B18R2.6482 Cc1cncc(c1)COCc2cncc(c2)Cl 34a_100011998709_100016992070 [0,2,0,0,0,0|2,0,0]=4 31872 B18R2.6482 Cc1cncc(c1)COCc2cncc(c2)Cl 7a_100000092867_100000716715 [0,2,0,0,0,0|2,0,0]=4 31873 B18R2.6482 Cc1cncc(c1)COCc2cncc(c2)Cl 7a_100011998709_100016992070 [0,2,0,0,0,0|2,0,0]=4 31874 B18R2.6482 Cc1cncc(c1)COCc2cncc(c2)F 34a_100011962875_100000716715 [0,2,0,0,0,0|2,0,0]=4 31875 B18R2.6482 Cc1cncc(c1)COCc2cncc(c2)F 34a_100011998709_100000725299 [0,2,0,0,0,0|2,0,0]=4 31876 B18R2.6482 Cc1cncc(c1)COCc2cncc(c2)F 7a_100011962875_100000716715 [0,2,0,0,0,0|2,0,0]=4 31877 B18R2.6482 Cc1cncc(c1)COCc2cncc(c2)F 7a_100011998709_100000725299 [0,2,0,0,0,0|2,0,0]=4 31878 B18R2.6482 Cc1cncc(c1)COCc2cncc(c2)N 34a_100000085308_100000716715 [0,2,0,0,0,0|2,0,0]=4 31879 B18R2.6482 Cc1cncc(c1)CSCc2cccc(c2)Br 62a_100000211773_100000716715 [0,2,0,0,0,0|1,1,0]=4 31880 B18R2.6482 Cc1cncc(c1)CSCc2cccc(c2)Br 62a_100000716715_100000211773 [0,2,0,0,0,0|1,1,0]=4 31881 B18R2.6482 Cc1cncc(c1)CSCc2cccc(c2)Cl 62a_100000187163_100000716715 [0,2,0,0,0,0|1,1,0]=4 31882 B18R2.6482 Cc1cncc(c1)CSCc2cccc(c2)Cl 62a_100000716715_100000187163 [0,2,0,0,0,0|1,1,0]=4 31883 B18R2.6482 Cc1cncc(c1)CSCc2cccc(c2)F 62a_100000230114_100000716715 [0,2,0,0,0,0|1,1,0]=4 31884 B18R2.6482 Cc1cncc(c1)CSCc2cccc(c2)F 62a_100000716715_100000230114 [0,2,0,0,0,0|1,1,0]=4 31885 B18R2.6482 Cc1cncc(c1)CSCc2cccc(c2)I 62a_100000716715_100011218688 [0,2,0,0,0,0|1,1,0]=4 31886 B18R2.6482 Cc1cncc(c1)CSCc2cccc(c2)I 62a_100011218688_100000716715 [0,2,0,0,0,0|1,1,0]=4 31887 B18R2.6482 Cc1cncc(c1)CSCc2cccc(c2)O 62a_100000716715_100011660834 [0,2,0,0,0,0|1,1,0]=4 31888 B18R2.6482 Cc1cncc(c1)CSCc2cccc(c2)O 62a_100011660834_100000716715 [0,2,0,0,0,0|1,1,0]=4 31889 B18R2.6482 Cc1cnnc(c1)COCc2cccc(c2)Br 34a_100016212594_100000698116 [0,2,0,0,0,0|2,0,0]=4 31890 B18R2.6482 Cc1cnnc(c1)COCc2cccc(c2)Cl 34a_100016212594_100000187163 [0,2,0,0,0,0|2,0,0]=4 31891 B18R2.6482 Cc1cnnc(c1)COCc2cccc(c2)F 34a_100016212594_100000187166 [0,2,0,0,0,0|2,0,0]=4 31892 B18R2.6482 Cc1cnnc(c1)COCc2cccc(c2)I 34a_100016212594_100011218688 [0,2,0,0,0,0|2,0,0]=4 31893 B18R2.6482 Cc1cnnc(c1)COCc2cccc(c2)O 34a_100016212594_100011660834 [0,2,0,0,0,0|2,0,0]=4 31894 B18R2.6482 Clc1cc(ccn1)CNCc2cccc(c2)Br 2230a_100000174977_100000764220 [0,2,0,0,0,0|2,0,0]=4 31895 B18R2.6482 Clc1cc(ccn1)CNCc2cccc(c2)Br 2230a_100015205668_100000698116 [0,2,0,0,0,0|2,0,0]=4 31896 B18R2.6482 Clc1cc(ccn1)CNCc2cccc(c2)Br 26a_100015205668_100000210342 [0,2,0,0,0,0|2,0,0]=4 31897 B18R2.6482 Clc1cc(ccn1)CNCc2cccc(c2)Br 270004a_100000174977_100011290808 [0,2,0,0,0,0|2,0,0]=4 31898 B18R2.6482 Clc1cc(ccn1)CNCc2cccc(c2)Br 270004a_100015205668_100000210085 [0,2,0,0,0,0|2,0,0]=4 31899 B18R2.6482 Clc1cc(ccn1)CNCc2cccc(c2)Br 34a_100000174977_100000764220 [0,2,0,0,0,0|2,0,0]=4 31900 B18R2.6482 Clc1cc(ccn1)CNCc2cccc(c2)Br 34a_100015205668_100000698116 [0,2,0,0,0,0|2,0,0]=4 31901 B18R2.6482 Clc1cc(ccn1)CNCc2cccc(c2)I 2230a_100000106179_100000764220 [0,2,0,0,0,0|2,0,0]=4 31902 B18R2.6482 Clc1cc(ccn1)CNCc2cccc(c2)I 2230a_100015205668_100011218688 [0,2,0,0,0,0|2,0,0]=4 31903 B18R2.6482 Clc1cc(ccn1)CNCc2cccc(c2)I 270004a_100000106179_100011290808 [0,2,0,0,0,0|2,0,0]=4 31904 B18R2.6482 Clc1cc(ccn1)CNCc2cccc(c2)I 270004a_100015205668_100000014684 [0,2,0,0,0,0|2,0,0]=4 31905 B18R2.6482 Clc1cc(ccn1)CNCc2cccc(c2)I 34a_100000106179_100000764220 [0,2,0,0,0,0|2,0,0]=4 31906 B18R2.6482 Clc1cc(ccn1)CNCc2cccc(c2)I 34a_100015205668_100011218688 [0,2,0,0,0,0|2,0,0]=4 31907 B18R2.6482 Clc1cc(ccn1)COCc2cc(ccn2)Br 34a_100000748751_100010173614 [0,2,0,0,0,0|2,0,0]=4 31908 B18R2.6482 Clc1cc(ccn1)COCc2cccc(c2)Br 34a_100000687537_100000764220 [0,2,0,0,0,0|1,0,0]=3 31909 B18R2.6482 Clc1cc(ccn1)COCc2cccc(c2)Br 34a_100000748751_100000698116 [0,2,0,0,0,0|1,0,0]=3 31910 B18R2.6482 Clc1cc(ccn1)COCc2cccc(c2)Br 7a_100000687537_100000764220 [0,2,0,0,0,0|1,0,0]=3 31911 B18R2.6482 Clc1cc(ccn1)COCc2cccc(c2)I 34a_100000748751_100011218688 [0,2,0,0,0,0|1,0,0]=3 31912 B18R2.6482 Clc1cc(ccn1)COCc2cccc(c2)I 34a_100011215336_100000764220 [0,2,0,0,0,0|1,0,0]=3 31913 B18R2.6482 Clc1cc(ccn1)COCc2cccc(c2)I 7a_100011215336_100000764220 [0,2,0,0,0,0|1,0,0]=3 31914 B18R2.6482 Clc1cc(ccn1)COCc2cccc(n2)Br 34a_100000694195_100000764220 [0,2,0,0,0,0|2,0,0]=4 31915 B18R2.6482 Clc1cc(ccn1)COCc2cccc(n2)Br 34a_100000748751_100009889011 [0,2,0,0,0,0|2,0,0]=4 31916 B18R2.6482 Clc1cc(ccn1)COCc2cccc(n2)Cl 34a_100000748751_100000086093 [0,2,0,0,0,0|2,0,0]=4 31917 B18R2.6482 Clc1cc(ccn1)COCc2cccc(n2)Cl 34a_100011998359_100000764220 [0,2,0,0,0,0|2,0,0]=4 31918 B18R2.6482 Clc1cc(ccn1)COCc2ccnc(c2)Br 34a_100000748751_100010243470 [0,2,0,0,0,0|2,0,0]=4 31919 B18R2.6482 Clc1cc(ccn1)COCc2ccnc(c2)Br 34a_100009814636_100000764220 [0,2,0,0,0,0|2,0,0]=4 31920 B18R2.6482 Clc1cc(ccn1)COCc2ccnc(c2)Br 7a_100009814636_100000764220 [0,2,0,0,0,0|2,0,0]=4 31921 B18R2.6482 Clc1cc(ccn1)COCc2ccnc(c2)Cl 34a_100000748751_100000764220 [0,2,0,0,0,0|2,0,0]=4 31922 B18R2.6482 Clc1cc(ccn1)COCc2cncc(c2)Br 34a_100000748751_100000738771 [0,2,0,0,0,0|2,0,0]=4 31923 B18R2.6482 Clc1cc(ccn1)COCc2cncc(c2)Br 34a_100011259137_100000764220 [0,2,0,0,0,0|2,0,0]=4 31924 B18R2.6482 Clc1cc(ccn1)COCc2cncc(c2)Br 7a_100011259137_100000764220 [0,2,0,0,0,0|2,0,0]=4 31925 B18R2.6482 Clc1cc(ccn1)CSCc2cccc(c2)Br 62a_100000211773_100000764220 [0,2,0,0,0,0|1,1,0]=4 31926 B18R2.6482 Clc1cc(ccn1)CSCc2cccc(c2)Br 62a_100000764220_100000211773 [0,2,0,0,0,0|1,1,0]=4 31927 B18R2.6482 Clc1cc(ccn1)CSCc2cccc(c2)I 62a_100000764220_100011218688 [0,2,0,0,0,0|1,1,0]=4 31928 B18R2.6482 Clc1cc(ccn1)CSCc2cccc(c2)I 62a_100011218688_100000764220 [0,2,0,0,0,0|1,1,0]=4 31929 B18R2.6482 Clc1cccc(c1)CCNc2cccc(c2)Br 34a_100000210019_100011713710 [0,2,0,0,0,0|2,0,0]=4 31930 B18R2.6482 Clc1cccc(c1)CCNc2cccc(c2)Cl 34a_100000185859_100011713710 [0,2,0,0,0,0|2,0,0]=4 31931 B18R2.6482 Clc1cccc(c1)CCNc2cccc(c2)I 34a_100000211102_100011713710 [0,2,0,0,0,0|2,0,0]=4 31932 B18R2.6482 Clc1cccc(c1)CCOc2cccc(c2)Br 34a_100000210342_100011713710 [0,2,0,0,0,0|2,0,0]=4 31933 B18R2.6482 Clc1cccc(c1)CCOc2cccc(c2)Br 7a_100000210342_100011713710 [0,2,0,0,0,0|2,0,0]=4 31934 B18R2.6482 Clc1cccc(c1)CCOc2cccc(c2)Cl 34a_100000210295_100011713710 [0,2,0,0,0,0|2,0,0]=4 31935 B18R2.6482 Clc1cccc(c1)CCOc2cccc(c2)Cl 7a_100000210295_100011713710 [0,2,0,0,0,0|2,0,0]=4 31936 B18R2.6482 Clc1cccc(c1)CCOc2cccc(c2)I 34a_100000211634_100011713710 [0,2,0,0,0,0|2,0,0]=4 31937 B18R2.6482 Clc1cccc(c1)CCOc2cccc(c2)I 7a_100000211634_100011713710 [0,2,0,0,0,0|2,0,0]=4 31938 B18R2.6482 Clc1cccc(c1)CCSc2cccc(c2)Br 62a_100000691529_100011713710 [0,2,0,0,0,0|2,0,0]=4 31939 B18R2.6482 Clc1cccc(c1)CCSc2cccc(c2)Br 62a_100011713710_100000691529 [0,2,0,0,0,0|2,0,0]=4 31940 B18R2.6482 Clc1cccc(c1)CCSc2cccc(c2)Cl 62a_100000699651_100011713710 [0,2,0,0,0,0|2,0,0]=4 31941 B18R2.6482 Clc1cccc(c1)CCSc2cccc(c2)Cl 62a_100011713710_100000699651 [0,2,0,0,0,0|2,0,0]=4 31942 B18R2.6482 Clc1cccc(c1)CNCc2cc(ccn2)Br 2230a_100000174878_100010173614 [0,2,0,0,0,0|2,0,0]=4 31943 B18R2.6482 Clc1cccc(c1)CNCc2cc(ccn2)Br 270004a_100000174878_100009818557 [0,2,0,0,0,0|2,0,0]=4 31944 B18R2.6482 Clc1cccc(c1)CNCc2cc(ccn2)Br 34a_100000174878_100010173614 [0,2,0,0,0,0|2,0,0]=4 31945 B18R2.6482 Clc1cccc(c1)CNCc2cc(ccn2)Cl 2230a_100000174878_100016988179 [0,2,0,0,0,0|2,0,0]=4 31946 B18R2.6482 Clc1cccc(c1)CNCc2cc(ccn2)Cl 270004a_100000174878_100011998288 [0,2,0,0,0,0|2,0,0]=4 31947 B18R2.6482 Clc1cccc(c1)CNCc2cc(ccn2)Cl 34a_100000174878_100016988179 [0,2,0,0,0,0|2,0,0]=4 31948 B18R2.6482 Clc1cccc(c1)CNCc2cccc(c2)Br 207a_100000174878_100000210085 [0,2,0,0,0,0|1,0,0]=3 31949 B18R2.6482 Clc1cccc(c1)CNCc2cccc(c2)Br 207a_100000174977_100000210801 [0,2,0,0,0,0|1,0,0]=3 31950 B18R2.6482 Clc1cccc(c1)CNCc2cccc(c2)Br 2230a_100000174878_100000698116 [0,2,0,0,0,0|1,0,0]=3 31951 B18R2.6482 Clc1cccc(c1)CNCc2cccc(c2)Br 2230a_100000174977_100000181238 [0,2,0,0,0,0|1,0,0]=3 31952 B18R2.6482 Clc1cccc(c1)CNCc2cccc(c2)Br 26a_100000174878_100000210342 [0,2,0,0,0,0|1,0,0]=3 31953 B18R2.6482 Clc1cccc(c1)CNCc2cccc(c2)Br 270004a_100000174878_100000210085 [0,2,0,0,0,0|1,0,0]=3 31954 B18R2.6482 Clc1cccc(c1)CNCc2cccc(c2)Br 270004a_100000174977_100000210801 [0,2,0,0,0,0|1,0,0]=3 31955 B18R2.6482 Clc1cccc(c1)CNCc2cccc(c2)Br 34a_100000174878_100000698116 [0,2,0,0,0,0|1,0,0]=3 31956 B18R2.6482 Clc1cccc(c1)CNCc2cccc(c2)Br 34a_100000174977_100000187163 [0,2,0,0,0,0|1,0,0]=3 31957 B18R2.6482 Clc1cccc(c1)CNCc2cccc(c2)Cl 207a_100000174878_100000210801 [0,2,0,0,0,0|1,0,0]=3 31958 B18R2.6482 Clc1cccc(c1)CNCc2cccc(c2)Cl 2230a_100000174878_100000181238 [0,2,0,0,0,0|1,0,0]=3 31959 B18R2.6482 Clc1cccc(c1)CNCc2cccc(c2)Cl 270004a_100000174878_100000210801 [0,2,0,0,0,0|1,0,0]=3 31960 B18R2.6482 Clc1cccc(c1)CNCc2cccc(c2)Cl 34a_100000174878_100000187163 [0,2,0,0,0,0|1,0,0]=3 31961 B18R2.6482 Clc1cccc(c1)CNCc2cccc(c2)I 207a_100000106179_100000210801 [0,2,0,0,0,0|1,0,0]=3 31962 B18R2.6482 Clc1cccc(c1)CNCc2cccc(c2)I 207a_100000174878_100000014684 [0,2,0,0,0,0|1,0,0]=3 31963 B18R2.6482 Clc1cccc(c1)CNCc2cccc(c2)I 2230a_100000106179_100000181238 [0,2,0,0,0,0|1,0,0]=3 31964 B18R2.6482 Clc1cccc(c1)CNCc2cccc(c2)I 2230a_100000174878_100011218688 [0,2,0,0,0,0|1,0,0]=3 31965 B18R2.6482 Clc1cccc(c1)CNCc2cccc(c2)I 270004a_100000106179_100000210801 [0,2,0,0,0,0|1,0,0]=3 31966 B18R2.6482 Clc1cccc(c1)CNCc2cccc(c2)I 270004a_100000174878_100000014684 [0,2,0,0,0,0|1,0,0]=3 31967 B18R2.6482 Clc1cccc(c1)CNCc2cccc(c2)I 34a_100000106179_100000187163 [0,2,0,0,0,0|1,0,0]=3 31968 B18R2.6482 Clc1cccc(c1)CNCc2cccc(c2)I 34a_100000174878_100011218688 [0,2,0,0,0,0|1,0,0]=3 31969 B18R2.6482 Clc1cccc(c1)CNCc2cccc(n2)Br 2230a_100000174878_100009889011 [0,2,0,0,0,0|2,0,0]=4 31970 B18R2.6482 Clc1cccc(c1)CNCc2cccc(n2)Br 2230a_100016987751_100000181238 [0,2,0,0,0,0|2,0,0]=4 31971 B18R2.6482 Clc1cccc(c1)CNCc2cccc(n2)Br 270004a_100000174878_100000688028 [0,2,0,0,0,0|2,0,0]=4 31972 B18R2.6482 Clc1cccc(c1)CNCc2cccc(n2)Br 34a_100000174878_100009889011 [0,2,0,0,0,0|2,0,0]=4 31973 B18R2.6482 Clc1cccc(c1)CNCc2cccc(n2)Cl 2230a_100000174878_100000086093 [0,2,0,0,0,0|2,0,0]=4 31974 B18R2.6482 Clc1cccc(c1)CNCc2cccc(n2)Cl 2230a_100016990191_100000181238 [0,2,0,0,0,0|2,0,0]=4 31975 B18R2.6482 Clc1cccc(c1)CNCc2cccc(n2)Cl 270004a_100000174878_100011361687 [0,2,0,0,0,0|2,0,0]=4 31976 B18R2.6482 Clc1cccc(c1)CNCc2cccc(n2)Cl 34a_100000174878_100000086093 [0,2,0,0,0,0|2,0,0]=4 31977 B18R2.6482 Clc1cccc(c1)CNCc2ccnc(c2)Br 2230a_100000174878_100010243470 [0,2,0,0,0,0|2,0,0]=4 31978 B18R2.6482 Clc1cccc(c1)CNCc2ccnc(c2)Br 2230a_100025757509_100000181238 [0,2,0,0,0,0|2,0,0]=4 31979 B18R2.6482 Clc1cccc(c1)CNCc2ccnc(c2)Br 270004a_100000174878_100009814634 [0,2,0,0,0,0|2,0,0]=4 31980 B18R2.6482 Clc1cccc(c1)CNCc2ccnc(c2)Br 270004a_100025757509_100000210801 [0,2,0,0,0,0|2,0,0]=4 31981 B18R2.6482 Clc1cccc(c1)CNCc2ccnc(c2)Br 34a_100000174878_100010243470 [0,2,0,0,0,0|2,0,0]=4 31982 B18R2.6482 Clc1cccc(c1)CNCc2ccnc(c2)Br 34a_100025757509_100000187163 [0,2,0,0,0,0|2,0,0]=4 31983 B18R2.6482 Clc1cccc(c1)CNCc2ccnc(c2)Cl 2230a_100000174878_100000764220 [0,2,0,0,0,0|2,0,0]=4 31984 B18R2.6482 Clc1cccc(c1)CNCc2ccnc(c2)Cl 2230a_100015205668_100000181238 [0,2,0,0,0,0|2,0,0]=4 31985 B18R2.6482 Clc1cccc(c1)CNCc2ccnc(c2)Cl 270004a_100000174878_100011290808 [0,2,0,0,0,0|2,0,0]=4 31986 B18R2.6482 Clc1cccc(c1)CNCc2ccnc(c2)Cl 270004a_100015205668_100000210801 [0,2,0,0,0,0|2,0,0]=4 31987 B18R2.6482 Clc1cccc(c1)CNCc2ccnc(c2)Cl 34a_100000174878_100000764220 [0,2,0,0,0,0|2,0,0]=4 31988 B18R2.6482 Clc1cccc(c1)CNCc2ccnc(c2)Cl 34a_100015205668_100000187163 [0,2,0,0,0,0|2,0,0]=4 31989 B18R2.6482 Clc1cccc(c1)CNCc2cncc(c2)Br 207a_100000174878_100000687066 [0,2,0,0,0,0|2,0,0]=4 31990 B18R2.6482 Clc1cccc(c1)CNCc2cncc(c2)Br 207a_100011249555_100000210801 [0,2,0,0,0,0|2,0,0]=4 31991 B18R2.6482 Clc1cccc(c1)CNCc2cncc(c2)Br 2230a_100000174878_100000738771 [0,2,0,0,0,0|2,0,0]=4 31992 B18R2.6482 Clc1cccc(c1)CNCc2cncc(c2)Br 270004a_100000174878_100000687066 [0,2,0,0,0,0|2,0,0]=4 31993 B18R2.6482 Clc1cccc(c1)CNCc2cncc(c2)Br 270004a_100011249555_100000210801 [0,2,0,0,0,0|2,0,0]=4 31994 B18R2.6482 Clc1cccc(c1)CNCc2cncc(c2)Br 34a_100000174878_100000738771 [0,2,0,0,0,0|2,0,0]=4 31995 B18R2.6482 Clc1cccc(c1)CNCc2cncc(c2)Cl 207a_100000174878_100000088910 [0,2,0,0,0,0|2,0,0]=4 31996 B18R2.6482 Clc1cccc(c1)CNCc2cncc(c2)Cl 207a_200020614424_100000210801 [0,2,0,0,0,0|2,0,0]=4 31997 B18R2.6482 Clc1cccc(c1)CNCc2cncc(c2)Cl 2230a_100000174878_100016992070 [0,2,0,0,0,0|2,0,0]=4 31998 B18R2.6482 Clc1cccc(c1)CNCc2cncc(c2)Cl 2230a_200020614424_100000181238 [0,2,0,0,0,0|2,0,0]=4 31999 B18R2.6482 Clc1cccc(c1)CNCc2cncc(c2)Cl 270004a_100000174878_100000088910 [0,2,0,0,0,0|2,0,0]=4 32000 B18R2.6482 Clc1cccc(c1)CNCc2cncc(c2)Cl 270004a_200020614424_100000210801 [0,2,0,0,0,0|2,0,0]=4 32001 B18R2.6482 Clc1cccc(c1)CNCc2cncc(c2)Cl 34a_100000174878_100016992070 [0,2,0,0,0,0|2,0,0]=4 32002 B18R2.6482 Clc1cccc(c1)COCc2cc(ccn2)Br 34a_100000241301_100010173614 [0,2,0,0,0,0|1,0,0]=3 32003 B18R2.6482 Clc1cccc(c1)COCc2cc(ccn2)Br 7a_100000241301_100010173614 [0,2,0,0,0,0|1,0,0]=3 32004 B18R2.6482 Clc1cccc(c1)COCc2cc(ccn2)Cl 34a_100000241301_100016988179 [0,2,0,0,0,0|1,0,0]=3 32005 B18R2.6482 Clc1cccc(c1)COCc2cc(ccn2)Cl 34a_100000748867_100000187163 [0,2,0,0,0,0|1,0,0]=3 32006 B18R2.6482 Clc1cccc(c1)COCc2cc(ccn2)Cl 7a_100000241301_100016988179 [0,2,0,0,0,0|1,0,0]=3 32007 B18R2.6482 Clc1cccc(c1)COCc2cccc(c2)Br 34a_100000241301_100000698116 [0,2,0,0,0,0|0,0,0]=2 32008 B18R2.6482 Clc1cccc(c1)COCc2cccc(c2)Br 34a_100000687537_100000187163 [0,2,0,0,0,0|0,0,0]=2 32009 B18R2.6482 Clc1cccc(c1)COCc2cccc(c2)Br 7a_100000241301_100000211773 [0,2,0,0,0,0|0,0,0]=2 32010 B18R2.6482 Clc1cccc(c1)COCc2cccc(c2)Br 7a_100000687537_100000187163 [0,2,0,0,0,0|0,0,0]=2 32011 B18R2.6482 Clc1cccc(c1)COCc2cccc(c2)Cl 34a_100000241301_100000187163 [0,2,0,0,0,0|0,0,0]=2 32012 B18R2.6482 Clc1cccc(c1)COCc2cccc(c2)Cl 7a_100000241301_100000187163 [0,2,0,0,0,0|0,0,0]=2 32013 B18R2.6482 Clc1cccc(c1)COCc2cccc(c2)I 34a_100000241301_100011218688 [0,2,0,0,0,0|0,0,0]=2 32014 B18R2.6482 Clc1cccc(c1)COCc2cccc(c2)I 34a_100011215336_100000187163 [0,2,0,0,0,0|0,0,0]=2 32015 B18R2.6482 Clc1cccc(c1)COCc2cccc(c2)I 7a_100000241301_100011218688 [0,2,0,0,0,0|0,0,0]=2 32016 B18R2.6482 Clc1cccc(c1)COCc2cccc(c2)I 7a_100011215336_100000187163 [0,2,0,0,0,0|0,0,0]=2 32017 B18R2.6482 Clc1cccc(c1)COCc2cccc(n2)Br 34a_100000241301_100009889011 [0,2,0,0,0,0|1,0,0]=3 32018 B18R2.6482 Clc1cccc(c1)COCc2cccc(n2)Br 34a_100000694195_100000187163 [0,2,0,0,0,0|1,0,0]=3 32019 B18R2.6482 Clc1cccc(c1)COCc2cccc(n2)Br 7a_100000241301_100009889011 [0,2,0,0,0,0|1,0,0]=3 32020 B18R2.6482 Clc1cccc(c1)COCc2cccc(n2)Cl 34a_100000241301_100000086093 [0,2,0,0,0,0|1,0,0]=3 32021 B18R2.6482 Clc1cccc(c1)COCc2cccc(n2)Cl 34a_100011998359_100000187163 [0,2,0,0,0,0|1,0,0]=3 32022 B18R2.6482 Clc1cccc(c1)COCc2cccc(n2)Cl 7a_100000241301_100000086093 [0,2,0,0,0,0|1,0,0]=3 32023 B18R2.6482 Clc1cccc(c1)COCc2ccnc(c2)Br 34a_100000241301_100010243470 [0,2,0,0,0,0|1,0,0]=3 32024 B18R2.6482 Clc1cccc(c1)COCc2ccnc(c2)Br 34a_100009814636_100000187163 [0,2,0,0,0,0|1,0,0]=3 32025 B18R2.6482 Clc1cccc(c1)COCc2ccnc(c2)Br 7a_100000241301_100010254460 [0,2,0,0,0,0|1,0,0]=3 32026 B18R2.6482 Clc1cccc(c1)COCc2ccnc(c2)Br 7a_100009814636_100000187163 [0,2,0,0,0,0|1,0,0]=3 32027 B18R2.6482 Clc1cccc(c1)COCc2ccnc(c2)Cl 34a_100000241301_100000764220 [0,2,0,0,0,0|1,0,0]=3 32028 B18R2.6482 Clc1cccc(c1)COCc2ccnc(c2)Cl 34a_100000748751_100000187163 [0,2,0,0,0,0|1,0,0]=3 32029 B18R2.6482 Clc1cccc(c1)COCc2ccnc(c2)Cl 7a_100000241301_100000764220 [0,2,0,0,0,0|1,0,0]=3 32030 B18R2.6482 Clc1cccc(c1)COCc2ccnc(n2)Cl 34a_100000241301_100000099655 [0,2,0,0,0,0|2,0,0]=4 32031 B18R2.6482 Clc1cccc(c1)COCc2ccnc(n2)Cl 7a_100000241301_100000099655 [0,2,0,0,0,0|2,0,0]=4 32032 B18R2.6482 Clc1cccc(c1)COCc2cncc(c2)Br 34a_100000241301_100000738771 [0,2,0,0,0,0|1,0,0]=3 32033 B18R2.6482 Clc1cccc(c1)COCc2cncc(c2)Br 34a_100011259137_100000187163 [0,2,0,0,0,0|1,0,0]=3 32034 B18R2.6482 Clc1cccc(c1)COCc2cncc(c2)Br 7a_100000241301_100000738771 [0,2,0,0,0,0|1,0,0]=3 32035 B18R2.6482 Clc1cccc(c1)COCc2cncc(c2)Br 7a_100011259137_100000187163 [0,2,0,0,0,0|1,0,0]=3 32036 B18R2.6482 Clc1cccc(c1)COCc2cncc(c2)Cl 34a_100000092867_100000187163 [0,2,0,0,0,0|1,0,0]=3 32037 B18R2.6482 Clc1cccc(c1)COCc2cncc(c2)Cl 34a_100000241301_100016992070 [0,2,0,0,0,0|1,0,0]=3 32038 B18R2.6482 Clc1cccc(c1)COCc2cncc(c2)Cl 7a_100000092867_100000187163 [0,2,0,0,0,0|1,0,0]=3 32039 B18R2.6482 Clc1cccc(c1)COCc2cncc(c2)Cl 7a_100000241301_100016992070 [0,2,0,0,0,0|1,0,0]=3 32040 B18R2.6482 Clc1cccc(c1)CSCc2cc(ccn2)Br 62a_100000187163_100010173614 [0,2,0,0,0,0|1,1,0]=4 32041 B18R2.6482 Clc1cccc(c1)CSCc2cc(ccn2)Br 62a_100010173614_100000187163 [0,2,0,0,0,0|1,1,0]=4 32042 B18R2.6482 Clc1cccc(c1)CSCc2cc(ccn2)Cl 62a_100000187163_100016988179 [0,2,0,0,0,0|1,1,0]=4 32043 B18R2.6482 Clc1cccc(c1)CSCc2cc(ccn2)Cl 62a_100016988179_100000187163 [0,2,0,0,0,0|1,1,0]=4 32044 B18R2.6482 Clc1cccc(c1)CSCc2cccc(c2)Br 62a_100000187163_100000211773 [0,2,0,0,0,0|0,1,0]=3 32045 B18R2.6482 Clc1cccc(c1)CSCc2cccc(c2)Br 62a_100000211773_100000187163 [0,2,0,0,0,0|0,1,0]=3 32046 B18R2.6482 Clc1cccc(c1)CSCc2cccc(c2)Cl 62a_100000187163_100000187163 [0,2,0,0,0,0|0,1,0]=3 32047 B18R2.6482 Clc1cccc(c1)CSCc2cccc(c2)I 62a_100000187163_100011218688 [0,2,0,0,0,0|0,1,0]=3 32048 B18R2.6482 Clc1cccc(c1)CSCc2cccc(c2)I 62a_100011218688_100000187163 [0,2,0,0,0,0|0,1,0]=3 32049 B18R2.6482 Clc1cccc(c1)CSCc2cccc(n2)Br 62a_100000187163_100009889011 [0,2,0,0,0,0|1,1,0]=4 32050 B18R2.6482 Clc1cccc(c1)CSCc2cccc(n2)Br 62a_100009889011_100000187163 [0,2,0,0,0,0|1,1,0]=4 32051 B18R2.6482 Clc1cccc(c1)CSCc2cccc(n2)Cl 62a_100000086093_100000187163 [0,2,0,0,0,0|1,1,0]=4 32052 B18R2.6482 Clc1cccc(c1)CSCc2cccc(n2)Cl 62a_100000187163_100000086093 [0,2,0,0,0,0|1,1,0]=4 32053 B18R2.6482 Clc1cccc(c1)CSCc2ccnc(c2)Br 62a_100000187163_100010243470 [0,2,0,0,0,0|1,1,0]=4 32054 B18R2.6482 Clc1cccc(c1)CSCc2ccnc(c2)Br 62a_100010254460_100000187163 [0,2,0,0,0,0|1,1,0]=4 32055 B18R2.6482 Clc1cccc(c1)CSCc2ccnc(c2)Cl 62a_100000187163_100000764220 [0,2,0,0,0,0|1,1,0]=4 32056 B18R2.6482 Clc1cccc(c1)CSCc2ccnc(c2)Cl 62a_100000764220_100000187163 [0,2,0,0,0,0|1,1,0]=4 32057 B18R2.6482 Clc1cccc(c1)CSCc2cncc(c2)Br 62a_100000187163_100000738771 [0,2,0,0,0,0|1,1,0]=4 32058 B18R2.6482 Clc1cccc(c1)CSCc2cncc(c2)Br 62a_100000738771_100000187163 [0,2,0,0,0,0|1,1,0]=4 32059 B18R2.6482 Clc1cccc(c1)CSCc2cncc(c2)Cl 62a_100000187163_100016992070 [0,2,0,0,0,0|1,1,0]=4 32060 B18R2.6482 Clc1cccc(c1)CSCc2cncc(c2)Cl 62a_100016992070_100000187163 [0,2,0,0,0,0|1,1,0]=4 32061 B18R2.6482 Clc1cccc(c1)NCCc2cccc(c2)Br 34a_100000185859_100011740638 [0,2,0,0,0,0|2,0,0]=4 32062 B18R2.6482 Clc1cccc(c1)OCCc2cccc(c2)Br 34a_100000210295_100011740638 [0,2,0,0,0,0|2,0,0]=4 32063 B18R2.6482 Clc1cccc(c1)OCCc2cccc(c2)Br 7a_100000210295_100011740638 [0,2,0,0,0,0|2,0,0]=4 32064 B18R2.6482 Clc1cccc(c1)SCCc2cccc(c2)Br 62a_100000699651_100011740638 [0,2,0,0,0,0|2,0,0]=4 32065 B18R2.6482 Clc1cccc(c1)SCCc2cccc(c2)Br 62a_100011740638_100000699651 [0,2,0,0,0,0|2,0,0]=4 32066 B18R2.6482 Clc1cccc(n1)CNCc2cccc(c2)Br 2230a_100000174977_100000086093 [0,2,0,0,0,0|2,0,0]=4 32067 B18R2.6482 Clc1cccc(n1)CNCc2cccc(c2)Br 2230a_100016990191_100000698116 [0,2,0,0,0,0|2,0,0]=4 32068 B18R2.6482 Clc1cccc(n1)CNCc2cccc(c2)Br 270004a_100000174977_100011361687 [0,2,0,0,0,0|2,0,0]=4 32069 B18R2.6482 Clc1cccc(n1)CNCc2cccc(c2)Br 34a_100000174977_100000086093 [0,2,0,0,0,0|2,0,0]=4 32070 B18R2.6482 Clc1cccc(n1)CNCc2cccc(c2)I 2230a_100000106179_100000086093 [0,2,0,0,0,0|2,0,0]=4 32071 B18R2.6482 Clc1cccc(n1)CNCc2cccc(c2)I 2230a_100016990191_100011218688 [0,2,0,0,0,0|2,0,0]=4 32072 B18R2.6482 Clc1cccc(n1)CNCc2cccc(c2)I 270004a_100000106179_100011361687 [0,2,0,0,0,0|2,0,0]=4 32073 B18R2.6482 Clc1cccc(n1)CNCc2cccc(c2)I 34a_100000106179_100000086093 [0,2,0,0,0,0|2,0,0]=4 32074 B18R2.6482 Clc1cccc(n1)COCc2cc(ccn2)Br 34a_100011998359_100010173614 [0,2,0,0,0,0|2,0,0]=4 32075 B18R2.6482 Clc1cccc(n1)COCc2cccc(c2)Br 34a_100000687537_100000086093 [0,2,0,0,0,0|1,0,0]=3 32076 B18R2.6482 Clc1cccc(n1)COCc2cccc(c2)Br 34a_100011998359_100000698116 [0,2,0,0,0,0|1,0,0]=3 32077 B18R2.6482 Clc1cccc(n1)COCc2cccc(c2)Br 7a_100000687537_100000086093 [0,2,0,0,0,0|1,0,0]=3 32078 B18R2.6482 Clc1cccc(n1)COCc2cccc(c2)I 34a_100011215336_100000086093 [0,2,0,0,0,0|1,0,0]=3 32079 B18R2.6482 Clc1cccc(n1)COCc2cccc(c2)I 34a_100011998359_100011218688 [0,2,0,0,0,0|1,0,0]=3 32080 B18R2.6482 Clc1cccc(n1)COCc2cccc(c2)I 7a_100011215336_100000086093 [0,2,0,0,0,0|1,0,0]=3 32081 B18R2.6482 Clc1cccc(n1)COCc2cccc(n2)Br 34a_100000694195_100000086093 [0,2,0,0,0,0|2,0,0]=4 32082 B18R2.6482 Clc1cccc(n1)COCc2cccc(n2)Br 34a_100011998359_100009889011 [0,2,0,0,0,0|2,0,0]=4 32083 B18R2.6482 Clc1cccc(n1)COCc2cccc(n2)Cl 34a_100011998359_100000086093 [0,2,0,0,0,0|2,0,0]=4 32084 B18R2.6482 Clc1cccc(n1)COCc2ccnc(c2)Br 34a_100009814636_100000086093 [0,2,0,0,0,0|2,0,0]=4 32085 B18R2.6482 Clc1cccc(n1)COCc2ccnc(c2)Br 34a_100011998359_100010243470 [0,2,0,0,0,0|2,0,0]=4 32086 B18R2.6482 Clc1cccc(n1)COCc2ccnc(c2)Br 7a_100009814636_100000086093 [0,2,0,0,0,0|2,0,0]=4 32087 B18R2.6482 Clc1cccc(n1)COCc2cncc(c2)Br 34a_100011259137_100000086093 [0,2,0,0,0,0|2,0,0]=4 32088 B18R2.6482 Clc1cccc(n1)COCc2cncc(c2)Br 34a_100011998359_100000738771 [0,2,0,0,0,0|2,0,0]=4 32089 B18R2.6482 Clc1cccc(n1)COCc2cncc(c2)Br 7a_100011259137_100000086093 [0,2,0,0,0,0|2,0,0]=4 32090 B18R2.6482 Clc1cccc(n1)CSCc2cccc(c2)Br 62a_100000086093_100000211773 [0,2,0,0,0,0|1,1,0]=4 32091 B18R2.6482 Clc1cccc(n1)CSCc2cccc(c2)Br 62a_100000211773_100000086093 [0,2,0,0,0,0|1,1,0]=4 32092 B18R2.6482 Clc1cccc(n1)CSCc2cccc(c2)I 62a_100000086093_100011218688 [0,2,0,0,0,0|1,1,0]=4 32093 B18R2.6482 Clc1cccc(n1)CSCc2cccc(c2)I 62a_100011218688_100000086093 [0,2,0,0,0,0|1,1,0]=4 32094 B18R2.6482 Clc1ccnc(c1)CNCc2cccc(c2)Br 2230a_100000174977_100016988179 [0,2,0,0,0,0|2,0,0]=4 32095 B18R2.6482 Clc1ccnc(c1)CNCc2cccc(c2)Br 270004a_100000174977_100011998288 [0,2,0,0,0,0|2,0,0]=4 32096 B18R2.6482 Clc1ccnc(c1)CNCc2cccc(c2)Br 34a_100000174977_100016988179 [0,2,0,0,0,0|2,0,0]=4 32097 B18R2.6482 Clc1ccnc(c1)CNCc2cccc(c2)I 2230a_100000106179_100016988179 [0,2,0,0,0,0|2,0,0]=4 32098 B18R2.6482 Clc1ccnc(c1)CNCc2cccc(c2)I 270004a_100000106179_100011998288 [0,2,0,0,0,0|2,0,0]=4 32099 B18R2.6482 Clc1ccnc(c1)CNCc2cccc(c2)I 34a_100000106179_100016988179 [0,2,0,0,0,0|2,0,0]=4 32100 B18R2.6482 Clc1ccnc(c1)COCc2cc(ccn2)Br 34a_100000748867_100010173614 [0,2,0,0,0,0|2,0,0]=4 32101 B18R2.6482 Clc1ccnc(c1)COCc2cc(ccn2)Cl 34a_100000748867_100016988179 [0,2,0,0,0,0|2,0,0]=4 32102 B18R2.6482 Clc1ccnc(c1)COCc2cccc(c2)Br 34a_100000687537_100016988179 [0,2,0,0,0,0|1,0,0]=3 32103 B18R2.6482 Clc1ccnc(c1)COCc2cccc(c2)Br 34a_100000748867_100000698116 [0,2,0,0,0,0|1,0,0]=3 32104 B18R2.6482 Clc1ccnc(c1)COCc2cccc(c2)Br 7a_100000687537_100016988179 [0,2,0,0,0,0|1,0,0]=3 32105 B18R2.6482 Clc1ccnc(c1)COCc2cccc(c2)I 34a_100000748867_100011218688 [0,2,0,0,0,0|1,0,0]=3 32106 B18R2.6482 Clc1ccnc(c1)COCc2cccc(c2)I 34a_100011215336_100016988179 [0,2,0,0,0,0|1,0,0]=3 32107 B18R2.6482 Clc1ccnc(c1)COCc2cccc(c2)I 7a_100011215336_100016988179 [0,2,0,0,0,0|1,0,0]=3 32108 B18R2.6482 Clc1ccnc(c1)COCc2cccc(n2)Br 34a_100000694195_100016988179 [0,2,0,0,0,0|2,0,0]=4 32109 B18R2.6482 Clc1ccnc(c1)COCc2cccc(n2)Br 34a_100000748867_100009889011 [0,2,0,0,0,0|2,0,0]=4 32110 B18R2.6482 Clc1ccnc(c1)COCc2cccc(n2)Cl 34a_100000748867_100000086093 [0,2,0,0,0,0|2,0,0]=4 32111 B18R2.6482 Clc1ccnc(c1)COCc2cccc(n2)Cl 34a_100011998359_100016988179 [0,2,0,0,0,0|2,0,0]=4 32112 B18R2.6482 Clc1ccnc(c1)COCc2ccnc(c2)Br 34a_100000748867_100010243470 [0,2,0,0,0,0|2,0,0]=4 32113 B18R2.6482 Clc1ccnc(c1)COCc2ccnc(c2)Br 34a_100009814636_100016988179 [0,2,0,0,0,0|2,0,0]=4 32114 B18R2.6482 Clc1ccnc(c1)COCc2ccnc(c2)Br 7a_100009814636_100016988179 [0,2,0,0,0,0|2,0,0]=4 32115 B18R2.6482 Clc1ccnc(c1)COCc2ccnc(c2)Cl 34a_100000748751_100016988179 [0,2,0,0,0,0|2,0,0]=4 32116 B18R2.6482 Clc1ccnc(c1)COCc2ccnc(c2)Cl 34a_100000748867_100000764220 [0,2,0,0,0,0|2,0,0]=4 32117 B18R2.6482 Clc1ccnc(c1)COCc2cncc(c2)Br 34a_100000748867_100000738771 [0,2,0,0,0,0|2,0,0]=4 32118 B18R2.6482 Clc1ccnc(c1)COCc2cncc(c2)Br 34a_100011259137_100016988179 [0,2,0,0,0,0|2,0,0]=4 32119 B18R2.6482 Clc1ccnc(c1)COCc2cncc(c2)Br 7a_100011259137_100016988179 [0,2,0,0,0,0|2,0,0]=4 32120 B18R2.6482 Clc1ccnc(c1)CSCc2cccc(c2)Br 62a_100000211773_100016988179 [0,2,0,0,0,0|1,1,0]=4 32121 B18R2.6482 Clc1ccnc(c1)CSCc2cccc(c2)Br 62a_100016988179_100000211773 [0,2,0,0,0,0|1,1,0]=4 32122 B18R2.6482 Clc1ccnc(c1)CSCc2cccc(c2)I 62a_100011218688_100016988179 [0,2,0,0,0,0|1,1,0]=4 32123 B18R2.6482 Clc1ccnc(c1)CSCc2cccc(c2)I 62a_100016988179_100011218688 [0,2,0,0,0,0|1,1,0]=4 32124 B18R2.6482 Clc1cncc(c1)CNCc2cccc(c2)Br 207a_100000174977_100000088910 [0,2,0,0,0,0|2,0,0]=4 32125 B18R2.6482 Clc1cncc(c1)CNCc2cccc(c2)Br 207a_200020614424_100000210085 [0,2,0,0,0,0|2,0,0]=4 32126 B18R2.6482 Clc1cncc(c1)CNCc2cccc(c2)Br 2230a_100000174977_100016992070 [0,2,0,0,0,0|2,0,0]=4 32127 B18R2.6482 Clc1cncc(c1)CNCc2cccc(c2)Br 2230a_200020614424_100000698116 [0,2,0,0,0,0|2,0,0]=4 32128 B18R2.6482 Clc1cncc(c1)CNCc2cccc(c2)Br 270004a_100000174977_100000088910 [0,2,0,0,0,0|2,0,0]=4 32129 B18R2.6482 Clc1cncc(c1)CNCc2cccc(c2)Br 270004a_200020614424_100000210085 [0,2,0,0,0,0|2,0,0]=4 32130 B18R2.6482 Clc1cncc(c1)CNCc2cccc(c2)Br 34a_100000174977_100016992070 [0,2,0,0,0,0|2,0,0]=4 32131 B18R2.6482 Clc1cncc(c1)CNCc2cccc(c2)I 207a_100000106179_100000088910 [0,2,0,0,0,0|2,0,0]=4 32132 B18R2.6482 Clc1cncc(c1)CNCc2cccc(c2)I 207a_200020614424_100000014684 [0,2,0,0,0,0|2,0,0]=4 32133 B18R2.6482 Clc1cncc(c1)CNCc2cccc(c2)I 2230a_100000106179_100016992070 [0,2,0,0,0,0|2,0,0]=4 32134 B18R2.6482 Clc1cncc(c1)CNCc2cccc(c2)I 2230a_200020614424_100011218688 [0,2,0,0,0,0|2,0,0]=4 32135 B18R2.6482 Clc1cncc(c1)CNCc2cccc(c2)I 270004a_100000106179_100000088910 [0,2,0,0,0,0|2,0,0]=4 32136 B18R2.6482 Clc1cncc(c1)CNCc2cccc(c2)I 270004a_200020614424_100000014684 [0,2,0,0,0,0|2,0,0]=4 32137 B18R2.6482 Clc1cncc(c1)CNCc2cccc(c2)I 34a_100000106179_100016992070 [0,2,0,0,0,0|2,0,0]=4 32138 B18R2.6482 Clc1cncc(c1)COCc2cc(ccn2)Br 34a_100000092867_100010173614 [0,2,0,0,0,0|2,0,0]=4 32139 B18R2.6482 Clc1cncc(c1)COCc2cc(ccn2)Br 7a_100000092867_100010173614 [0,2,0,0,0,0|2,0,0]=4 32140 B18R2.6482 Clc1cncc(c1)COCc2cc(ccn2)Cl 34a_100000092867_100016988179 [0,2,0,0,0,0|2,0,0]=4 32141 B18R2.6482 Clc1cncc(c1)COCc2cc(ccn2)Cl 34a_100000748867_100016992070 [0,2,0,0,0,0|2,0,0]=4 32142 B18R2.6482 Clc1cncc(c1)COCc2cc(ccn2)Cl 7a_100000092867_100016988179 [0,2,0,0,0,0|2,0,0]=4 32143 B18R2.6482 Clc1cncc(c1)COCc2cccc(c2)Br 34a_100000092867_100000698116 [0,2,0,0,0,0|1,0,0]=3 32144 B18R2.6482 Clc1cncc(c1)COCc2cccc(c2)Br 34a_100000687537_100016992070 [0,2,0,0,0,0|1,0,0]=3 32145 B18R2.6482 Clc1cncc(c1)COCc2cccc(c2)Br 7a_100000092867_100000211773 [0,2,0,0,0,0|1,0,0]=3 32146 B18R2.6482 Clc1cncc(c1)COCc2cccc(c2)Br 7a_100000687537_100016992070 [0,2,0,0,0,0|1,0,0]=3 32147 B18R2.6482 Clc1cncc(c1)COCc2cccc(c2)I 34a_100000092867_100011218688 [0,2,0,0,0,0|1,0,0]=3 32148 B18R2.6482 Clc1cncc(c1)COCc2cccc(c2)I 34a_100011215336_100016992070 [0,2,0,0,0,0|1,0,0]=3 32149 B18R2.6482 Clc1cncc(c1)COCc2cccc(c2)I 7a_100000092867_100011218688 [0,2,0,0,0,0|1,0,0]=3 32150 B18R2.6482 Clc1cncc(c1)COCc2cccc(c2)I 7a_100011215336_100016992070 [0,2,0,0,0,0|1,0,0]=3 32151 B18R2.6482 Clc1cncc(c1)COCc2cccc(n2)Br 34a_100000092867_100009889011 [0,2,0,0,0,0|2,0,0]=4 32152 B18R2.6482 Clc1cncc(c1)COCc2cccc(n2)Br 34a_100000694195_100016992070 [0,2,0,0,0,0|2,0,0]=4 32153 B18R2.6482 Clc1cncc(c1)COCc2cccc(n2)Br 7a_100000092867_100009889011 [0,2,0,0,0,0|2,0,0]=4 32154 B18R2.6482 Clc1cncc(c1)COCc2cccc(n2)Cl 34a_100000092867_100000086093 [0,2,0,0,0,0|2,0,0]=4 32155 B18R2.6482 Clc1cncc(c1)COCc2cccc(n2)Cl 34a_100011998359_100016992070 [0,2,0,0,0,0|2,0,0]=4 32156 B18R2.6482 Clc1cncc(c1)COCc2cccc(n2)Cl 7a_100000092867_100000086093 [0,2,0,0,0,0|2,0,0]=4 32157 B18R2.6482 Clc1cncc(c1)COCc2ccnc(c2)Br 34a_100000092867_100010243470 [0,2,0,0,0,0|2,0,0]=4 32158 B18R2.6482 Clc1cncc(c1)COCc2ccnc(c2)Br 34a_100009814636_100016992070 [0,2,0,0,0,0|2,0,0]=4 32159 B18R2.6482 Clc1cncc(c1)COCc2ccnc(c2)Br 7a_100000092867_100010254460 [0,2,0,0,0,0|2,0,0]=4 32160 B18R2.6482 Clc1cncc(c1)COCc2ccnc(c2)Br 7a_100009814636_100016992070 [0,2,0,0,0,0|2,0,0]=4 32161 B18R2.6482 Clc1cncc(c1)COCc2ccnc(c2)Cl 34a_100000092867_100000764220 [0,2,0,0,0,0|2,0,0]=4 32162 B18R2.6482 Clc1cncc(c1)COCc2ccnc(c2)Cl 34a_100000748751_100016992070 [0,2,0,0,0,0|2,0,0]=4 32163 B18R2.6482 Clc1cncc(c1)COCc2ccnc(c2)Cl 7a_100000092867_100000764220 [0,2,0,0,0,0|2,0,0]=4 32164 B18R2.6482 Clc1cncc(c1)COCc2cncc(c2)Br 34a_100000092867_100000738771 [0,2,0,0,0,0|2,0,0]=4 32165 B18R2.6482 Clc1cncc(c1)COCc2cncc(c2)Br 34a_100011259137_100016992070 [0,2,0,0,0,0|2,0,0]=4 32166 B18R2.6482 Clc1cncc(c1)COCc2cncc(c2)Br 7a_100000092867_100000738771 [0,2,0,0,0,0|2,0,0]=4 32167 B18R2.6482 Clc1cncc(c1)COCc2cncc(c2)Br 7a_100011259137_100016992070 [0,2,0,0,0,0|2,0,0]=4 32168 B18R2.6482 Clc1cncc(c1)COCc2cncc(c2)Cl 34a_100000092867_100016992070 [0,2,0,0,0,0|2,0,0]=4 32169 B18R2.6482 Clc1cncc(c1)COCc2cncc(c2)Cl 7a_100000092867_100016992070 [0,2,0,0,0,0|2,0,0]=4 32170 B18R2.6482 Clc1cncc(c1)CSCc2cccc(c2)Br 62a_100000211773_100016992070 [0,2,0,0,0,0|1,1,0]=4 32171 B18R2.6482 Clc1cncc(c1)CSCc2cccc(c2)Br 62a_100016992070_100000211773 [0,2,0,0,0,0|1,1,0]=4 32172 B18R2.6482 Clc1cncc(c1)CSCc2cccc(c2)I 62a_100011218688_100016992070 [0,2,0,0,0,0|1,1,0]=4 32173 B18R2.6482 Clc1cncc(c1)CSCc2cccc(c2)I 62a_100016992070_100011218688 [0,2,0,0,0,0|1,1,0]=4 32174 B18R2.6482 Clc1nccc(n1)COCc2cccc(c2)Br 34a_100000687537_100000099655 [0,2,0,0,0,0|2,0,0]=4 32175 B18R2.6482 Clc1nccc(n1)COCc2cccc(c2)Br 7a_100000687537_100000099655 [0,2,0,0,0,0|2,0,0]=4 32176 B18R2.6482 Clc1nccc(n1)COCc2cccc(c2)I 34a_100011215336_100000099655 [0,2,0,0,0,0|2,0,0]=4 32177 B18R2.6482 Clc1nccc(n1)COCc2cccc(c2)I 7a_100011215336_100000099655 [0,2,0,0,0,0|2,0,0]=4 32178 B18R2.6482 Fc1cc(ccn1)CNCc2cccc(c2)Br 2230a_100015188774_100000698116 [0,2,0,0,0,0|2,0,0]=4 32179 B18R2.6482 Fc1cc(ccn1)CNCc2cccc(c2)Br 270004a_100000174977_100000068331 [0,2,0,0,0,0|2,0,0]=4 32180 B18R2.6482 Fc1cc(ccn1)CNCc2cccc(c2)Br 270004a_100015188774_100000210085 [0,2,0,0,0,0|2,0,0]=4 32181 B18R2.6482 Fc1cc(ccn1)CNCc2cccc(c2)Br 34a_100015188774_100000698116 [0,2,0,0,0,0|2,0,0]=4 32182 B18R2.6482 Fc1cc(ccn1)CNCc2cccc(c2)Cl 2230a_100015188774_100000181238 [0,2,0,0,0,0|2,0,0]=4 32183 B18R2.6482 Fc1cc(ccn1)CNCc2cccc(c2)Cl 270004a_100000174878_100000068331 [0,2,0,0,0,0|2,0,0]=4 32184 B18R2.6482 Fc1cc(ccn1)CNCc2cccc(c2)Cl 270004a_100015188774_100000210801 [0,2,0,0,0,0|2,0,0]=4 32185 B18R2.6482 Fc1cc(ccn1)CNCc2cccc(c2)Cl 34a_100015188774_100000187163 [0,2,0,0,0,0|2,0,0]=4 32186 B18R2.6482 Fc1cc(ccn1)CNCc2cccc(c2)I 2230a_100015188774_100011218688 [0,2,0,0,0,0|2,0,0]=4 32187 B18R2.6482 Fc1cc(ccn1)CNCc2cccc(c2)I 270004a_100000106179_100000068331 [0,2,0,0,0,0|2,0,0]=4 32188 B18R2.6482 Fc1cc(ccn1)CNCc2cccc(c2)I 270004a_100015188774_100000014684 [0,2,0,0,0,0|2,0,0]=4 32189 B18R2.6482 Fc1cc(ccn1)CNCc2cccc(c2)I 34a_100015188774_100011218688 [0,2,0,0,0,0|2,0,0]=4 32190 B18R2.6482 Fc1cc(ccn1)COCc2cc(ccn2)Br 34a_100000082451_100010173614 [0,2,0,0,0,0|2,0,0]=4 32191 B18R2.6482 Fc1cc(ccn1)COCc2cc(ccn2)Cl 34a_100000082451_100016988179 [0,2,0,0,0,0|2,0,0]=4 32192 B18R2.6482 Fc1cc(ccn1)COCc2cccc(c2)Br 34a_100000082451_100000698116 [0,2,0,0,0,0|1,0,0]=3 32193 B18R2.6482 Fc1cc(ccn1)COCc2cccc(c2)Cl 34a_100000082451_100000187163 [0,2,0,0,0,0|1,0,0]=3 32194 B18R2.6482 Fc1cc(ccn1)COCc2cccc(c2)I 34a_100000082451_100011218688 [0,2,0,0,0,0|1,0,0]=3 32195 B18R2.6482 Fc1cc(ccn1)COCc2cccc(n2)Br 34a_100000082451_100009889011 [0,2,0,0,0,0|2,0,0]=4 32196 B18R2.6482 Fc1cc(ccn1)COCc2cccc(n2)Cl 34a_100000082451_100000086093 [0,2,0,0,0,0|2,0,0]=4 32197 B18R2.6482 Fc1cc(ccn1)COCc2cccc(n2)F 34a_100000082451_100009819644 [0,2,0,0,0,0|2,0,0]=4 32198 B18R2.6482 Fc1cc(ccn1)COCc2ccnc(c2)Br 34a_100000082451_100010243470 [0,2,0,0,0,0|2,0,0]=4 32199 B18R2.6482 Fc1cc(ccn1)COCc2ccnc(c2)Cl 34a_100000082451_100000764220 [0,2,0,0,0,0|2,0,0]=4 32200 B18R2.6482 Fc1cc(ccn1)COCc2cncc(c2)Br 34a_100000082451_100000738771 [0,2,0,0,0,0|2,0,0]=4 32201 B18R2.6482 Fc1cc(ccn1)COCc2cncc(c2)Cl 34a_100000082451_100016992070 [0,2,0,0,0,0|2,0,0]=4 32202 B18R2.6482 Fc1cccc(c1)CCNc2cccc(c2)Br 34a_100000210019_100011217235 [0,2,0,0,0,0|2,0,0]=4 32203 B18R2.6482 Fc1cccc(c1)CCNc2cccc(c2)Cl 34a_100000185859_100011217235 [0,2,0,0,0,0|2,0,0]=4 32204 B18R2.6482 Fc1cccc(c1)CCNc2cccc(c2)F 34a_100000210047_100011217235 [0,2,0,0,0,0|2,0,0]=4 32205 B18R2.6482 Fc1cccc(c1)CCNc2cccc(c2)I 34a_100000211102_100011217235 [0,2,0,0,0,0|2,0,0]=4 32206 B18R2.6482 Fc1cccc(c1)CCOc2cccc(c2)Br 34a_100000210342_100011217235 [0,2,0,0,0,0|2,0,0]=4 32207 B18R2.6482 Fc1cccc(c1)CCOc2cccc(c2)Br 7a_100000210342_100011217235 [0,2,0,0,0,0|2,0,0]=4 32208 B18R2.6482 Fc1cccc(c1)CCOc2cccc(c2)Cl 34a_100000210295_100011217235 [0,2,0,0,0,0|2,0,0]=4 32209 B18R2.6482 Fc1cccc(c1)CCOc2cccc(c2)Cl 7a_100000210295_100011217235 [0,2,0,0,0,0|2,0,0]=4 32210 B18R2.6482 Fc1cccc(c1)CCOc2cccc(c2)F 34a_100000210426_100011217235 [0,2,0,0,0,0|2,0,0]=4 32211 B18R2.6482 Fc1cccc(c1)CCOc2cccc(c2)F 7a_100000210426_100011217235 [0,2,0,0,0,0|2,0,0]=4 32212 B18R2.6482 Fc1cccc(c1)CCOc2cccc(c2)I 34a_100000211634_100011217235 [0,2,0,0,0,0|2,0,0]=4 32213 B18R2.6482 Fc1cccc(c1)CCOc2cccc(c2)I 7a_100000211634_100011217235 [0,2,0,0,0,0|2,0,0]=4 32214 B18R2.6482 Fc1cccc(c1)CCSc2cccc(c2)Br 62a_100000691529_100011217235 [0,2,0,0,0,0|2,0,0]=4 32215 B18R2.6482 Fc1cccc(c1)CCSc2cccc(c2)Br 62a_100011217235_100000691529 [0,2,0,0,0,0|2,0,0]=4 32216 B18R2.6482 Fc1cccc(c1)CCSc2cccc(c2)Cl 62a_100000699651_100011217235 [0,2,0,0,0,0|2,0,0]=4 32217 B18R2.6482 Fc1cccc(c1)CCSc2cccc(c2)Cl 62a_100011217235_100000699651 [0,2,0,0,0,0|2,0,0]=4 32218 B18R2.6482 Fc1cccc(c1)CCSc2cccc(c2)F 62a_100000685547_100011217235 [0,2,0,0,0,0|2,0,0]=4 32219 B18R2.6482 Fc1cccc(c1)CCSc2cccc(c2)F 62a_100011217235_100000685547 [0,2,0,0,0,0|2,0,0]=4 32220 B18R2.6482 Fc1cccc(c1)CCSc2cccc(c2)[S] 62a_100011217235_114929384022 [0,2,0,0,0,0|2,0,0]=4 32221 B18R2.6482 Fc1cccc(c1)CCSc2cccc(c2)[S] 62a_114929384022_100011217235 [0,2,0,0,0,0|2,0,0]=4 32222 B18R2.6482 Fc1cccc(c1)CNCc2cc(ccn2)Br 2230a_100000174948_100010173614 [0,2,0,0,0,0|2,0,0]=4 32223 B18R2.6482 Fc1cccc(c1)CNCc2cc(ccn2)Br 270004a_100000174948_100009818557 [0,2,0,0,0,0|2,0,0]=4 32224 B18R2.6482 Fc1cccc(c1)CNCc2cc(ccn2)Br 34a_100000174948_100010173614 [0,2,0,0,0,0|2,0,0]=4 32225 B18R2.6482 Fc1cccc(c1)CNCc2cc(ccn2)Cl 2230a_100000174948_100016988179 [0,2,0,0,0,0|2,0,0]=4 32226 B18R2.6482 Fc1cccc(c1)CNCc2cc(ccn2)Cl 270004a_100000174948_100011998288 [0,2,0,0,0,0|2,0,0]=4 32227 B18R2.6482 Fc1cccc(c1)CNCc2cc(ccn2)Cl 34a_100000174948_100016988179 [0,2,0,0,0,0|2,0,0]=4 32228 B18R2.6482 Fc1cccc(c1)CNCc2cccc(c2)Br 207a_100000174948_100000210085 [0,2,0,0,0,0|1,0,0]=3 32229 B18R2.6482 Fc1cccc(c1)CNCc2cccc(c2)Br 207a_100000174977_100000210812 [0,2,0,0,0,0|1,0,0]=3 32230 B18R2.6482 Fc1cccc(c1)CNCc2cccc(c2)Br 2230a_100000174948_100000698116 [0,2,0,0,0,0|1,0,0]=3 32231 B18R2.6482 Fc1cccc(c1)CNCc2cccc(c2)Br 2230a_100000174977_100000230114 [0,2,0,0,0,0|1,0,0]=3 32232 B18R2.6482 Fc1cccc(c1)CNCc2cccc(c2)Br 270004a_100000174948_100000210085 [0,2,0,0,0,0|1,0,0]=3 32233 B18R2.6482 Fc1cccc(c1)CNCc2cccc(c2)Br 270004a_100000174977_100000210812 [0,2,0,0,0,0|1,0,0]=3 32234 B18R2.6482 Fc1cccc(c1)CNCc2cccc(c2)Br 34a_100000174948_100000698116 [0,2,0,0,0,0|1,0,0]=3 32235 B18R2.6482 Fc1cccc(c1)CNCc2cccc(c2)Br 34a_100000174977_100000187166 [0,2,0,0,0,0|1,0,0]=3 32236 B18R2.6482 Fc1cccc(c1)CNCc2cccc(c2)Cl 207a_100000174878_100000210812 [0,2,0,0,0,0|1,0,0]=3 32237 B18R2.6482 Fc1cccc(c1)CNCc2cccc(c2)Cl 207a_100000174948_100000210801 [0,2,0,0,0,0|1,0,0]=3 32238 B18R2.6482 Fc1cccc(c1)CNCc2cccc(c2)Cl 2230a_100000174878_100000230114 [0,2,0,0,0,0|1,0,0]=3 32239 B18R2.6482 Fc1cccc(c1)CNCc2cccc(c2)Cl 2230a_100000174948_100000181238 [0,2,0,0,0,0|1,0,0]=3 32240 B18R2.6482 Fc1cccc(c1)CNCc2cccc(c2)Cl 270004a_100000174878_100000210812 [0,2,0,0,0,0|1,0,0]=3 32241 B18R2.6482 Fc1cccc(c1)CNCc2cccc(c2)Cl 270004a_100000174948_100000210801 [0,2,0,0,0,0|1,0,0]=3 32242 B18R2.6482 Fc1cccc(c1)CNCc2cccc(c2)Cl 34a_100000174878_100000187166 [0,2,0,0,0,0|1,0,0]=3 32243 B18R2.6482 Fc1cccc(c1)CNCc2cccc(c2)Cl 34a_100000174948_100000187163 [0,2,0,0,0,0|1,0,0]=3 32244 B18R2.6482 Fc1cccc(c1)CNCc2cccc(c2)F 207a_100000174948_100000210812 [0,2,0,0,0,0|1,0,0]=3 32245 B18R2.6482 Fc1cccc(c1)CNCc2cccc(c2)F 2230a_100000174948_100000230114 [0,2,0,0,0,0|1,0,0]=3 32246 B18R2.6482 Fc1cccc(c1)CNCc2cccc(c2)F 270004a_100000174948_100000210812 [0,2,0,0,0,0|1,0,0]=3 32247 B18R2.6482 Fc1cccc(c1)CNCc2cccc(c2)F 34a_100000174948_100000187166 [0,2,0,0,0,0|1,0,0]=3 32248 B18R2.6482 Fc1cccc(c1)CNCc2cccc(c2)I 207a_100000106179_100000210812 [0,2,0,0,0,0|1,0,0]=3 32249 B18R2.6482 Fc1cccc(c1)CNCc2cccc(c2)I 207a_100000174948_100000014684 [0,2,0,0,0,0|1,0,0]=3 32250 B18R2.6482 Fc1cccc(c1)CNCc2cccc(c2)I 2230a_100000106179_100000230114 [0,2,0,0,0,0|1,0,0]=3 32251 B18R2.6482 Fc1cccc(c1)CNCc2cccc(c2)I 2230a_100000174948_100011218688 [0,2,0,0,0,0|1,0,0]=3 32252 B18R2.6482 Fc1cccc(c1)CNCc2cccc(c2)I 270004a_100000106179_100000210812 [0,2,0,0,0,0|1,0,0]=3 32253 B18R2.6482 Fc1cccc(c1)CNCc2cccc(c2)I 270004a_100000174948_100000014684 [0,2,0,0,0,0|1,0,0]=3 32254 B18R2.6482 Fc1cccc(c1)CNCc2cccc(c2)I 34a_100000106179_100000187166 [0,2,0,0,0,0|1,0,0]=3 32255 B18R2.6482 Fc1cccc(c1)CNCc2cccc(c2)I 34a_100000174948_100011218688 [0,2,0,0,0,0|1,0,0]=3 32256 B18R2.6482 Fc1cccc(c1)CNCc2cccc(n2)Br 2230a_100000174948_100009889011 [0,2,0,0,0,0|2,0,0]=4 32257 B18R2.6482 Fc1cccc(c1)CNCc2cccc(n2)Br 2230a_100016987751_100000230114 [0,2,0,0,0,0|2,0,0]=4 32258 B18R2.6482 Fc1cccc(c1)CNCc2cccc(n2)Br 270004a_100000174948_100000688028 [0,2,0,0,0,0|2,0,0]=4 32259 B18R2.6482 Fc1cccc(c1)CNCc2cccc(n2)Br 34a_100000174948_100009889011 [0,2,0,0,0,0|2,0,0]=4 32260 B18R2.6482 Fc1cccc(c1)CNCc2cccc(n2)Cl 2230a_100000174948_100000086093 [0,2,0,0,0,0|2,0,0]=4 32261 B18R2.6482 Fc1cccc(c1)CNCc2cccc(n2)Cl 2230a_100016990191_100000230114 [0,2,0,0,0,0|2,0,0]=4 32262 B18R2.6482 Fc1cccc(c1)CNCc2cccc(n2)Cl 270004a_100000174948_100011361687 [0,2,0,0,0,0|2,0,0]=4 32263 B18R2.6482 Fc1cccc(c1)CNCc2cccc(n2)Cl 34a_100000174948_100000086093 [0,2,0,0,0,0|2,0,0]=4 32264 B18R2.6482 Fc1cccc(c1)CNCc2cccc(n2)F 2230a_100000174948_100009819644 [0,2,0,0,0,0|2,0,0]=4 32265 B18R2.6482 Fc1cccc(c1)CNCc2cccc(n2)F 2230a_100015188798_100000230114 [0,2,0,0,0,0|2,0,0]=4 32266 B18R2.6482 Fc1cccc(c1)CNCc2cccc(n2)F 270004a_100000174948_100000050434 [0,2,0,0,0,0|2,0,0]=4 32267 B18R2.6482 Fc1cccc(c1)CNCc2cccc(n2)F 34a_100000174948_100009819644 [0,2,0,0,0,0|2,0,0]=4 32268 B18R2.6482 Fc1cccc(c1)CNCc2cccc(n2)F 34a_100015188798_100000187166 [0,2,0,0,0,0|2,0,0]=4 32269 B18R2.6482 Fc1cccc(c1)CNCc2ccnc(c2)Br 2230a_100000174948_100010243470 [0,2,0,0,0,0|2,0,0]=4 32270 B18R2.6482 Fc1cccc(c1)CNCc2ccnc(c2)Br 2230a_100025757509_100000230114 [0,2,0,0,0,0|2,0,0]=4 32271 B18R2.6482 Fc1cccc(c1)CNCc2ccnc(c2)Br 270004a_100000174948_100009814634 [0,2,0,0,0,0|2,0,0]=4 32272 B18R2.6482 Fc1cccc(c1)CNCc2ccnc(c2)Br 270004a_100025757509_100000210812 [0,2,0,0,0,0|2,0,0]=4 32273 B18R2.6482 Fc1cccc(c1)CNCc2ccnc(c2)Br 34a_100000174948_100010243470 [0,2,0,0,0,0|2,0,0]=4 32274 B18R2.6482 Fc1cccc(c1)CNCc2ccnc(c2)Br 34a_100025757509_100000187166 [0,2,0,0,0,0|2,0,0]=4 32275 B18R2.6482 Fc1cccc(c1)CNCc2ccnc(c2)Cl 2230a_100000174948_100000764220 [0,2,0,0,0,0|2,0,0]=4 32276 B18R2.6482 Fc1cccc(c1)CNCc2ccnc(c2)Cl 2230a_100015205668_100000230114 [0,2,0,0,0,0|2,0,0]=4 32277 B18R2.6482 Fc1cccc(c1)CNCc2ccnc(c2)Cl 270004a_100000174948_100011290808 [0,2,0,0,0,0|2,0,0]=4 32278 B18R2.6482 Fc1cccc(c1)CNCc2ccnc(c2)Cl 270004a_100015205668_100000210812 [0,2,0,0,0,0|2,0,0]=4 32279 B18R2.6482 Fc1cccc(c1)CNCc2ccnc(c2)Cl 34a_100000174948_100000764220 [0,2,0,0,0,0|2,0,0]=4 32280 B18R2.6482 Fc1cccc(c1)CNCc2ccnc(c2)Cl 34a_100015205668_100000187166 [0,2,0,0,0,0|2,0,0]=4 32281 B18R2.6482 Fc1cccc(c1)CNCc2ccnc(c2)F 2230a_100015188774_100000230114 [0,2,0,0,0,0|2,0,0]=4 32282 B18R2.6482 Fc1cccc(c1)CNCc2ccnc(c2)F 270004a_100000174948_100000068331 [0,2,0,0,0,0|2,0,0]=4 32283 B18R2.6482 Fc1cccc(c1)CNCc2ccnc(c2)F 270004a_100015188774_100000210812 [0,2,0,0,0,0|2,0,0]=4 32284 B18R2.6482 Fc1cccc(c1)CNCc2ccnc(c2)F 34a_100015188774_100000187166 [0,2,0,0,0,0|2,0,0]=4 32285 B18R2.6482 Fc1cccc(c1)CNCc2cncc(c2)Br 207a_100000174948_100000687066 [0,2,0,0,0,0|2,0,0]=4 32286 B18R2.6482 Fc1cccc(c1)CNCc2cncc(c2)Br 207a_100011249555_100000210812 [0,2,0,0,0,0|2,0,0]=4 32287 B18R2.6482 Fc1cccc(c1)CNCc2cncc(c2)Br 2230a_100000174948_100000738771 [0,2,0,0,0,0|2,0,0]=4 32288 B18R2.6482 Fc1cccc(c1)CNCc2cncc(c2)Br 270004a_100000174948_100000687066 [0,2,0,0,0,0|2,0,0]=4 32289 B18R2.6482 Fc1cccc(c1)CNCc2cncc(c2)Br 270004a_100011249555_100000210812 [0,2,0,0,0,0|2,0,0]=4 32290 B18R2.6482 Fc1cccc(c1)CNCc2cncc(c2)Br 34a_100000174948_100000738771 [0,2,0,0,0,0|2,0,0]=4 32291 B18R2.6482 Fc1cccc(c1)CNCc2cncc(c2)Cl 207a_100000174948_100000088910 [0,2,0,0,0,0|2,0,0]=4 32292 B18R2.6482 Fc1cccc(c1)CNCc2cncc(c2)Cl 207a_200020614424_100000210812 [0,2,0,0,0,0|2,0,0]=4 32293 B18R2.6482 Fc1cccc(c1)CNCc2cncc(c2)Cl 2230a_100000174948_100016992070 [0,2,0,0,0,0|2,0,0]=4 32294 B18R2.6482 Fc1cccc(c1)CNCc2cncc(c2)Cl 2230a_200020614424_100000230114 [0,2,0,0,0,0|2,0,0]=4 32295 B18R2.6482 Fc1cccc(c1)CNCc2cncc(c2)Cl 270004a_100000174948_100000088910 [0,2,0,0,0,0|2,0,0]=4 32296 B18R2.6482 Fc1cccc(c1)CNCc2cncc(c2)Cl 270004a_200020614424_100000210812 [0,2,0,0,0,0|2,0,0]=4 32297 B18R2.6482 Fc1cccc(c1)CNCc2cncc(c2)Cl 34a_100000174948_100016992070 [0,2,0,0,0,0|2,0,0]=4 32298 B18R2.6482 Fc1cccc(c1)CNCc2cncc(c2)F 207a_100000174948_100011361476 [0,2,0,0,0,0|2,0,0]=4 32299 B18R2.6482 Fc1cccc(c1)CNCc2cncc(c2)F 207a_100011962886_100000210812 [0,2,0,0,0,0|2,0,0]=4 32300 B18R2.6482 Fc1cccc(c1)CNCc2cncc(c2)F 2230a_100000174948_100000725299 [0,2,0,0,0,0|2,0,0]=4 32301 B18R2.6482 Fc1cccc(c1)CNCc2cncc(c2)F 2230a_100011962886_100000230114 [0,2,0,0,0,0|2,0,0]=4 32302 B18R2.6482 Fc1cccc(c1)CNCc2cncc(c2)F 270004a_100000174948_100011361476 [0,2,0,0,0,0|2,0,0]=4 32303 B18R2.6482 Fc1cccc(c1)CNCc2cncc(c2)F 270004a_100011962886_100000210812 [0,2,0,0,0,0|2,0,0]=4 32304 B18R2.6482 Fc1cccc(c1)CNCc2cncc(c2)F 34a_100000174948_100000725299 [0,2,0,0,0,0|2,0,0]=4 32305 B18R2.6482 Fc1cccc(c1)CNCc2cncc(c2)F 34a_100011962886_100000187166 [0,2,0,0,0,0|2,0,0]=4 32306 B18R2.6482 Fc1cccc(c1)COCc2cc(ccn2)Br 34a_100000210976_100010173614 [0,2,0,0,0,0|1,0,0]=3 32307 B18R2.6482 Fc1cccc(c1)COCc2cc(ccn2)Br 7a_100000210976_100010173614 [0,2,0,0,0,0|1,0,0]=3 32308 B18R2.6482 Fc1cccc(c1)COCc2cc(ccn2)Cl 34a_100000210976_100016988179 [0,2,0,0,0,0|1,0,0]=3 32309 B18R2.6482 Fc1cccc(c1)COCc2cc(ccn2)Cl 34a_100000748867_100000187166 [0,2,0,0,0,0|1,0,0]=3 32310 B18R2.6482 Fc1cccc(c1)COCc2cc(ccn2)Cl 7a_100000210976_100016988179 [0,2,0,0,0,0|1,0,0]=3 32311 B18R2.6482 Fc1cccc(c1)COCc2cccc(c2)Br 34a_100000210976_100000698116 [0,2,0,0,0,0|0,0,0]=2 32312 B18R2.6482 Fc1cccc(c1)COCc2cccc(c2)Br 34a_100000687537_100000187166 [0,2,0,0,0,0|0,0,0]=2 32313 B18R2.6482 Fc1cccc(c1)COCc2cccc(c2)Br 7a_100000210976_100000211773 [0,2,0,0,0,0|0,0,0]=2 32314 B18R2.6482 Fc1cccc(c1)COCc2cccc(c2)Br 7a_100000687537_100000230114 [0,2,0,0,0,0|0,0,0]=2 32315 B18R2.6482 Fc1cccc(c1)COCc2cccc(c2)Cl 34a_100000210976_100000187163 [0,2,0,0,0,0|0,0,0]=2 32316 B18R2.6482 Fc1cccc(c1)COCc2cccc(c2)Cl 34a_100000241301_100000187166 [0,2,0,0,0,0|0,0,0]=2 32317 B18R2.6482 Fc1cccc(c1)COCc2cccc(c2)Cl 7a_100000210976_100000187163 [0,2,0,0,0,0|0,0,0]=2 32318 B18R2.6482 Fc1cccc(c1)COCc2cccc(c2)Cl 7a_100000241301_100000230114 [0,2,0,0,0,0|0,0,0]=2 32319 B18R2.6482 Fc1cccc(c1)COCc2cccc(c2)F 34a_100000210976_100000187166 [0,2,0,0,0,0|0,0,0]=2 32320 B18R2.6482 Fc1cccc(c1)COCc2cccc(c2)F 7a_100000210976_100000230114 [0,2,0,0,0,0|0,0,0]=2 32321 B18R2.6482 Fc1cccc(c1)COCc2cccc(c2)I 34a_100000210976_100011218688 [0,2,0,0,0,0|0,0,0]=2 32322 B18R2.6482 Fc1cccc(c1)COCc2cccc(c2)I 34a_100011215336_100000187166 [0,2,0,0,0,0|0,0,0]=2 32323 B18R2.6482 Fc1cccc(c1)COCc2cccc(c2)I 7a_100000210976_100011218688 [0,2,0,0,0,0|0,0,0]=2 32324 B18R2.6482 Fc1cccc(c1)COCc2cccc(c2)I 7a_100011215336_100000230114 [0,2,0,0,0,0|0,0,0]=2 32325 B18R2.6482 Fc1cccc(c1)COCc2cccc(n2)Br 34a_100000210976_100009889011 [0,2,0,0,0,0|1,0,0]=3 32326 B18R2.6482 Fc1cccc(c1)COCc2cccc(n2)Br 34a_100000694195_100000187166 [0,2,0,0,0,0|1,0,0]=3 32327 B18R2.6482 Fc1cccc(c1)COCc2cccc(n2)Br 7a_100000210976_100009889011 [0,2,0,0,0,0|1,0,0]=3 32328 B18R2.6482 Fc1cccc(c1)COCc2cccc(n2)Cl 34a_100000210976_100000086093 [0,2,0,0,0,0|1,0,0]=3 32329 B18R2.6482 Fc1cccc(c1)COCc2cccc(n2)Cl 34a_100011998359_100000187166 [0,2,0,0,0,0|1,0,0]=3 32330 B18R2.6482 Fc1cccc(c1)COCc2cccc(n2)Cl 7a_100000210976_100000086093 [0,2,0,0,0,0|1,0,0]=3 32331 B18R2.6482 Fc1cccc(c1)COCc2cccc(n2)F 34a_100000086748_100000187166 [0,2,0,0,0,0|1,0,0]=3 32332 B18R2.6482 Fc1cccc(c1)COCc2cccc(n2)F 34a_100000210976_100009819644 [0,2,0,0,0,0|1,0,0]=3 32333 B18R2.6482 Fc1cccc(c1)COCc2cccc(n2)F 7a_100000210976_100009819644 [0,2,0,0,0,0|1,0,0]=3 32334 B18R2.6482 Fc1cccc(c1)COCc2ccnc(c2)Br 34a_100000210976_100010243470 [0,2,0,0,0,0|1,0,0]=3 32335 B18R2.6482 Fc1cccc(c1)COCc2ccnc(c2)Br 34a_100009814636_100000187166 [0,2,0,0,0,0|1,0,0]=3 32336 B18R2.6482 Fc1cccc(c1)COCc2ccnc(c2)Br 7a_100000210976_100010254460 [0,2,0,0,0,0|1,0,0]=3 32337 B18R2.6482 Fc1cccc(c1)COCc2ccnc(c2)Br 7a_100009814636_100000230114 [0,2,0,0,0,0|1,0,0]=3 32338 B18R2.6482 Fc1cccc(c1)COCc2ccnc(c2)Cl 34a_100000210976_100000764220 [0,2,0,0,0,0|1,0,0]=3 32339 B18R2.6482 Fc1cccc(c1)COCc2ccnc(c2)Cl 34a_100000748751_100000187166 [0,2,0,0,0,0|1,0,0]=3 32340 B18R2.6482 Fc1cccc(c1)COCc2ccnc(c2)Cl 7a_100000210976_100000764220 [0,2,0,0,0,0|1,0,0]=3 32341 B18R2.6482 Fc1cccc(c1)COCc2ccnc(c2)F 34a_100000082451_100000187166 [0,2,0,0,0,0|1,0,0]=3 32342 B18R2.6482 Fc1cccc(c1)COCc2ccnc(n2)Cl 34a_100000210976_100000099655 [0,2,0,0,0,0|2,0,0]=4 32343 B18R2.6482 Fc1cccc(c1)COCc2ccnc(n2)Cl 7a_100000210976_100000099655 [0,2,0,0,0,0|2,0,0]=4 32344 B18R2.6482 Fc1cccc(c1)COCc2cncc(c2)Br 34a_100000210976_100000738771 [0,2,0,0,0,0|1,0,0]=3 32345 B18R2.6482 Fc1cccc(c1)COCc2cncc(c2)Br 34a_100011259137_100000187166 [0,2,0,0,0,0|1,0,0]=3 32346 B18R2.6482 Fc1cccc(c1)COCc2cncc(c2)Br 7a_100000210976_100000738771 [0,2,0,0,0,0|1,0,0]=3 32347 B18R2.6482 Fc1cccc(c1)COCc2cncc(c2)Br 7a_100011259137_100000230114 [0,2,0,0,0,0|1,0,0]=3 32348 B18R2.6482 Fc1cccc(c1)COCc2cncc(c2)Cl 34a_100000092867_100000187166 [0,2,0,0,0,0|1,0,0]=3 32349 B18R2.6482 Fc1cccc(c1)COCc2cncc(c2)Cl 34a_100000210976_100016992070 [0,2,0,0,0,0|1,0,0]=3 32350 B18R2.6482 Fc1cccc(c1)COCc2cncc(c2)Cl 7a_100000092867_100000230114 [0,2,0,0,0,0|1,0,0]=3 32351 B18R2.6482 Fc1cccc(c1)COCc2cncc(c2)Cl 7a_100000210976_100016992070 [0,2,0,0,0,0|1,0,0]=3 32352 B18R2.6482 Fc1cccc(c1)COCc2cncc(c2)F 34a_100000210976_100000725299 [0,2,0,0,0,0|1,0,0]=3 32353 B18R2.6482 Fc1cccc(c1)COCc2cncc(c2)F 34a_100011962875_100000187166 [0,2,0,0,0,0|1,0,0]=3 32354 B18R2.6482 Fc1cccc(c1)COCc2cncc(c2)F 7a_100000210976_100000725299 [0,2,0,0,0,0|1,0,0]=3 32355 B18R2.6482 Fc1cccc(c1)COCc2cncc(c2)F 7a_100011962875_100000230114 [0,2,0,0,0,0|1,0,0]=3 32356 B18R2.6482 Fc1cccc(c1)CSCc2cc(ccn2)Br 62a_100000230114_100010173614 [0,2,0,0,0,0|1,1,0]=4 32357 B18R2.6482 Fc1cccc(c1)CSCc2cc(ccn2)Br 62a_100010173614_100000230114 [0,2,0,0,0,0|1,1,0]=4 32358 B18R2.6482 Fc1cccc(c1)CSCc2cc(ccn2)Cl 62a_100000230114_100016988179 [0,2,0,0,0,0|1,1,0]=4 32359 B18R2.6482 Fc1cccc(c1)CSCc2cc(ccn2)Cl 62a_100016988179_100000230114 [0,2,0,0,0,0|1,1,0]=4 32360 B18R2.6482 Fc1cccc(c1)CSCc2cccc(c2)Br 62a_100000211773_100000230114 [0,2,0,0,0,0|0,1,0]=3 32361 B18R2.6482 Fc1cccc(c1)CSCc2cccc(c2)Br 62a_100000230114_100000211773 [0,2,0,0,0,0|0,1,0]=3 32362 B18R2.6482 Fc1cccc(c1)CSCc2cccc(c2)Cl 62a_100000187163_100000230114 [0,2,0,0,0,0|0,1,0]=3 32363 B18R2.6482 Fc1cccc(c1)CSCc2cccc(c2)Cl 62a_100000230114_100000187163 [0,2,0,0,0,0|0,1,0]=3 32364 B18R2.6482 Fc1cccc(c1)CSCc2cccc(c2)F 62a_100000230114_100000230114 [0,2,0,0,0,0|0,1,0]=3 32365 B18R2.6482 Fc1cccc(c1)CSCc2cccc(c2)I 62a_100000230114_100011218688 [0,2,0,0,0,0|0,1,0]=3 32366 B18R2.6482 Fc1cccc(c1)CSCc2cccc(c2)I 62a_100011218688_100000230114 [0,2,0,0,0,0|0,1,0]=3 32367 B18R2.6482 Fc1cccc(c1)CSCc2cccc(n2)Br 62a_100000230114_100009889011 [0,2,0,0,0,0|1,1,0]=4 32368 B18R2.6482 Fc1cccc(c1)CSCc2cccc(n2)Br 62a_100009889011_100000230114 [0,2,0,0,0,0|1,1,0]=4 32369 B18R2.6482 Fc1cccc(c1)CSCc2cccc(n2)Cl 62a_100000086093_100000230114 [0,2,0,0,0,0|1,1,0]=4 32370 B18R2.6482 Fc1cccc(c1)CSCc2cccc(n2)Cl 62a_100000230114_100000086093 [0,2,0,0,0,0|1,1,0]=4 32371 B18R2.6482 Fc1cccc(c1)CSCc2cccc(n2)F 62a_100000230114_100009819644 [0,2,0,0,0,0|1,1,0]=4 32372 B18R2.6482 Fc1cccc(c1)CSCc2cccc(n2)F 62a_100009819644_100000230114 [0,2,0,0,0,0|1,1,0]=4 32373 B18R2.6482 Fc1cccc(c1)CSCc2ccnc(c2)Br 62a_100000230114_100010243470 [0,2,0,0,0,0|1,1,0]=4 32374 B18R2.6482 Fc1cccc(c1)CSCc2ccnc(c2)Br 62a_100010254460_100000230114 [0,2,0,0,0,0|1,1,0]=4 32375 B18R2.6482 Fc1cccc(c1)CSCc2ccnc(c2)Cl 62a_100000230114_100000764220 [0,2,0,0,0,0|1,1,0]=4 32376 B18R2.6482 Fc1cccc(c1)CSCc2ccnc(c2)Cl 62a_100000764220_100000230114 [0,2,0,0,0,0|1,1,0]=4 32377 B18R2.6482 Fc1cccc(c1)CSCc2cncc(c2)Br 62a_100000230114_100000738771 [0,2,0,0,0,0|1,1,0]=4 32378 B18R2.6482 Fc1cccc(c1)CSCc2cncc(c2)Br 62a_100000738771_100000230114 [0,2,0,0,0,0|1,1,0]=4 32379 B18R2.6482 Fc1cccc(c1)CSCc2cncc(c2)Cl 62a_100000230114_100016992070 [0,2,0,0,0,0|1,1,0]=4 32380 B18R2.6482 Fc1cccc(c1)CSCc2cncc(c2)Cl 62a_100016992070_100000230114 [0,2,0,0,0,0|1,1,0]=4 32381 B18R2.6482 Fc1cccc(c1)CSCc2cncc(c2)F 62a_100000230114_100000725299 [0,2,0,0,0,0|1,1,0]=4 32382 B18R2.6482 Fc1cccc(c1)CSCc2cncc(c2)F 62a_100000725299_100000230114 [0,2,0,0,0,0|1,1,0]=4 32383 B18R2.6482 Fc1cccc(c1)NCCc2cccc(c2)Br 34a_100000210047_100011740638 [0,2,0,0,0,0|2,0,0]=4 32384 B18R2.6482 Fc1cccc(c1)NCCc2cccc(c2)Cl 34a_100000210047_100011713710 [0,2,0,0,0,0|2,0,0]=4 32385 B18R2.6482 Fc1cccc(c1)OCCc2cccc(c2)Br 34a_100000210426_100011740638 [0,2,0,0,0,0|2,0,0]=4 32386 B18R2.6482 Fc1cccc(c1)OCCc2cccc(c2)Br 7a_100000210426_100011740638 [0,2,0,0,0,0|2,0,0]=4 32387 B18R2.6482 Fc1cccc(c1)OCCc2cccc(c2)Cl 34a_100000210426_100011713710 [0,2,0,0,0,0|2,0,0]=4 32388 B18R2.6482 Fc1cccc(c1)OCCc2cccc(c2)Cl 7a_100000210426_100011713710 [0,2,0,0,0,0|2,0,0]=4 32389 B18R2.6482 Fc1cccc(c1)SCCc2cccc(c2)Br 62a_100000685547_100011740638 [0,2,0,0,0,0|2,0,0]=4 32390 B18R2.6482 Fc1cccc(c1)SCCc2cccc(c2)Br 62a_100011740638_100000685547 [0,2,0,0,0,0|2,0,0]=4 32391 B18R2.6482 Fc1cccc(c1)SCCc2cccc(c2)Cl 62a_100000685547_100011713710 [0,2,0,0,0,0|2,0,0]=4 32392 B18R2.6482 Fc1cccc(c1)SCCc2cccc(c2)Cl 62a_100011713710_100000685547 [0,2,0,0,0,0|2,0,0]=4 32393 B18R2.6482 Fc1cccc(n1)CNCc2cccc(c2)Br 2230a_100000174977_100009819644 [0,2,0,0,0,0|2,0,0]=4 32394 B18R2.6482 Fc1cccc(n1)CNCc2cccc(c2)Br 2230a_100015188798_100000698116 [0,2,0,0,0,0|2,0,0]=4 32395 B18R2.6482 Fc1cccc(n1)CNCc2cccc(c2)Br 270004a_100000174977_100000050434 [0,2,0,0,0,0|2,0,0]=4 32396 B18R2.6482 Fc1cccc(n1)CNCc2cccc(c2)Br 34a_100000174977_100009819644 [0,2,0,0,0,0|2,0,0]=4 32397 B18R2.6482 Fc1cccc(n1)CNCc2cccc(c2)Br 34a_100015188798_100000698116 [0,2,0,0,0,0|2,0,0]=4 32398 B18R2.6482 Fc1cccc(n1)CNCc2cccc(c2)Cl 2230a_100000174878_100009819644 [0,2,0,0,0,0|2,0,0]=4 32399 B18R2.6482 Fc1cccc(n1)CNCc2cccc(c2)Cl 2230a_100015188798_100000181238 [0,2,0,0,0,0|2,0,0]=4 32400 B18R2.6482 Fc1cccc(n1)CNCc2cccc(c2)Cl 270004a_100000174878_100000050434 [0,2,0,0,0,0|2,0,0]=4 32401 B18R2.6482 Fc1cccc(n1)CNCc2cccc(c2)Cl 34a_100000174878_100009819644 [0,2,0,0,0,0|2,0,0]=4 32402 B18R2.6482 Fc1cccc(n1)CNCc2cccc(c2)Cl 34a_100015188798_100000187163 [0,2,0,0,0,0|2,0,0]=4 32403 B18R2.6482 Fc1cccc(n1)CNCc2cccc(c2)I 2230a_100000106179_100009819644 [0,2,0,0,0,0|2,0,0]=4 32404 B18R2.6482 Fc1cccc(n1)CNCc2cccc(c2)I 2230a_100015188798_100011218688 [0,2,0,0,0,0|2,0,0]=4 32405 B18R2.6482 Fc1cccc(n1)CNCc2cccc(c2)I 270004a_100000106179_100000050434 [0,2,0,0,0,0|2,0,0]=4 32406 B18R2.6482 Fc1cccc(n1)CNCc2cccc(c2)I 34a_100000106179_100009819644 [0,2,0,0,0,0|2,0,0]=4 32407 B18R2.6482 Fc1cccc(n1)CNCc2cccc(c2)I 34a_100015188798_100011218688 [0,2,0,0,0,0|2,0,0]=4 32408 B18R2.6482 Fc1cccc(n1)COCc2cc(ccn2)Br 34a_100000086748_100010173614 [0,2,0,0,0,0|2,0,0]=4 32409 B18R2.6482 Fc1cccc(n1)COCc2cc(ccn2)Cl 34a_100000086748_100016988179 [0,2,0,0,0,0|2,0,0]=4 32410 B18R2.6482 Fc1cccc(n1)COCc2cc(ccn2)Cl 34a_100000748867_100009819644 [0,2,0,0,0,0|2,0,0]=4 32411 B18R2.6482 Fc1cccc(n1)COCc2cccc(c2)Br 34a_100000086748_100000698116 [0,2,0,0,0,0|1,0,0]=3 32412 B18R2.6482 Fc1cccc(n1)COCc2cccc(c2)Br 34a_100000687537_100009819644 [0,2,0,0,0,0|1,0,0]=3 32413 B18R2.6482 Fc1cccc(n1)COCc2cccc(c2)Br 7a_100000687537_100009819644 [0,2,0,0,0,0|1,0,0]=3 32414 B18R2.6482 Fc1cccc(n1)COCc2cccc(c2)Cl 34a_100000086748_100000187163 [0,2,0,0,0,0|1,0,0]=3 32415 B18R2.6482 Fc1cccc(n1)COCc2cccc(c2)Cl 34a_100000241301_100009819644 [0,2,0,0,0,0|1,0,0]=3 32416 B18R2.6482 Fc1cccc(n1)COCc2cccc(c2)Cl 7a_100000241301_100009819644 [0,2,0,0,0,0|1,0,0]=3 32417 B18R2.6482 Fc1cccc(n1)COCc2cccc(c2)I 34a_100000086748_100011218688 [0,2,0,0,0,0|1,0,0]=3 32418 B18R2.6482 Fc1cccc(n1)COCc2cccc(c2)I 34a_100011215336_100009819644 [0,2,0,0,0,0|1,0,0]=3 32419 B18R2.6482 Fc1cccc(n1)COCc2cccc(c2)I 7a_100011215336_100009819644 [0,2,0,0,0,0|1,0,0]=3 32420 B18R2.6482 Fc1cccc(n1)COCc2cccc(n2)Br 34a_100000086748_100009889011 [0,2,0,0,0,0|2,0,0]=4 32421 B18R2.6482 Fc1cccc(n1)COCc2cccc(n2)Br 34a_100000694195_100009819644 [0,2,0,0,0,0|2,0,0]=4 32422 B18R2.6482 Fc1cccc(n1)COCc2cccc(n2)Cl 34a_100000086748_100000086093 [0,2,0,0,0,0|2,0,0]=4 32423 B18R2.6482 Fc1cccc(n1)COCc2cccc(n2)Cl 34a_100011998359_100009819644 [0,2,0,0,0,0|2,0,0]=4 32424 B18R2.6482 Fc1cccc(n1)COCc2cccc(n2)F 34a_100000086748_100009819644 [0,2,0,0,0,0|2,0,0]=4 32425 B18R2.6482 Fc1cccc(n1)COCc2ccnc(c2)Br 34a_100000086748_100010243470 [0,2,0,0,0,0|2,0,0]=4 32426 B18R2.6482 Fc1cccc(n1)COCc2ccnc(c2)Br 34a_100009814636_100009819644 [0,2,0,0,0,0|2,0,0]=4 32427 B18R2.6482 Fc1cccc(n1)COCc2ccnc(c2)Br 7a_100009814636_100009819644 [0,2,0,0,0,0|2,0,0]=4 32428 B18R2.6482 Fc1cccc(n1)COCc2ccnc(c2)Cl 34a_100000086748_100000764220 [0,2,0,0,0,0|2,0,0]=4 32429 B18R2.6482 Fc1cccc(n1)COCc2ccnc(c2)Cl 34a_100000748751_100009819644 [0,2,0,0,0,0|2,0,0]=4 32430 B18R2.6482 Fc1cccc(n1)COCc2cncc(c2)Br 34a_100000086748_100000738771 [0,2,0,0,0,0|2,0,0]=4 32431 B18R2.6482 Fc1cccc(n1)COCc2cncc(c2)Br 34a_100011259137_100009819644 [0,2,0,0,0,0|2,0,0]=4 32432 B18R2.6482 Fc1cccc(n1)COCc2cncc(c2)Br 7a_100011259137_100009819644 [0,2,0,0,0,0|2,0,0]=4 32433 B18R2.6482 Fc1cccc(n1)COCc2cncc(c2)Cl 34a_100000086748_100016992070 [0,2,0,0,0,0|2,0,0]=4 32434 B18R2.6482 Fc1cccc(n1)COCc2cncc(c2)Cl 34a_100000092867_100009819644 [0,2,0,0,0,0|2,0,0]=4 32435 B18R2.6482 Fc1cccc(n1)COCc2cncc(c2)Cl 7a_100000092867_100009819644 [0,2,0,0,0,0|2,0,0]=4 32436 B18R2.6482 Fc1cccc(n1)CSCc2cccc(c2)Br 62a_100000211773_100009819644 [0,2,0,0,0,0|1,1,0]=4 32437 B18R2.6482 Fc1cccc(n1)CSCc2cccc(c2)Br 62a_100009819644_100000211773 [0,2,0,0,0,0|1,1,0]=4 32438 B18R2.6482 Fc1cccc(n1)CSCc2cccc(c2)Cl 62a_100000187163_100009819644 [0,2,0,0,0,0|1,1,0]=4 32439 B18R2.6482 Fc1cccc(n1)CSCc2cccc(c2)Cl 62a_100009819644_100000187163 [0,2,0,0,0,0|1,1,0]=4 32440 B18R2.6482 Fc1cccc(n1)CSCc2cccc(c2)I 62a_100009819644_100011218688 [0,2,0,0,0,0|1,1,0]=4 32441 B18R2.6482 Fc1cccc(n1)CSCc2cccc(c2)I 62a_100011218688_100009819644 [0,2,0,0,0,0|1,1,0]=4 32442 B18R2.6482 Fc1cncc(c1)CNCc2cccc(c2)Br 207a_100000174977_100011361476 [0,2,0,0,0,0|2,0,0]=4 32443 B18R2.6482 Fc1cncc(c1)CNCc2cccc(c2)Br 207a_100011962886_100000210085 [0,2,0,0,0,0|2,0,0]=4 32444 B18R2.6482 Fc1cncc(c1)CNCc2cccc(c2)Br 2230a_100000174977_100000725299 [0,2,0,0,0,0|2,0,0]=4 32445 B18R2.6482 Fc1cncc(c1)CNCc2cccc(c2)Br 2230a_100011962886_100000698116 [0,2,0,0,0,0|2,0,0]=4 32446 B18R2.6482 Fc1cncc(c1)CNCc2cccc(c2)Br 270004a_100000174977_100011361476 [0,2,0,0,0,0|2,0,0]=4 32447 B18R2.6482 Fc1cncc(c1)CNCc2cccc(c2)Br 270004a_100011962886_100000210085 [0,2,0,0,0,0|2,0,0]=4 32448 B18R2.6482 Fc1cncc(c1)CNCc2cccc(c2)Br 34a_100000174977_100000725299 [0,2,0,0,0,0|2,0,0]=4 32449 B18R2.6482 Fc1cncc(c1)CNCc2cccc(c2)Br 34a_100011962886_100000698116 [0,2,0,0,0,0|2,0,0]=4 32450 B18R2.6482 Fc1cncc(c1)CNCc2cccc(c2)Cl 207a_100000174878_100011361476 [0,2,0,0,0,0|2,0,0]=4 32451 B18R2.6482 Fc1cncc(c1)CNCc2cccc(c2)Cl 207a_100011962886_100000210801 [0,2,0,0,0,0|2,0,0]=4 32452 B18R2.6482 Fc1cncc(c1)CNCc2cccc(c2)Cl 2230a_100000174878_100000725299 [0,2,0,0,0,0|2,0,0]=4 32453 B18R2.6482 Fc1cncc(c1)CNCc2cccc(c2)Cl 2230a_100011962886_100000181238 [0,2,0,0,0,0|2,0,0]=4 32454 B18R2.6482 Fc1cncc(c1)CNCc2cccc(c2)Cl 270004a_100000174878_100011361476 [0,2,0,0,0,0|2,0,0]=4 32455 B18R2.6482 Fc1cncc(c1)CNCc2cccc(c2)Cl 270004a_100011962886_100000210801 [0,2,0,0,0,0|2,0,0]=4 32456 B18R2.6482 Fc1cncc(c1)CNCc2cccc(c2)Cl 34a_100000174878_100000725299 [0,2,0,0,0,0|2,0,0]=4 32457 B18R2.6482 Fc1cncc(c1)CNCc2cccc(c2)Cl 34a_100011962886_100000187163 [0,2,0,0,0,0|2,0,0]=4 32458 B18R2.6482 Fc1cncc(c1)CNCc2cccc(c2)I 207a_100000106179_100011361476 [0,2,0,0,0,0|2,0,0]=4 32459 B18R2.6482 Fc1cncc(c1)CNCc2cccc(c2)I 207a_100011962886_100000014684 [0,2,0,0,0,0|2,0,0]=4 32460 B18R2.6482 Fc1cncc(c1)CNCc2cccc(c2)I 2230a_100000106179_100000725299 [0,2,0,0,0,0|2,0,0]=4 32461 B18R2.6482 Fc1cncc(c1)CNCc2cccc(c2)I 2230a_100011962886_100011218688 [0,2,0,0,0,0|2,0,0]=4 32462 B18R2.6482 Fc1cncc(c1)CNCc2cccc(c2)I 270004a_100000106179_100011361476 [0,2,0,0,0,0|2,0,0]=4 32463 B18R2.6482 Fc1cncc(c1)CNCc2cccc(c2)I 270004a_100011962886_100000014684 [0,2,0,0,0,0|2,0,0]=4 32464 B18R2.6482 Fc1cncc(c1)CNCc2cccc(c2)I 34a_100000106179_100000725299 [0,2,0,0,0,0|2,0,0]=4 32465 B18R2.6482 Fc1cncc(c1)CNCc2cccc(c2)I 34a_100011962886_100011218688 [0,2,0,0,0,0|2,0,0]=4 32466 B18R2.6482 Fc1cncc(c1)COCc2cc(ccn2)Br 34a_100011962875_100010173614 [0,2,0,0,0,0|2,0,0]=4 32467 B18R2.6482 Fc1cncc(c1)COCc2cc(ccn2)Br 7a_100011962875_100010173614 [0,2,0,0,0,0|2,0,0]=4 32468 B18R2.6482 Fc1cncc(c1)COCc2cc(ccn2)Cl 34a_100000748867_100000725299 [0,2,0,0,0,0|2,0,0]=4 32469 B18R2.6482 Fc1cncc(c1)COCc2cc(ccn2)Cl 34a_100011962875_100016988179 [0,2,0,0,0,0|2,0,0]=4 32470 B18R2.6482 Fc1cncc(c1)COCc2cc(ccn2)Cl 7a_100011962875_100016988179 [0,2,0,0,0,0|2,0,0]=4 32471 B18R2.6482 Fc1cncc(c1)COCc2cccc(c2)Br 34a_100000687537_100000725299 [0,2,0,0,0,0|1,0,0]=3 32472 B18R2.6482 Fc1cncc(c1)COCc2cccc(c2)Br 34a_100011962875_100000698116 [0,2,0,0,0,0|1,0,0]=3 32473 B18R2.6482 Fc1cncc(c1)COCc2cccc(c2)Br 7a_100000687537_100000725299 [0,2,0,0,0,0|1,0,0]=3 32474 B18R2.6482 Fc1cncc(c1)COCc2cccc(c2)Br 7a_100011962875_100000211773 [0,2,0,0,0,0|1,0,0]=3 32475 B18R2.6482 Fc1cncc(c1)COCc2cccc(c2)Cl 34a_100000241301_100000725299 [0,2,0,0,0,0|1,0,0]=3 32476 B18R2.6482 Fc1cncc(c1)COCc2cccc(c2)Cl 34a_100011962875_100000187163 [0,2,0,0,0,0|1,0,0]=3 32477 B18R2.6482 Fc1cncc(c1)COCc2cccc(c2)Cl 7a_100000241301_100000725299 [0,2,0,0,0,0|1,0,0]=3 32478 B18R2.6482 Fc1cncc(c1)COCc2cccc(c2)Cl 7a_100011962875_100000187163 [0,2,0,0,0,0|1,0,0]=3 32479 B18R2.6482 Fc1cncc(c1)COCc2cccc(c2)I 34a_100011215336_100000725299 [0,2,0,0,0,0|1,0,0]=3 32480 B18R2.6482 Fc1cncc(c1)COCc2cccc(c2)I 34a_100011962875_100011218688 [0,2,0,0,0,0|1,0,0]=3 32481 B18R2.6482 Fc1cncc(c1)COCc2cccc(c2)I 7a_100011215336_100000725299 [0,2,0,0,0,0|1,0,0]=3 32482 B18R2.6482 Fc1cncc(c1)COCc2cccc(c2)I 7a_100011962875_100011218688 [0,2,0,0,0,0|1,0,0]=3 32483 B18R2.6482 Fc1cncc(c1)COCc2cccc(n2)Br 34a_100000694195_100000725299 [0,2,0,0,0,0|2,0,0]=4 32484 B18R2.6482 Fc1cncc(c1)COCc2cccc(n2)Br 34a_100011962875_100009889011 [0,2,0,0,0,0|2,0,0]=4 32485 B18R2.6482 Fc1cncc(c1)COCc2cccc(n2)Br 7a_100011962875_100009889011 [0,2,0,0,0,0|2,0,0]=4 32486 B18R2.6482 Fc1cncc(c1)COCc2cccc(n2)Cl 34a_100011962875_100000086093 [0,2,0,0,0,0|2,0,0]=4 32487 B18R2.6482 Fc1cncc(c1)COCc2cccc(n2)Cl 34a_100011998359_100000725299 [0,2,0,0,0,0|2,0,0]=4 32488 B18R2.6482 Fc1cncc(c1)COCc2cccc(n2)Cl 7a_100011962875_100000086093 [0,2,0,0,0,0|2,0,0]=4 32489 B18R2.6482 Fc1cncc(c1)COCc2cccc(n2)F 34a_100000086748_100000725299 [0,2,0,0,0,0|2,0,0]=4 32490 B18R2.6482 Fc1cncc(c1)COCc2cccc(n2)F 34a_100011962875_100009819644 [0,2,0,0,0,0|2,0,0]=4 32491 B18R2.6482 Fc1cncc(c1)COCc2cccc(n2)F 7a_100011962875_100009819644 [0,2,0,0,0,0|2,0,0]=4 32492 B18R2.6482 Fc1cncc(c1)COCc2ccnc(c2)Br 34a_100009814636_100000725299 [0,2,0,0,0,0|2,0,0]=4 32493 B18R2.6482 Fc1cncc(c1)COCc2ccnc(c2)Br 34a_100011962875_100010243470 [0,2,0,0,0,0|2,0,0]=4 32494 B18R2.6482 Fc1cncc(c1)COCc2ccnc(c2)Br 7a_100009814636_100000725299 [0,2,0,0,0,0|2,0,0]=4 32495 B18R2.6482 Fc1cncc(c1)COCc2ccnc(c2)Br 7a_100011962875_100010254460 [0,2,0,0,0,0|2,0,0]=4 32496 B18R2.6482 Fc1cncc(c1)COCc2ccnc(c2)Cl 34a_100000748751_100000725299 [0,2,0,0,0,0|2,0,0]=4 32497 B18R2.6482 Fc1cncc(c1)COCc2ccnc(c2)Cl 34a_100011962875_100000764220 [0,2,0,0,0,0|2,0,0]=4 32498 B18R2.6482 Fc1cncc(c1)COCc2ccnc(c2)Cl 7a_100011962875_100000764220 [0,2,0,0,0,0|2,0,0]=4 32499 B18R2.6482 Fc1cncc(c1)COCc2ccnc(c2)F 34a_100000082451_100000725299 [0,2,0,0,0,0|2,0,0]=4 32500 B18R2.6482 Fc1cncc(c1)COCc2cncc(c2)Br 34a_100011259137_100000725299 [0,2,0,0,0,0|2,0,0]=4 32501 B18R2.6482 Fc1cncc(c1)COCc2cncc(c2)Br 34a_100011962875_100000738771 [0,2,0,0,0,0|2,0,0]=4 32502 B18R2.6482 Fc1cncc(c1)COCc2cncc(c2)Br 7a_100011259137_100000725299 [0,2,0,0,0,0|2,0,0]=4 32503 B18R2.6482 Fc1cncc(c1)COCc2cncc(c2)Br 7a_100011962875_100000738771 [0,2,0,0,0,0|2,0,0]=4 32504 B18R2.6482 Fc1cncc(c1)COCc2cncc(c2)Cl 34a_100000092867_100000725299 [0,2,0,0,0,0|2,0,0]=4 32505 B18R2.6482 Fc1cncc(c1)COCc2cncc(c2)Cl 34a_100011962875_100016992070 [0,2,0,0,0,0|2,0,0]=4 32506 B18R2.6482 Fc1cncc(c1)COCc2cncc(c2)Cl 7a_100000092867_100000725299 [0,2,0,0,0,0|2,0,0]=4 32507 B18R2.6482 Fc1cncc(c1)COCc2cncc(c2)Cl 7a_100011962875_100016992070 [0,2,0,0,0,0|2,0,0]=4 32508 B18R2.6482 Fc1cncc(c1)COCc2cncc(c2)F 34a_100011962875_100000725299 [0,2,0,0,0,0|2,0,0]=4 32509 B18R2.6482 Fc1cncc(c1)COCc2cncc(c2)F 7a_100011962875_100000725299 [0,2,0,0,0,0|2,0,0]=4 32510 B18R2.6482 Fc1cncc(c1)CSCc2cccc(c2)Br 62a_100000211773_100000725299 [0,2,0,0,0,0|1,1,0]=4 32511 B18R2.6482 Fc1cncc(c1)CSCc2cccc(c2)Br 62a_100000725299_100000211773 [0,2,0,0,0,0|1,1,0]=4 32512 B18R2.6482 Fc1cncc(c1)CSCc2cccc(c2)Cl 62a_100000187163_100000725299 [0,2,0,0,0,0|1,1,0]=4 32513 B18R2.6482 Fc1cncc(c1)CSCc2cccc(c2)Cl 62a_100000725299_100000187163 [0,2,0,0,0,0|1,1,0]=4 32514 B18R2.6482 Fc1cncc(c1)CSCc2cccc(c2)I 62a_100000725299_100011218688 [0,2,0,0,0,0|1,1,0]=4 32515 B18R2.6482 Fc1cncc(c1)CSCc2cccc(c2)I 62a_100011218688_100000725299 [0,2,0,0,0,0|1,1,0]=4 32516 B18R2.6482 Ic1cccc(c1)CNCc2cccc(c2)I 207a_100000106179_100000014684 [0,2,0,0,0,0|1,0,0]=3 32517 B18R2.6482 Ic1cccc(c1)CNCc2cccc(c2)I 2230a_100000106179_100011218688 [0,2,0,0,0,0|1,0,0]=3 32518 B18R2.6482 Ic1cccc(c1)CNCc2cccc(c2)I 270004a_100000106179_100000014684 [0,2,0,0,0,0|1,0,0]=3 32519 B18R2.6482 Ic1cccc(c1)CNCc2cccc(c2)I 34a_100000106179_100011218688 [0,2,0,0,0,0|1,0,0]=3 32520 B18R2.6482 Ic1cccc(c1)COCc2cccc(c2)I 34a_100011215336_100011218688 [0,2,0,0,0,0|0,0,0]=2 32521 B18R2.6482 Ic1cccc(c1)COCc2cccc(c2)I 7a_100011215336_100011218688 [0,2,0,0,0,0|0,0,0]=2 32522 B18R2.6482 Ic1cccc(c1)CSCc2cccc(c2)I 62a_100011218688_100011218688 [0,2,0,0,0,0|0,1,0]=3 32523 B18R2.6482 Nc1cccc(c1)COCc2cc(ccn2)Br 34a_100000211919_100010173614 [0,2,0,0,0,0|1,0,0]=3 32524 B18R2.6482 Nc1cccc(c1)COCc2cc(ccn2)Cl 34a_100000211919_100016988179 [0,2,0,0,0,0|1,0,0]=3 32525 B18R2.6482 Nc1cccc(c1)COCc2cccc(c2)Br 34a_100000211919_100000698116 [0,2,0,0,0,0|0,0,0]=2 32526 B18R2.6482 Nc1cccc(c1)COCc2cccc(c2)Cl 34a_100000211919_100000187163 [0,2,0,0,0,0|0,0,0]=2 32527 B18R2.6482 Nc1cccc(c1)COCc2cccc(c2)F 34a_100000211919_100000187166 [0,2,0,0,0,0|0,0,0]=2 32528 B18R2.6482 Nc1cccc(c1)COCc2cccc(c2)I 34a_100000211919_100011218688 [0,2,0,0,0,0|0,0,0]=2 32529 B18R2.6482 Nc1cccc(c1)COCc2cccc(c2)O 34a_100000211919_100011660834 [0,2,0,0,0,0|0,0,0]=2 32530 B18R2.6482 Nc1cccc(c1)COCc2cccc(n2)Br 34a_100000211919_100009889011 [0,2,0,0,0,0|1,0,0]=3 32531 B18R2.6482 Nc1cccc(c1)COCc2cccc(n2)Cl 34a_100000211919_100000086093 [0,2,0,0,0,0|1,0,0]=3 32532 B18R2.6482 Nc1cccc(c1)COCc2cccc(n2)F 34a_100000211919_100009819644 [0,2,0,0,0,0|1,0,0]=3 32533 B18R2.6482 Nc1cccc(c1)COCc2ccnc(c2)Br 34a_100000211919_100010243470 [0,2,0,0,0,0|1,0,0]=3 32534 B18R2.6482 Nc1cccc(c1)COCc2ccnc(c2)Cl 34a_100000211919_100000764220 [0,2,0,0,0,0|1,0,0]=3 32535 B18R2.6482 Nc1cccc(c1)COCc2ccnc(n2)Cl 34a_100000211919_100000099655 [0,2,0,0,0,0|2,0,0]=4 32536 B18R2.6482 Nc1cccc(c1)COCc2cncc(c2)Br 34a_100000211919_100000738771 [0,2,0,0,0,0|1,0,0]=3 32537 B18R2.6482 Nc1cccc(c1)COCc2cncc(c2)Cl 34a_100000211919_100016992070 [0,2,0,0,0,0|1,0,0]=3 32538 B18R2.6482 Nc1cccc(c1)COCc2cncc(c2)F 34a_100000211919_100000725299 [0,2,0,0,0,0|1,0,0]=3 32539 B18R2.6482 Nc1cccc(c1)OCCc2cccc(c2)Br 34a_100000210217_100011740638 [0,2,0,0,0,0|2,0,0]=4 32540 B18R2.6482 Nc1cccc(c1)OCCc2cccc(c2)Cl 34a_100000210217_100011713710 [0,2,0,0,0,0|2,0,0]=4 32541 B18R2.6482 Nc1cccc(c1)OCCc2cccc(c2)F 34a_100000210217_100011217235 [0,2,0,0,0,0|2,0,0]=4 32542 B18R2.6482 Nc1cccc(c1)SCCc2cccc(c2)Br 62a_100000210019_100011740638 [0,2,0,0,0,0|2,0,0]=4 32543 B18R2.6482 Nc1cccc(c1)SCCc2cccc(c2)Br 62a_100011740638_100000210019 [0,2,0,0,0,0|2,0,0]=4 32544 B18R2.6482 Nc1cccc(c1)SCCc2cccc(c2)Cl 62a_100000210019_100011713710 [0,2,0,0,0,0|2,0,0]=4 32545 B18R2.6482 Nc1cccc(c1)SCCc2cccc(c2)Cl 62a_100011713710_100000210019 [0,2,0,0,0,0|2,0,0]=4 32546 B18R2.6482 Nc1cccc(c1)SCCc2cccc(c2)F 62a_100000210019_100011217235 [0,2,0,0,0,0|2,0,0]=4 32547 B18R2.6482 Nc1cccc(c1)SCCc2cccc(c2)F 62a_100011217235_100000210019 [0,2,0,0,0,0|2,0,0]=4 32548 B18R2.6482 Nc1ccnc(c1)COCc2cc(ccn2)Br 34a_100000692640_100010173614 [0,2,0,0,0,0|2,0,0]=4 32549 B18R2.6482 Nc1ccnc(c1)COCc2cc(ccn2)Cl 34a_100000692640_100016988179 [0,2,0,0,0,0|2,0,0]=4 32550 B18R2.6482 Nc1ccnc(c1)COCc2cccc(c2)Br 34a_100000692640_100000698116 [0,2,0,0,0,0|1,0,0]=3 32551 B18R2.6482 Nc1ccnc(c1)COCc2cccc(c2)Cl 34a_100000692640_100000187163 [0,2,0,0,0,0|1,0,0]=3 32552 B18R2.6482 Nc1ccnc(c1)COCc2cccc(c2)F 34a_100000692640_100000187166 [0,2,0,0,0,0|1,0,0]=3 32553 B18R2.6482 Nc1ccnc(c1)COCc2cccc(c2)I 34a_100000692640_100011218688 [0,2,0,0,0,0|1,0,0]=3 32554 B18R2.6482 Nc1ccnc(c1)COCc2cccc(c2)O 34a_100000692640_100011660834 [0,2,0,0,0,0|1,0,0]=3 32555 B18R2.6482 Nc1ccnc(c1)COCc2cccc(n2)Br 34a_100000692640_100009889011 [0,2,0,0,0,0|2,0,0]=4 32556 B18R2.6482 Nc1ccnc(c1)COCc2cccc(n2)Cl 34a_100000692640_100000086093 [0,2,0,0,0,0|2,0,0]=4 32557 B18R2.6482 Nc1ccnc(c1)COCc2cccc(n2)F 34a_100000692640_100009819644 [0,2,0,0,0,0|2,0,0]=4 32558 B18R2.6482 Nc1ccnc(c1)COCc2ccnc(c2)Br 34a_100000692640_100010243470 [0,2,0,0,0,0|2,0,0]=4 32559 B18R2.6482 Nc1ccnc(c1)COCc2ccnc(c2)Cl 34a_100000692640_100000764220 [0,2,0,0,0,0|2,0,0]=4 32560 B18R2.6482 Nc1ccnc(c1)COCc2cncc(c2)Br 34a_100000692640_100000738771 [0,2,0,0,0,0|2,0,0]=4 32561 B18R2.6482 Nc1ccnc(c1)COCc2cncc(c2)Cl 34a_100000692640_100016992070 [0,2,0,0,0,0|2,0,0]=4 32562 B18R2.6482 Nc1ccnc(c1)COCc2cncc(c2)F 34a_100000692640_100000725299 [0,2,0,0,0,0|2,0,0]=4 32563 B18R2.6482 Nc1cncc(c1)COCc2cc(ccn2)Br 34a_100000085308_100010173614 [0,2,0,0,0,0|2,0,0]=4 32564 B18R2.6482 Nc1cncc(c1)COCc2cc(ccn2)Cl 34a_100000085308_100016988179 [0,2,0,0,0,0|2,0,0]=4 32565 B18R2.6482 Nc1cncc(c1)COCc2cccc(c2)Br 34a_100000085308_100000698116 [0,2,0,0,0,0|1,0,0]=3 32566 B18R2.6482 Nc1cncc(c1)COCc2cccc(c2)Cl 34a_100000085308_100000187163 [0,2,0,0,0,0|1,0,0]=3 32567 B18R2.6482 Nc1cncc(c1)COCc2cccc(c2)F 34a_100000085308_100000187166 [0,2,0,0,0,0|1,0,0]=3 32568 B18R2.6482 Nc1cncc(c1)COCc2cccc(c2)I 34a_100000085308_100011218688 [0,2,0,0,0,0|1,0,0]=3 32569 B18R2.6482 Nc1cncc(c1)COCc2cccc(c2)O 34a_100000085308_100011660834 [0,2,0,0,0,0|1,0,0]=3 32570 B18R2.6482 Nc1cncc(c1)COCc2cccc(n2)Br 34a_100000085308_100009889011 [0,2,0,0,0,0|2,0,0]=4 32571 B18R2.6482 Nc1cncc(c1)COCc2cccc(n2)Cl 34a_100000085308_100000086093 [0,2,0,0,0,0|2,0,0]=4 32572 B18R2.6482 Nc1cncc(c1)COCc2cccc(n2)F 34a_100000085308_100009819644 [0,2,0,0,0,0|2,0,0]=4 32573 B18R2.6482 Nc1cncc(c1)COCc2ccnc(c2)Br 34a_100000085308_100010243470 [0,2,0,0,0,0|2,0,0]=4 32574 B18R2.6482 Nc1cncc(c1)COCc2ccnc(c2)Cl 34a_100000085308_100000764220 [0,2,0,0,0,0|2,0,0]=4 32575 B18R2.6482 Nc1cncc(c1)COCc2cncc(c2)Br 34a_100000085308_100000738771 [0,2,0,0,0,0|2,0,0]=4 32576 B18R2.6482 Nc1cncc(c1)COCc2cncc(c2)Cl 34a_100000085308_100016992070 [0,2,0,0,0,0|2,0,0]=4 32577 B18R2.6482 Nc1cncc(c1)COCc2cncc(c2)F 34a_100000085308_100000725299 [0,2,0,0,0,0|2,0,0]=4 32578 B18R2.6482 O=c1cccc([nH]1)CNCc2cccc(c2)Br 207a_100000174977_100011935257 [0,2,0,0,0,0|2,0,0]=4 32579 B18R2.6482 O=c1cccc([nH]1)CNCc2cccc(c2)Br 2230a_100000696482_100000698116 [0,2,0,0,0,0|2,0,0]=4 32580 B18R2.6482 O=c1cccc([nH]1)CNCc2cccc(c2)Cl 207a_100000174878_100011935257 [0,2,0,0,0,0|2,0,0]=4 32581 B18R2.6482 O=c1cccc([nH]1)CNCc2cccc(c2)Cl 2230a_100000696482_100000181238 [0,2,0,0,0,0|2,0,0]=4 32582 B18R2.6482 O=c1cccc([nH]1)CNCc2cccc(c2)F 207a_100000174948_100011935257 [0,2,0,0,0,0|2,0,0]=4 32583 B18R2.6482 O=c1cccc([nH]1)CNCc2cccc(c2)F 2230a_100000696482_100000230114 [0,2,0,0,0,0|2,0,0]=4 32584 B18R2.6482 O=c1cccc([nH]1)CNCc2cccc(c2)I 207a_100000106179_100011935257 [0,2,0,0,0,0|2,0,0]=4 32585 B18R2.6482 O=c1cccc([nH]1)CNCc2cccc(c2)I 2230a_100000696482_100011218688 [0,2,0,0,0,0|2,0,0]=4 32586 B18R2.6482 O=c1cccc([nH]1)CNCc2cccc(c2)O 207a_100000743036_100011935257 [0,2,0,0,0,0|2,0,0]=4 32587 B18R2.6482 O=c1cccc([nH]1)CNCc2cccc(c2)O 2230a_100000696482_100011660834 [0,2,0,0,0,0|2,0,0]=4 32588 B18R2.6482 Oc1cc(ccn1)CNCc2cccc(c2)Br 207a_100000174977_100000688113 [0,2,0,0,0,0|2,0,0]=4 32589 B18R2.6482 Oc1cc(ccn1)CNCc2cccc(c2)Cl 207a_100000174878_100000688113 [0,2,0,0,0,0|2,0,0]=4 32590 B18R2.6482 Oc1cc(ccn1)CNCc2cccc(c2)F 207a_100000174948_100000688113 [0,2,0,0,0,0|2,0,0]=4 32591 B18R2.6482 Oc1cc(ccn1)CNCc2cccc(c2)I 207a_100000106179_100000688113 [0,2,0,0,0,0|2,0,0]=4 32592 B18R2.6482 Oc1cccc(c1)CNCc2cc(ccn2)Br 2230a_100000743036_100010173614 [0,2,0,0,0,0|2,0,0]=4 32593 B18R2.6482 Oc1cccc(c1)CNCc2cc(ccn2)Br 270004a_100000743036_100009818557 [0,2,0,0,0,0|2,0,0]=4 32594 B18R2.6482 Oc1cccc(c1)CNCc2cc(ccn2)Br 34a_100000743036_100010173614 [0,2,0,0,0,0|2,0,0]=4 32595 B18R2.6482 Oc1cccc(c1)CNCc2cc(ccn2)Cl 2230a_100000743036_100016988179 [0,2,0,0,0,0|2,0,0]=4 32596 B18R2.6482 Oc1cccc(c1)CNCc2cc(ccn2)Cl 270004a_100000743036_100011998288 [0,2,0,0,0,0|2,0,0]=4 32597 B18R2.6482 Oc1cccc(c1)CNCc2cc(ccn2)Cl 34a_100000743036_100016988179 [0,2,0,0,0,0|2,0,0]=4 32598 B18R2.6482 Oc1cccc(c1)CNCc2cccc(c2)Br 207a_100000174977_100000188321 [0,2,0,0,0,0|1,0,0]=3 32599 B18R2.6482 Oc1cccc(c1)CNCc2cccc(c2)Br 207a_100000743036_100000210085 [0,2,0,0,0,0|1,0,0]=3 32600 B18R2.6482 Oc1cccc(c1)CNCc2cccc(c2)Br 2230a_100000174977_100011660834 [0,2,0,0,0,0|1,0,0]=3 32601 B18R2.6482 Oc1cccc(c1)CNCc2cccc(c2)Br 2230a_100000743036_100000698116 [0,2,0,0,0,0|1,0,0]=3 32602 B18R2.6482 Oc1cccc(c1)CNCc2cccc(c2)Br 270004a_100000174977_100000188321 [0,2,0,0,0,0|1,0,0]=3 32603 B18R2.6482 Oc1cccc(c1)CNCc2cccc(c2)Br 270004a_100000743036_100000210085 [0,2,0,0,0,0|1,0,0]=3 32604 B18R2.6482 Oc1cccc(c1)CNCc2cccc(c2)Br 34a_100000174977_100011660834 [0,2,0,0,0,0|1,0,0]=3 32605 B18R2.6482 Oc1cccc(c1)CNCc2cccc(c2)Br 34a_100000743036_100000698116 [0,2,0,0,0,0|1,0,0]=3 32606 B18R2.6482 Oc1cccc(c1)CNCc2cccc(c2)Cl 207a_100000174878_100000188321 [0,2,0,0,0,0|1,0,0]=3 32607 B18R2.6482 Oc1cccc(c1)CNCc2cccc(c2)Cl 207a_100000743036_100000210801 [0,2,0,0,0,0|1,0,0]=3 32608 B18R2.6482 Oc1cccc(c1)CNCc2cccc(c2)Cl 2230a_100000174878_100011660834 [0,2,0,0,0,0|1,0,0]=3 32609 B18R2.6482 Oc1cccc(c1)CNCc2cccc(c2)Cl 2230a_100000743036_100000181238 [0,2,0,0,0,0|1,0,0]=3 32610 B18R2.6482 Oc1cccc(c1)CNCc2cccc(c2)Cl 270004a_100000174878_100000188321 [0,2,0,0,0,0|1,0,0]=3 32611 B18R2.6482 Oc1cccc(c1)CNCc2cccc(c2)Cl 270004a_100000743036_100000210801 [0,2,0,0,0,0|1,0,0]=3 32612 B18R2.6482 Oc1cccc(c1)CNCc2cccc(c2)Cl 34a_100000174878_100011660834 [0,2,0,0,0,0|1,0,0]=3 32613 B18R2.6482 Oc1cccc(c1)CNCc2cccc(c2)Cl 34a_100000743036_100000187163 [0,2,0,0,0,0|1,0,0]=3 32614 B18R2.6482 Oc1cccc(c1)CNCc2cccc(c2)F 207a_100000174948_100000188321 [0,2,0,0,0,0|1,0,0]=3 32615 B18R2.6482 Oc1cccc(c1)CNCc2cccc(c2)F 207a_100000743036_100000210812 [0,2,0,0,0,0|1,0,0]=3 32616 B18R2.6482 Oc1cccc(c1)CNCc2cccc(c2)F 2230a_100000174948_100011660834 [0,2,0,0,0,0|1,0,0]=3 32617 B18R2.6482 Oc1cccc(c1)CNCc2cccc(c2)F 2230a_100000743036_100000230114 [0,2,0,0,0,0|1,0,0]=3 32618 B18R2.6482 Oc1cccc(c1)CNCc2cccc(c2)F 270004a_100000174948_100000188321 [0,2,0,0,0,0|1,0,0]=3 32619 B18R2.6482 Oc1cccc(c1)CNCc2cccc(c2)F 270004a_100000743036_100000210812 [0,2,0,0,0,0|1,0,0]=3 32620 B18R2.6482 Oc1cccc(c1)CNCc2cccc(c2)F 34a_100000174948_100011660834 [0,2,0,0,0,0|1,0,0]=3 32621 B18R2.6482 Oc1cccc(c1)CNCc2cccc(c2)F 34a_100000743036_100000187166 [0,2,0,0,0,0|1,0,0]=3 32622 B18R2.6482 Oc1cccc(c1)CNCc2cccc(c2)I 207a_100000106179_100000188321 [0,2,0,0,0,0|1,0,0]=3 32623 B18R2.6482 Oc1cccc(c1)CNCc2cccc(c2)I 207a_100000743036_100000014684 [0,2,0,0,0,0|1,0,0]=3 32624 B18R2.6482 Oc1cccc(c1)CNCc2cccc(c2)I 2230a_100000106179_100011660834 [0,2,0,0,0,0|1,0,0]=3 32625 B18R2.6482 Oc1cccc(c1)CNCc2cccc(c2)I 2230a_100000743036_100011218688 [0,2,0,0,0,0|1,0,0]=3 32626 B18R2.6482 Oc1cccc(c1)CNCc2cccc(c2)I 270004a_100000106179_100000188321 [0,2,0,0,0,0|1,0,0]=3 32627 B18R2.6482 Oc1cccc(c1)CNCc2cccc(c2)I 270004a_100000743036_100000014684 [0,2,0,0,0,0|1,0,0]=3 32628 B18R2.6482 Oc1cccc(c1)CNCc2cccc(c2)I 34a_100000106179_100011660834 [0,2,0,0,0,0|1,0,0]=3 32629 B18R2.6482 Oc1cccc(c1)CNCc2cccc(c2)I 34a_100000743036_100011218688 [0,2,0,0,0,0|1,0,0]=3 32630 B18R2.6482 Oc1cccc(c1)CNCc2cccc(c2)O 207a_100000743036_100000188321 [0,2,0,0,0,0|1,0,0]=3 32631 B18R2.6482 Oc1cccc(c1)CNCc2cccc(c2)O 2230a_100000743036_100011660834 [0,2,0,0,0,0|1,0,0]=3 32632 B18R2.6482 Oc1cccc(c1)CNCc2cccc(c2)O 270004a_100000743036_100000188321 [0,2,0,0,0,0|1,0,0]=3 32633 B18R2.6482 Oc1cccc(c1)CNCc2cccc(c2)O 34a_100000743036_100011660834 [0,2,0,0,0,0|1,0,0]=3 32634 B18R2.6482 Oc1cccc(c1)CNCc2cccc(n2)Br 2230a_100000743036_100009889011 [0,2,0,0,0,0|2,0,0]=4 32635 B18R2.6482 Oc1cccc(c1)CNCc2cccc(n2)Br 2230a_100016987751_100011660834 [0,2,0,0,0,0|2,0,0]=4 32636 B18R2.6482 Oc1cccc(c1)CNCc2cccc(n2)Br 270004a_100000743036_100000688028 [0,2,0,0,0,0|2,0,0]=4 32637 B18R2.6482 Oc1cccc(c1)CNCc2cccc(n2)Br 34a_100000743036_100009889011 [0,2,0,0,0,0|2,0,0]=4 32638 B18R2.6482 Oc1cccc(c1)CNCc2cccc(n2)Cl 2230a_100000743036_100000086093 [0,2,0,0,0,0|2,0,0]=4 32639 B18R2.6482 Oc1cccc(c1)CNCc2cccc(n2)Cl 2230a_100016990191_100011660834 [0,2,0,0,0,0|2,0,0]=4 32640 B18R2.6482 Oc1cccc(c1)CNCc2cccc(n2)Cl 270004a_100000743036_100011361687 [0,2,0,0,0,0|2,0,0]=4 32641 B18R2.6482 Oc1cccc(c1)CNCc2cccc(n2)Cl 34a_100000743036_100000086093 [0,2,0,0,0,0|2,0,0]=4 32642 B18R2.6482 Oc1cccc(c1)CNCc2cccc(n2)F 2230a_100000743036_100009819644 [0,2,0,0,0,0|2,0,0]=4 32643 B18R2.6482 Oc1cccc(c1)CNCc2cccc(n2)F 2230a_100015188798_100011660834 [0,2,0,0,0,0|2,0,0]=4 32644 B18R2.6482 Oc1cccc(c1)CNCc2cccc(n2)F 270004a_100000743036_100000050434 [0,2,0,0,0,0|2,0,0]=4 32645 B18R2.6482 Oc1cccc(c1)CNCc2cccc(n2)F 34a_100000743036_100009819644 [0,2,0,0,0,0|2,0,0]=4 32646 B18R2.6482 Oc1cccc(c1)CNCc2cccc(n2)F 34a_100015188798_100011660834 [0,2,0,0,0,0|2,0,0]=4 32647 B18R2.6482 Oc1cccc(c1)CNCc2ccnc(c2)Br 2230a_100000743036_100010243470 [0,2,0,0,0,0|2,0,0]=4 32648 B18R2.6482 Oc1cccc(c1)CNCc2ccnc(c2)Br 2230a_100025757509_100011660834 [0,2,0,0,0,0|2,0,0]=4 32649 B18R2.6482 Oc1cccc(c1)CNCc2ccnc(c2)Br 270004a_100000743036_100009814634 [0,2,0,0,0,0|2,0,0]=4 32650 B18R2.6482 Oc1cccc(c1)CNCc2ccnc(c2)Br 270004a_100025757509_100000188321 [0,2,0,0,0,0|2,0,0]=4 32651 B18R2.6482 Oc1cccc(c1)CNCc2ccnc(c2)Br 34a_100000743036_100010243470 [0,2,0,0,0,0|2,0,0]=4 32652 B18R2.6482 Oc1cccc(c1)CNCc2ccnc(c2)Br 34a_100025757509_100011660834 [0,2,0,0,0,0|2,0,0]=4 32653 B18R2.6482 Oc1cccc(c1)CNCc2ccnc(c2)Cl 2230a_100000743036_100000764220 [0,2,0,0,0,0|2,0,0]=4 32654 B18R2.6482 Oc1cccc(c1)CNCc2ccnc(c2)Cl 2230a_100015205668_100011660834 [0,2,0,0,0,0|2,0,0]=4 32655 B18R2.6482 Oc1cccc(c1)CNCc2ccnc(c2)Cl 270004a_100000743036_100011290808 [0,2,0,0,0,0|2,0,0]=4 32656 B18R2.6482 Oc1cccc(c1)CNCc2ccnc(c2)Cl 270004a_100015205668_100000188321 [0,2,0,0,0,0|2,0,0]=4 32657 B18R2.6482 Oc1cccc(c1)CNCc2ccnc(c2)Cl 34a_100000743036_100000764220 [0,2,0,0,0,0|2,0,0]=4 32658 B18R2.6482 Oc1cccc(c1)CNCc2ccnc(c2)Cl 34a_100015205668_100011660834 [0,2,0,0,0,0|2,0,0]=4 32659 B18R2.6482 Oc1cccc(c1)CNCc2ccnc(c2)F 2230a_100015188774_100011660834 [0,2,0,0,0,0|2,0,0]=4 32660 B18R2.6482 Oc1cccc(c1)CNCc2ccnc(c2)F 270004a_100000743036_100000068331 [0,2,0,0,0,0|2,0,0]=4 32661 B18R2.6482 Oc1cccc(c1)CNCc2ccnc(c2)F 270004a_100015188774_100000188321 [0,2,0,0,0,0|2,0,0]=4 32662 B18R2.6482 Oc1cccc(c1)CNCc2ccnc(c2)F 34a_100015188774_100011660834 [0,2,0,0,0,0|2,0,0]=4 32663 B18R2.6482 Oc1cccc(c1)CNCc2ccnc(c2)O 207a_100000743036_100000688113 [0,2,0,0,0,0|2,0,0]=4 32664 B18R2.6482 Oc1cccc(c1)CNCc2cncc(c2)Br 207a_100000743036_100000687066 [0,2,0,0,0,0|2,0,0]=4 32665 B18R2.6482 Oc1cccc(c1)CNCc2cncc(c2)Br 207a_100011249555_100000188321 [0,2,0,0,0,0|2,0,0]=4 32666 B18R2.6482 Oc1cccc(c1)CNCc2cncc(c2)Br 2230a_100000743036_100000738771 [0,2,0,0,0,0|2,0,0]=4 32667 B18R2.6482 Oc1cccc(c1)CNCc2cncc(c2)Br 270004a_100000743036_100000687066 [0,2,0,0,0,0|2,0,0]=4 32668 B18R2.6482 Oc1cccc(c1)CNCc2cncc(c2)Br 270004a_100011249555_100000188321 [0,2,0,0,0,0|2,0,0]=4 32669 B18R2.6482 Oc1cccc(c1)CNCc2cncc(c2)Br 34a_100000743036_100000738771 [0,2,0,0,0,0|2,0,0]=4 32670 B18R2.6482 Oc1cccc(c1)CNCc2cncc(c2)Cl 207a_100000743036_100000088910 [0,2,0,0,0,0|2,0,0]=4 32671 B18R2.6482 Oc1cccc(c1)CNCc2cncc(c2)Cl 207a_200020614424_100000188321 [0,2,0,0,0,0|2,0,0]=4 32672 B18R2.6482 Oc1cccc(c1)CNCc2cncc(c2)Cl 2230a_100000743036_100016992070 [0,2,0,0,0,0|2,0,0]=4 32673 B18R2.6482 Oc1cccc(c1)CNCc2cncc(c2)Cl 2230a_200020614424_100011660834 [0,2,0,0,0,0|2,0,0]=4 32674 B18R2.6482 Oc1cccc(c1)CNCc2cncc(c2)Cl 270004a_100000743036_100000088910 [0,2,0,0,0,0|2,0,0]=4 32675 B18R2.6482 Oc1cccc(c1)CNCc2cncc(c2)Cl 270004a_200020614424_100000188321 [0,2,0,0,0,0|2,0,0]=4 32676 B18R2.6482 Oc1cccc(c1)CNCc2cncc(c2)Cl 34a_100000743036_100016992070 [0,2,0,0,0,0|2,0,0]=4 32677 B18R2.6482 Oc1cccc(c1)CNCc2cncc(c2)F 207a_100000743036_100011361476 [0,2,0,0,0,0|2,0,0]=4 32678 B18R2.6482 Oc1cccc(c1)CNCc2cncc(c2)F 207a_100011962886_100000188321 [0,2,0,0,0,0|2,0,0]=4 32679 B18R2.6482 Oc1cccc(c1)CNCc2cncc(c2)F 2230a_100000743036_100000725299 [0,2,0,0,0,0|2,0,0]=4 32680 B18R2.6482 Oc1cccc(c1)CNCc2cncc(c2)F 2230a_100011962886_100011660834 [0,2,0,0,0,0|2,0,0]=4 32681 B18R2.6482 Oc1cccc(c1)CNCc2cncc(c2)F 270004a_100000743036_100011361476 [0,2,0,0,0,0|2,0,0]=4 32682 B18R2.6482 Oc1cccc(c1)CNCc2cncc(c2)F 270004a_100011962886_100000188321 [0,2,0,0,0,0|2,0,0]=4 32683 B18R2.6482 Oc1cccc(c1)CNCc2cncc(c2)F 34a_100000743036_100000725299 [0,2,0,0,0,0|2,0,0]=4 32684 B18R2.6482 Oc1cccc(c1)CNCc2cncc(c2)F 34a_100011962886_100011660834 [0,2,0,0,0,0|2,0,0]=4 32685 B18R2.6482 Oc1cccc(c1)CNCc2cncc(c2)O 207a_100000743036_100012187055 [0,2,0,0,0,0|2,0,0]=4 32686 B18R2.6482 Oc1cccc(c1)CNCc2cncc(c2)O 270004a_100000743036_100012187055 [0,2,0,0,0,0|2,0,0]=4 32687 B18R2.6482 Oc1cccc(c1)COCc2cc(ccn2)Cl 34a_100000748867_100011660834 [0,2,0,0,0,0|1,0,0]=3 32688 B18R2.6482 Oc1cccc(c1)COCc2cccc(c2)Br 34a_100000687537_100011660834 [0,2,0,0,0,0|0,0,0]=2 32689 B18R2.6482 Oc1cccc(c1)COCc2cccc(c2)Br 7a_100000687537_100000084143 [0,2,0,0,0,0|0,0,0]=2 32690 B18R2.6482 Oc1cccc(c1)COCc2cccc(c2)Cl 34a_100000241301_100011660834 [0,2,0,0,0,0|0,0,0]=2 32691 B18R2.6482 Oc1cccc(c1)COCc2cccc(c2)Cl 7a_100000241301_100000084143 [0,2,0,0,0,0|0,0,0]=2 32692 B18R2.6482 Oc1cccc(c1)COCc2cccc(c2)F 34a_100000210976_100011660834 [0,2,0,0,0,0|0,0,0]=2 32693 B18R2.6482 Oc1cccc(c1)COCc2cccc(c2)F 7a_100000210976_100000084143 [0,2,0,0,0,0|0,0,0]=2 32694 B18R2.6482 Oc1cccc(c1)COCc2cccc(c2)I 34a_100011215336_100011660834 [0,2,0,0,0,0|0,0,0]=2 32695 B18R2.6482 Oc1cccc(c1)COCc2cccc(c2)I 7a_100011215336_100000084143 [0,2,0,0,0,0|0,0,0]=2 32696 B18R2.6482 Oc1cccc(c1)COCc2cccc(n2)Br 34a_100000694195_100011660834 [0,2,0,0,0,0|1,0,0]=3 32697 B18R2.6482 Oc1cccc(c1)COCc2cccc(n2)Cl 34a_100011998359_100011660834 [0,2,0,0,0,0|1,0,0]=3 32698 B18R2.6482 Oc1cccc(c1)COCc2cccc(n2)F 34a_100000086748_100011660834 [0,2,0,0,0,0|1,0,0]=3 32699 B18R2.6482 Oc1cccc(c1)COCc2ccnc(c2)Br 34a_100009814636_100011660834 [0,2,0,0,0,0|1,0,0]=3 32700 B18R2.6482 Oc1cccc(c1)COCc2ccnc(c2)Br 7a_100009814636_100000084143 [0,2,0,0,0,0|1,0,0]=3 32701 B18R2.6482 Oc1cccc(c1)COCc2ccnc(c2)Cl 34a_100000748751_100011660834 [0,2,0,0,0,0|1,0,0]=3 32702 B18R2.6482 Oc1cccc(c1)COCc2ccnc(c2)F 34a_100000082451_100011660834 [0,2,0,0,0,0|1,0,0]=3 32703 B18R2.6482 Oc1cccc(c1)COCc2cncc(c2)Br 34a_100011259137_100011660834 [0,2,0,0,0,0|1,0,0]=3 32704 B18R2.6482 Oc1cccc(c1)COCc2cncc(c2)Br 7a_100011259137_100000084143 [0,2,0,0,0,0|1,0,0]=3 32705 B18R2.6482 Oc1cccc(c1)COCc2cncc(c2)Cl 34a_100000092867_100011660834 [0,2,0,0,0,0|1,0,0]=3 32706 B18R2.6482 Oc1cccc(c1)COCc2cncc(c2)Cl 7a_100000092867_100000084143 [0,2,0,0,0,0|1,0,0]=3 32707 B18R2.6482 Oc1cccc(c1)COCc2cncc(c2)F 34a_100011962875_100011660834 [0,2,0,0,0,0|1,0,0]=3 32708 B18R2.6482 Oc1cccc(c1)COCc2cncc(c2)F 7a_100011962875_100000084143 [0,2,0,0,0,0|1,0,0]=3 32709 B18R2.6482 Oc1cccc(c1)CSCc2cc(ccn2)Br 62a_100010173614_100011660834 [0,2,0,0,0,0|1,1,0]=4 32710 B18R2.6482 Oc1cccc(c1)CSCc2cc(ccn2)Br 62a_100011660834_100010173614 [0,2,0,0,0,0|1,1,0]=4 32711 B18R2.6482 Oc1cccc(c1)CSCc2cc(ccn2)Cl 62a_100011660834_100016988179 [0,2,0,0,0,0|1,1,0]=4 32712 B18R2.6482 Oc1cccc(c1)CSCc2cc(ccn2)Cl 62a_100016988179_100011660834 [0,2,0,0,0,0|1,1,0]=4 32713 B18R2.6482 Oc1cccc(c1)CSCc2cccc(c2)Br 62a_100000211773_100011660834 [0,2,0,0,0,0|0,1,0]=3 32714 B18R2.6482 Oc1cccc(c1)CSCc2cccc(c2)Br 62a_100011660834_100000211773 [0,2,0,0,0,0|0,1,0]=3 32715 B18R2.6482 Oc1cccc(c1)CSCc2cccc(c2)Cl 62a_100000187163_100011660834 [0,2,0,0,0,0|0,1,0]=3 32716 B18R2.6482 Oc1cccc(c1)CSCc2cccc(c2)Cl 62a_100011660834_100000187163 [0,2,0,0,0,0|0,1,0]=3 32717 B18R2.6482 Oc1cccc(c1)CSCc2cccc(c2)F 62a_100000230114_100011660834 [0,2,0,0,0,0|0,1,0]=3 32718 B18R2.6482 Oc1cccc(c1)CSCc2cccc(c2)F 62a_100011660834_100000230114 [0,2,0,0,0,0|0,1,0]=3 32719 B18R2.6482 Oc1cccc(c1)CSCc2cccc(c2)I 62a_100011218688_100011660834 [0,2,0,0,0,0|0,1,0]=3 32720 B18R2.6482 Oc1cccc(c1)CSCc2cccc(c2)I 62a_100011660834_100011218688 [0,2,0,0,0,0|0,1,0]=3 32721 B18R2.6482 Oc1cccc(c1)CSCc2cccc(c2)O 62a_100011660834_100011660834 [0,2,0,0,0,0|0,1,0]=3 32722 B18R2.6482 Oc1cccc(c1)CSCc2cccc(n2)Br 62a_100009889011_100011660834 [0,2,0,0,0,0|1,1,0]=4 32723 B18R2.6482 Oc1cccc(c1)CSCc2cccc(n2)Br 62a_100011660834_100009889011 [0,2,0,0,0,0|1,1,0]=4 32724 B18R2.6482 Oc1cccc(c1)CSCc2cccc(n2)Cl 62a_100000086093_100011660834 [0,2,0,0,0,0|1,1,0]=4 32725 B18R2.6482 Oc1cccc(c1)CSCc2cccc(n2)Cl 62a_100011660834_100000086093 [0,2,0,0,0,0|1,1,0]=4 32726 B18R2.6482 Oc1cccc(c1)CSCc2cccc(n2)F 62a_100009819644_100011660834 [0,2,0,0,0,0|1,1,0]=4 32727 B18R2.6482 Oc1cccc(c1)CSCc2cccc(n2)F 62a_100011660834_100009819644 [0,2,0,0,0,0|1,1,0]=4 32728 B18R2.6482 Oc1cccc(c1)CSCc2ccnc(c2)Br 62a_100010254460_100011660834 [0,2,0,0,0,0|1,1,0]=4 32729 B18R2.6482 Oc1cccc(c1)CSCc2ccnc(c2)Br 62a_100011660834_100010243470 [0,2,0,0,0,0|1,1,0]=4 32730 B18R2.6482 Oc1cccc(c1)CSCc2ccnc(c2)Cl 62a_100000764220_100011660834 [0,2,0,0,0,0|1,1,0]=4 32731 B18R2.6482 Oc1cccc(c1)CSCc2ccnc(c2)Cl 62a_100011660834_100000764220 [0,2,0,0,0,0|1,1,0]=4 32732 B18R2.6482 Oc1cccc(c1)CSCc2cncc(c2)Br 62a_100000738771_100011660834 [0,2,0,0,0,0|1,1,0]=4 32733 B18R2.6482 Oc1cccc(c1)CSCc2cncc(c2)Br 62a_100011660834_100000738771 [0,2,0,0,0,0|1,1,0]=4 32734 B18R2.6482 Oc1cccc(c1)CSCc2cncc(c2)Cl 62a_100011660834_100016992070 [0,2,0,0,0,0|1,1,0]=4 32735 B18R2.6482 Oc1cccc(c1)CSCc2cncc(c2)Cl 62a_100016992070_100011660834 [0,2,0,0,0,0|1,1,0]=4 32736 B18R2.6482 Oc1cccc(c1)CSCc2cncc(c2)F 62a_100000725299_100011660834 [0,2,0,0,0,0|1,1,0]=4 32737 B18R2.6482 Oc1cccc(c1)CSCc2cncc(c2)F 62a_100011660834_100000725299 [0,2,0,0,0,0|1,1,0]=4 32738 B18R2.6482 Oc1cccc(c1)NCCc2cccc(c2)Br 34a_100000210217_100011740638 [0,2,0,0,0,0|2,0,0]=4 32739 B18R2.6482 Oc1cccc(c1)NCCc2cccc(c2)Cl 34a_100000210217_100011713710 [0,2,0,0,0,0|2,0,0]=4 32740 B18R2.6482 Oc1cccc(c1)NCCc2cccc(c2)F 34a_100000210217_100011217235 [0,2,0,0,0,0|2,0,0]=4 32741 B18R2.6482 Oc1cccc(c1)SCCc2cccc(c2)Br 62a_100011740638_100000211634 [0,2,0,0,0,0|2,0,0]=4 32742 B18R2.6482 Oc1cccc(c1)SCCc2cccc(c2)Cl 62a_100011713710_100000211634 [0,2,0,0,0,0|2,0,0]=4 32743 B18R2.6482 Oc1cccc(c1)SCCc2cccc(c2)F 62a_100011217235_100000211634 [0,2,0,0,0,0|2,0,0]=4 32744 B18R2.6482 Oc1cncc(c1)CNCc2cccc(c2)Br 207a_100000174977_100012187055 [0,2,0,0,0,0|2,0,0]=4 32745 B18R2.6482 Oc1cncc(c1)CNCc2cccc(c2)Br 270004a_100000174977_100012187055 [0,2,0,0,0,0|2,0,0]=4 32746 B18R2.6482 Oc1cncc(c1)CNCc2cccc(c2)Cl 207a_100000174878_100012187055 [0,2,0,0,0,0|2,0,0]=4 32747 B18R2.6482 Oc1cncc(c1)CNCc2cccc(c2)Cl 270004a_100000174878_100012187055 [0,2,0,0,0,0|2,0,0]=4 32748 B18R2.6482 Oc1cncc(c1)CNCc2cccc(c2)F 207a_100000174948_100012187055 [0,2,0,0,0,0|2,0,0]=4 32749 B18R2.6482 Oc1cncc(c1)CNCc2cccc(c2)F 270004a_100000174948_100012187055 [0,2,0,0,0,0|2,0,0]=4 32750 B18R2.6482 Oc1cncc(c1)CNCc2cccc(c2)I 207a_100000106179_100012187055 [0,2,0,0,0,0|2,0,0]=4 32751 B18R2.6482 Oc1cncc(c1)CNCc2cccc(c2)I 270004a_100000106179_100012187055 [0,2,0,0,0,0|2,0,0]=4 32752 B18R2.6482 [O-][n+]1cccc(c1)COCc2cc(ccn2)Br 34a_100000037817_100010173614 [0,2,0,0,0,0|2,0,0]=4 32753 B18R2.6482 [O-][n+]1cccc(c1)COCc2cc(ccn2)Br 7a_100000037817_100010173614 [0,2,0,0,0,0|2,0,0]=4 32754 B18R2.6482 [O-][n+]1cccc(c1)COCc2cc(ccn2)Cl 34a_100000037817_100016988179 [0,2,0,0,0,0|2,0,0]=4 32755 B18R2.6482 [O-][n+]1cccc(c1)COCc2cc(ccn2)Cl 7a_100000037817_100016988179 [0,2,0,0,0,0|2,0,0]=4 32756 B18R2.6482 [O-][n+]1cccc(c1)COCc2cccc(c2)Br 34a_100000037817_100000698116 [0,2,0,0,0,0|1,0,0]=3 32757 B18R2.6482 [O-][n+]1cccc(c1)COCc2cccc(c2)Br 7a_100000037817_100000211773 [0,2,0,0,0,0|1,0,0]=3 32758 B18R2.6482 [O-][n+]1cccc(c1)COCc2cccc(c2)Cl 34a_100000037817_100000187163 [0,2,0,0,0,0|1,0,0]=3 32759 B18R2.6482 [O-][n+]1cccc(c1)COCc2cccc(c2)Cl 7a_100000037817_100000187163 [0,2,0,0,0,0|1,0,0]=3 32760 B18R2.6482 [O-][n+]1cccc(c1)COCc2cccc(c2)F 34a_100000037817_100000187166 [0,2,0,0,0,0|1,0,0]=3 32761 B18R2.6482 [O-][n+]1cccc(c1)COCc2cccc(c2)F 7a_100000037817_100000230114 [0,2,0,0,0,0|1,0,0]=3 32762 B18R2.6482 [O-][n+]1cccc(c1)COCc2cccc(c2)I 34a_100000037817_100011218688 [0,2,0,0,0,0|1,0,0]=3 32763 B18R2.6482 [O-][n+]1cccc(c1)COCc2cccc(c2)I 7a_100000037817_100011218688 [0,2,0,0,0,0|1,0,0]=3 32764 B18R2.6482 [O-][n+]1cccc(c1)COCc2cccc(c2)O 34a_100000037817_100011660834 [0,2,0,0,0,0|1,0,0]=3 32765 B18R2.6482 [O-][n+]1cccc(c1)COCc2cccc(c2)O 7a_100000037817_100000084143 [0,2,0,0,0,0|1,0,0]=3 32766 B18R2.6482 [O-][n+]1cccc(c1)COCc2cccc(n2)Br 34a_100000037817_100009889011 [0,2,0,0,0,0|2,0,0]=4 32767 B18R2.6482 [O-][n+]1cccc(c1)COCc2cccc(n2)Br 7a_100000037817_100009889011 [0,2,0,0,0,0|2,0,0]=4 32768 B18R2.6482 [O-][n+]1cccc(c1)COCc2cccc(n2)Cl 34a_100000037817_100000086093 [0,2,0,0,0,0|2,0,0]=4 32769 B18R2.6482 [O-][n+]1cccc(c1)COCc2cccc(n2)Cl 7a_100000037817_100000086093 [0,2,0,0,0,0|2,0,0]=4 32770 B18R2.6482 [O-][n+]1cccc(c1)COCc2cccc(n2)F 34a_100000037817_100009819644 [0,2,0,0,0,0|2,0,0]=4 32771 B18R2.6482 [O-][n+]1cccc(c1)COCc2cccc(n2)F 7a_100000037817_100009819644 [0,2,0,0,0,0|2,0,0]=4 32772 B18R2.6482 [O-][n+]1cccc(c1)COCc2ccnc(c2)Br 34a_100000037817_100010243470 [0,2,0,0,0,0|2,0,0]=4 32773 B18R2.6482 [O-][n+]1cccc(c1)COCc2ccnc(c2)Br 7a_100000037817_100010254460 [0,2,0,0,0,0|2,0,0]=4 32774 B18R2.6482 [O-][n+]1cccc(c1)COCc2ccnc(c2)Cl 34a_100000037817_100000764220 [0,2,0,0,0,0|2,0,0]=4 32775 B18R2.6482 [O-][n+]1cccc(c1)COCc2ccnc(c2)Cl 7a_100000037817_100000764220 [0,2,0,0,0,0|2,0,0]=4 32776 B18R2.6482 [O-][n+]1cccc(c1)COCc2cncc(c2)Br 34a_100000037817_100000738771 [0,2,0,0,0,0|2,0,0]=4 32777 B18R2.6482 [O-][n+]1cccc(c1)COCc2cncc(c2)Br 7a_100000037817_100000738771 [0,2,0,0,0,0|2,0,0]=4 32778 B18R2.6482 [O-][n+]1cccc(c1)COCc2cncc(c2)Cl 34a_100000037817_100016992070 [0,2,0,0,0,0|2,0,0]=4 32779 B18R2.6482 [O-][n+]1cccc(c1)COCc2cncc(c2)Cl 7a_100000037817_100016992070 [0,2,0,0,0,0|2,0,0]=4 32780 B18R2.6482 [O-][n+]1cccc(c1)COCc2cncc(c2)F 34a_100000037817_100000725299 [0,2,0,0,0,0|2,0,0]=4 32781 B18R2.6482 [O-][n+]1cccc(c1)COCc2cncc(c2)F 7a_100000037817_100000725299 [0,2,0,0,0,0|2,0,0]=4 32782 B18R2.6482 [S]c1cccc(c1)SCCc2cccc(c2)Br 62a_100011740638_114929384022 [0,2,0,0,0,0|2,0,0]=4 32783 B18R2.6482 [S]c1cccc(c1)SCCc2cccc(c2)Br 62a_114929384022_100011740638 [0,2,0,0,0,0|2,0,0]=4 32784 B18R2.6482 [S]c1cccc(c1)SCCc2cccc(c2)Cl 62a_100011713710_114929384022 [0,2,0,0,0,0|2,0,0]=4 32785 B18R2.6482 [S]c1cccc(c1)SCCc2cccc(c2)Cl 62a_114929384022_100011713710 [0,2,0,0,0,0|2,0,0]=4 32786 B16R2.172 C=Cc1ccccc1Cc2ccccc2 271570a_100011290941_200011216382 [0,0,1,1,0,0|1,0,1]=4 32787 B16R2.2257 c1ccc(cc1)COCCc2cccs2 34a_100000210790_100000748579 [0,0,1,1,0,0|1,0,1]=4 32788 B16R2.2257 c1ccc(cc1)COCCc2cccs2 34a_100011216825_100015291786 [0,0,1,1,0,0|1,0,1]=4 32789 B16R2.2257 c1ccc(cc1)COCCc2cccs2 7a_100000210790_100000748579 [0,0,1,1,0,0|1,0,1]=4 32790 B16R2.2257 c1ccc(cc1)COCCc2cccs2 7a_100011216825_100000211182 [0,0,1,1,0,0|1,0,1]=4 32791 B16R2.2257 c1ccc(cc1)COCCc2ccsc2 34a_100000748821_100015291786 [0,0,1,1,0,0|1,0,1]=4 32792 B16R2.2257 c1ccc(cc1)COCCn2cccc2 34a_100000179382_100015291786 [0,0,1,1,0,0|1,0,1]=4 32793 B16R2.2257 c1ccc(cc1)COCCn2cccc2 7a_100000210790_200000035178 [0,0,1,1,0,0|1,0,1]=4 32794 B16R2.2257 c1ccc(cc1)COCOc2ccsc2 34a_100000106738_100000763385 [0,0,1,1,0,0|2,0,0]=4 32795 B16R2.2257 c1ccc(cc1)COCSc2ccco2 62a_100000763385_100009814098 [0,0,1,1,0,0|2,0,0]=4 32796 B16R2.2257 c1ccc(cc1)COCSc2ccco2 62a_100009814098_100000763385 [0,0,1,1,0,0|2,0,0]=4 32797 B16R2.2257 c1ccc(cc1)COCSc2cccs2 62a_100000763385_100011215356 [0,0,1,1,0,0|2,0,0]=4 32798 B16R2.2257 c1ccc(cc1)COCSc2cccs2 62a_100011215356_100000763385 [0,0,1,1,0,0|2,0,0]=4 32799 B16R2.2257 c1ccc(cc1)COCSc2ccoc2 62a_100000763385_100011215275 [0,0,1,1,0,0|2,0,0]=4 32800 B16R2.2257 c1ccc(cc1)COCSc2ccoc2 62a_100011215275_100000763385 [0,0,1,1,0,0|2,0,0]=4 32801 B16R2.2257 c1ccc(cc1)COCSc2ccsc2 62a_100000738268_100000763385 [0,0,1,1,0,0|2,0,0]=4 32802 B16R2.2257 c1ccc(cc1)COCSc2ccsc2 62a_100000763385_100000738268 [0,0,1,1,0,0|2,0,0]=4 32803 B16R2.23 C=Cc1ccc[n+](c1)Cc2ccccc2 271570a_100011290941_200009812568 [0,0,1,1,0,0|1,0,1]=4 32804 B18R3.2098 c1ccc(cc1)SC2CCc3c2cccc3 62a_100000719477_200000721974 [0,0,0,1,0,1|1,0,0]=3 32805 B18R3.2098 c1ccc(nc1)SC2CCc3c2cccc3 62a_100011216584_200000721974 [0,0,0,1,0,1|2,0,0]=4 32806 B18R3.2098 c1ccc2c(c1)CCC2Sc3ccncc3 62a_100000728582_200000721974 [0,0,0,1,0,1|2,0,0]=4 32807 B18R3.2098 c1cncc(c1)SC2CCc3c2cccc3 62a_100000210063_200000721974 [0,0,0,1,0,1|2,0,0]=4 32808 B18R3.2100 c1ccc(cc1)COC2Cc3c2cccc3 7a_100000210790_100009813401 [0,0,0,1,0,1|0,0,0]=2 32809 B18R3.2100 c1ccc(cc1)CSC2Cc3c2cccc3 62a_100000211182_100009813401 [0,0,0,1,0,1|0,1,0]=3 32810 B18R3.2100 c1ccc(cc1)CSC2Cc3c2cccc3 62a_100009813401_100015291786 [0,0,0,1,0,1|0,1,0]=3 32811 B18R3.2100 c1ccc(cc1)NN=C2Cc3c2cccc3 4a_100015195140_100000051409 [0,0,0,1,0,1|2,0,0]=4 32812 B18R3.2100 c1ccc(nc1)CSC2Cc3c2cccc3 62a_100000721315_100009813401 [0,0,0,1,0,1|1,1,0]=4 32813 B18R3.2100 c1ccc(nc1)CSC2Cc3c2cccc3 62a_100009813401_100000721315 [0,0,0,1,0,1|1,1,0]=4 32814 B18R3.2100 c1ccc2c(c1)CC2SCc3ccncc3 62a_100009813401_100015193705 [0,0,0,1,0,1|1,1,0]=4 32815 B18R3.2100 c1ccc2c(c1)CC2SCc3ccncc3 62a_100015193705_100009813401 [0,0,0,1,0,1|1,1,0]=4 32816 B18R3.2100 c1cncc(c1)CSC2Cc3c2cccc3 62a_100000741622_100009813401 [0,0,0,1,0,1|1,1,0]=4 32817 B18R3.2100 c1cncc(c1)CSC2Cc3c2cccc3 62a_100009813401_100000741622 [0,0,0,1,0,1|1,1,0]=4 32818 B18R3.12875 c1ccc(cc1)CN2Cc3ccccc3C2 2230a_100000752595_100015291786 [0,1,0,1,0,0|1,0,0]=3 32819 B18R3.12875 c1ccc(cc1)CN2Cc3ccccc3C2 269982a_100000752595_100000211182 [0,1,0,1,0,0|1,0,0]=3 32820 B18R3.12875 c1ccc(cc1)CN2Cc3ccccc3C2 270004a_100000752595_100015611070 [0,1,0,1,0,0|1,0,0]=3 32821 B18R3.12875 c1ccc(cc1)CN2Cc3ccccc3C2 34a_100000752595_100015291786 [0,1,0,1,0,0|1,0,0]=3 32822 B18R3.12875 c1ccc(cc1)CN2Cc3cccnc3C2 269982a_100000726175_100000211182 [0,1,0,1,0,0|2,0,0]=4 32823 B18R3.12875 c1ccc(cc1)CN2Cc3cccnc3C2 270004a_100000726175_100015611070 [0,1,0,1,0,0|2,0,0]=4 32824 B18R3.12875 c1ccc(cc1)CN2Cc3ccncc3C2 2230a_100000730608_100015291786 [0,1,0,1,0,0|2,0,0]=4 32825 B18R3.12875 c1ccc(cc1)CN2Cc3ccncc3C2 269982a_100000730608_100000211182 [0,1,0,1,0,0|2,0,0]=4 32826 B18R3.12875 c1ccc(cc1)NC2Cc3ccccc3C2 34a_100000106764_100000753484 [0,1,0,1,0,0|2,0,0]=4 32827 B18R3.12875 c1ccc(cc1)OC2Cc3ccccc3C2 34a_100000210340_100000753484 [0,1,0,1,0,0|2,0,0]=4 32828 B18R3.12875 c1ccc(cc1)OC2Cc3ccccc3C2 7a_100000210340_100000753484 [0,1,0,1,0,0|2,0,0]=4 32829 B18R3.12875 c1ccc(cc1)SC2Cc3ccccc3C2 62a_100000719477_100000753484 [0,1,0,1,0,0|2,0,0]=4 32830 B18R3.12875 c1ccc(nc1)CN2Cc3ccccc3C2 2230a_100000752595_100000721315 [0,1,0,1,0,0|2,0,0]=4 32831 B18R3.12875 c1ccc(nc1)CN2Cc3ccccc3C2 269982a_100000752595_100000721315 [0,1,0,1,0,0|2,0,0]=4 32832 B18R3.12875 c1ccc(nc1)CN2Cc3ccccc3C2 270004a_100000752595_100000209966 [0,1,0,1,0,0|2,0,0]=4 32833 B18R3.12875 c1ccc(nc1)CN2Cc3ccccc3C2 34a_100000752595_100000721315 [0,1,0,1,0,0|2,0,0]=4 32834 B18R3.12875 c1ccc2c(c1)CN(C2)Cc3ccncc3 2230a_100000752595_100015193705 [0,1,0,1,0,0|2,0,0]=4 32835 B18R3.12875 c1ccc2c(c1)CN(C2)Cc3ccncc3 269982a_100000752595_100015193705 [0,1,0,1,0,0|2,0,0]=4 32836 B18R3.12875 c1cncc(c1)CN2Cc3ccccc3C2 2230a_100000752595_100000741622 [0,1,0,1,0,0|2,0,0]=4 32837 B18R3.12875 c1cncc(c1)CN2Cc3ccccc3C2 269982a_100000752595_100000733263 [0,1,0,1,0,0|2,0,0]=4 32838 B18R3.12875 c1cncc(c1)CN2Cc3ccccc3C2 270004a_100000752595_100000209961 [0,1,0,1,0,0|2,0,0]=4 32839 B18R3.12875 c1cncc(c1)CN2Cc3ccccc3C2 34a_100000752595_100000733263 [0,1,0,1,0,0|2,0,0]=4 32840 B18R3.8952 Brc1ccc(cc1)OC2Cc3c2cccc3 7a_100000185759_100009813401 [0,1,0,1,0,0|2,0,0]=4 32841 B18R3.8952 Brc1ccc(cc1)SC2Cc3c2cccc3 62a_100000752885_100009813401 [0,1,0,1,0,0|2,0,0]=4 32842 B18R3.8952 Brc1ccc(cc1)SC2Cc3c2cccc3 62a_100009813401_100000752885 [0,1,0,1,0,0|2,0,0]=4 32843 B18R3.8952 Cc1ccc(cc1)OC2Cc3c2cccc3 7a_100000210336_100009813401 [0,1,0,1,0,0|2,0,0]=4 32844 B18R3.8952 Cc1ccc(cc1)SC2Cc3c2cccc3 62a_100000186775_100009813401 [0,1,0,1,0,0|2,0,0]=4 32845 B18R3.8952 Cc1ccc(cc1)SC2Cc3c2cccc3 62a_100009813401_100000186775 [0,1,0,1,0,0|2,0,0]=4 32846 B18R3.8952 Clc1ccc(cc1)OC2Cc3c2cccc3 7a_100000210216_100009813401 [0,1,0,1,0,0|2,0,0]=4 32847 B18R3.8952 Clc1ccc(cc1)SC2Cc3c2cccc3 62a_100000755918_100009813401 [0,1,0,1,0,0|2,0,0]=4 32848 B18R3.8952 Clc1ccc(cc1)SC2Cc3c2cccc3 62a_100009813401_100000755918 [0,1,0,1,0,0|2,0,0]=4 32849 B18R3.8952 Fc1ccc(cc1)SC2Cc3c2cccc3 62a_100000211213_100009813401 [0,1,0,1,0,0|2,0,0]=4 32850 B18R3.8952 Fc1ccc(cc1)SC2Cc3c2cccc3 62a_100009813401_100000211213 [0,1,0,1,0,0|2,0,0]=4 32851 B18R3.8952 Ic1ccc(cc1)OC2Cc3c2cccc3 7a_100000212066_100009813401 [0,1,0,1,0,0|2,0,0]=4 32852 B18R3.8952 Nc1ccc(cc1)SC2Cc3c2cccc3 62a_100000185761_100009813401 [0,1,0,1,0,0|2,0,0]=4 32853 B18R3.8952 Nc1ccc(cc1)SC2Cc3c2cccc3 62a_100009813401_100000185761 [0,1,0,1,0,0|2,0,0]=4 32854 B18R3.8952 Oc1ccc(cc1)SC2Cc3c2cccc3 62a_100009813401_100000185759 [0,1,0,1,0,0|2,0,0]=4 32855 B18R3.14499 CN(c1ccccc1)C2Cc3c2cccc3 269982a_100000210012_100009813401 [0,1,0,1,0,0|2,0,0]=4 32856 B18R3.6528 Brc1ccccc1OC2Cc3c2cccc3 7a_100000181306_100009813401 [0,1,0,1,0,0|2,0,0]=4 32857 B18R3.6528 Brc1ccccc1SC2Cc3c2cccc3 62a_100000695589_100009813401 [0,1,0,1,0,0|2,0,0]=4 32858 B18R3.6528 Brc1ccccc1SC2Cc3c2cccc3 62a_100009813401_100000695589 [0,1,0,1,0,0|2,0,0]=4 32859 B18R3.6528 Cc1ccccc1OC2Cc3c2cccc3 7a_100000210338_100009813401 [0,1,0,1,0,0|2,0,0]=4 32860 B18R3.6528 Cc1ccccc1SC2Cc3c2cccc3 62a_100000210755_100009813401 [0,1,0,1,0,0|2,0,0]=4 32861 B18R3.6528 Cc1ccccc1SC2Cc3c2cccc3 62a_100009813401_100000210755 [0,1,0,1,0,0|2,0,0]=4 32862 B18R3.6528 Clc1ccccc1OC2Cc3c2cccc3 7a_100000210172_100009813401 [0,1,0,1,0,0|2,0,0]=4 32863 B18R3.6528 Clc1ccccc1SC2Cc3c2cccc3 62a_100000764095_100009813401 [0,1,0,1,0,0|2,0,0]=4 32864 B18R3.6528 Clc1ccccc1SC2Cc3c2cccc3 62a_100009813401_100000764095 [0,1,0,1,0,0|2,0,0]=4 32865 B18R3.6528 Fc1ccccc1OC2Cc3c2cccc3 7a_100000210171_100009813401 [0,1,0,1,0,0|2,0,0]=4 32866 B18R3.6528 Fc1ccccc1SC2Cc3c2cccc3 62a_100009813401_100011215700 [0,1,0,1,0,0|2,0,0]=4 32867 B18R3.6528 Fc1ccccc1SC2Cc3c2cccc3 62a_100011215700_100009813401 [0,1,0,1,0,0|2,0,0]=4 32868 B18R3.6528 Ic1ccccc1OC2Cc3c2cccc3 7a_100000739446_100009813401 [0,1,0,1,0,0|2,0,0]=4 32869 B18R3.6528 Nc1ccccc1OC2Cc3c2cccc3 7a_100000185747_100009813401 [0,1,0,1,0,0|2,0,0]=4 32870 B18R3.6528 Nc1ccccc1SC2Cc3c2cccc3 62a_100000210017_100009813401 [0,1,0,1,0,0|2,0,0]=4 32871 B18R3.6528 Nc1ccccc1SC2Cc3c2cccc3 62a_100009813401_100000210017 [0,1,0,1,0,0|2,0,0]=4 32872 B18R3.6528 Oc1ccccc1SC2Cc3c2cccc3 62a_100000739446_100009813401 [0,1,0,1,0,0|2,0,0]=4 32873 B18R3.6528 Oc1ccccc1SC2Cc3c2cccc3 62a_100009813401_100000739446 [0,1,0,1,0,0|2,0,0]=4 32874 B18R3.3023 Brc1cccc(c1)OC2Cc3c2cccc3 7a_100000210342_100009813401 [0,1,0,1,0,0|2,0,0]=4 32875 B18R3.3023 Brc1cccc(c1)SC2Cc3c2cccc3 62a_100000691529_100009813401 [0,1,0,1,0,0|2,0,0]=4 32876 B18R3.3023 Brc1cccc(c1)SC2Cc3c2cccc3 62a_100009813401_100000691529 [0,1,0,1,0,0|2,0,0]=4 32877 B18R3.3023 Cc1cccc(c1)OC2Cc3c2cccc3 7a_100000210337_100009813401 [0,1,0,1,0,0|2,0,0]=4 32878 B18R3.3023 Cc1cccc(c1)SC2Cc3c2cccc3 62a_100009813401_100011215228 [0,1,0,1,0,0|2,0,0]=4 32879 B18R3.3023 Cc1cccc(c1)SC2Cc3c2cccc3 62a_100011215228_100009813401 [0,1,0,1,0,0|2,0,0]=4 32880 B18R3.3023 Clc1cccc(c1)OC2Cc3c2cccc3 7a_100000210295_100009813401 [0,1,0,1,0,0|2,0,0]=4 32881 B18R3.3023 Clc1cccc(c1)SC2Cc3c2cccc3 62a_100000699651_100009813401 [0,1,0,1,0,0|2,0,0]=4 32882 B18R3.3023 Clc1cccc(c1)SC2Cc3c2cccc3 62a_100009813401_100000699651 [0,1,0,1,0,0|2,0,0]=4 32883 B18R3.3023 Fc1cccc(c1)OC2Cc3c2cccc3 7a_100000210426_100009813401 [0,1,0,1,0,0|2,0,0]=4 32884 B18R3.3023 Fc1cccc(c1)SC2Cc3c2cccc3 62a_100000685547_100009813401 [0,1,0,1,0,0|2,0,0]=4 32885 B18R3.3023 Fc1cccc(c1)SC2Cc3c2cccc3 62a_100009813401_100000685547 [0,1,0,1,0,0|2,0,0]=4 32886 B18R3.3023 Ic1cccc(c1)OC2Cc3c2cccc3 7a_100000211634_100009813401 [0,1,0,1,0,0|2,0,0]=4 32887 B18R3.3023 Nc1cccc(c1)SC2Cc3c2cccc3 62a_100000210019_100009813401 [0,1,0,1,0,0|2,0,0]=4 32888 B18R3.3023 Nc1cccc(c1)SC2Cc3c2cccc3 62a_100009813401_100000210019 [0,1,0,1,0,0|2,0,0]=4 32889 B18R3.3023 Oc1cccc(c1)SC2Cc3c2cccc3 62a_100009813401_100000211634 [0,1,0,1,0,0|2,0,0]=4 32890 B18R3.3023 [S]c1cccc(c1)SC2Cc3c2cccc3 62a_100009813401_114929384022 [0,1,0,1,0,0|2,0,0]=4 32891 B18R3.3023 [S]c1cccc(c1)SC2Cc3c2cccc3 62a_114929384022_100009813401 [0,1,0,1,0,0|2,0,0]=4 32892 B14R1.156 C=CC=CC(=O)CCc1ccccc1 1458a_100016291481_100000765856 [0,0,1,0,1,0|1,0,0]=3 32893 B14R1.156 C=CC=CC(=O)CCc1ccccn1 1458a_100016291481_100015183660 [0,0,1,0,1,0|2,0,0]=4 32894 B14R1.156 C=CC=CC(=O)CCc1cccnc1 1458a_100016291481_200011713674 [0,0,1,0,1,0|2,0,0]=4 32895 B14R1.156 C=CC=CC(=O)CCc1ccncc1 1458a_100016291481_100000723409 [0,0,1,0,1,0|2,0,0]=4 32896 B14R1.156 C=CC=CC(=O)NCc1ccccc1 1626a_100015324214_100016291481 [0,0,1,0,1,0|2,0,0]=4 32897 B14R1.979 C=CCC(C=C)OCc1ccccc1 34a_100000038011_100015291786 [0,0,1,0,1,0|0,0,2]=4 32898 B14R1.979 C=CCC(C=C)OCc1ccccc1 7a_100000038011_100000211182 [0,0,1,0,1,0|0,0,2]=4 32899 B14R2.6 c1ccc(cc1)Sc2ccccc2 62a_100000719477_100000041952 [0,0,0,0,2,0|0,1,0]=3 32900 B14R2.6 c1ccc(cc1)Sc2ccccn2 62a_100000719477_100011216584 [0,0,0,0,2,0|1,1,0]=4 32901 B14R2.6 c1ccc(cc1)Sc2ccccn2 62a_100011216584_100000041952 [0,0,0,0,2,0|1,1,0]=4 32902 B14R2.6 c1ccc(cc1)Sc2cccnc2 62a_100000210063_100000041952 [0,0,0,0,2,0|1,1,0]=4 32903 B14R2.6 c1ccc(cc1)Sc2cccnc2 62a_100000719477_100000210063 [0,0,0,0,2,0|1,1,0]=4 32904 B14R2.6 c1ccc(cc1)Sc2ccncc2 62a_100000719477_100000728582 [0,0,0,0,2,0|1,1,0]=4 32905 B14R2.6 c1ccc(cc1)Sc2ccncc2 62a_100000728582_100000041952 [0,0,0,0,2,0|1,1,0]=4 32906 B14R2.101 c1cc(ccn1)COc2ccsc2 7a_100000106738_100015193705 [0,0,0,0,2,0|2,0,0]=4 32907 B14R2.101 c1cc(ccn1)OCc2ccsc2 34a_100000212176_100011261437 [0,0,0,0,2,0|2,0,0]=4 32908 B14R2.101 c1ccc(cc1)COc2ccsc2 34a_100000106738_100015291786 [0,0,0,0,2,0|1,0,0]=3 32909 B14R2.101 c1ccc(cc1)COc2ccsc2 7a_100000106738_100000211182 [0,0,0,0,2,0|1,0,0]=3 32910 B14R2.101 c1ccc(cc1)CSc2ccco2 62a_100000211182_100009814098 [0,0,0,0,2,0|1,1,0]=4 32911 B14R2.101 c1ccc(cc1)CSc2ccco2 62a_100009814098_100015291786 [0,0,0,0,2,0|1,1,0]=4 32912 B14R2.101 c1ccc(cc1)CSc2cccs2 62a_100000211182_100011215356 [0,0,0,0,2,0|1,1,0]=4 32913 B14R2.101 c1ccc(cc1)CSc2cccs2 62a_100011215356_100015291786 [0,0,0,0,2,0|1,1,0]=4 32914 B14R2.101 c1ccc(cc1)CSc2ccoc2 62a_100000211182_100011215275 [0,0,0,0,2,0|1,1,0]=4 32915 B14R2.101 c1ccc(cc1)CSc2ccoc2 62a_100011215275_100015291786 [0,0,0,0,2,0|1,1,0]=4 32916 B14R2.101 c1ccc(cc1)CSc2ccsc2 62a_100000211182_100000738268 [0,0,0,0,2,0|1,1,0]=4 32917 B14R2.101 c1ccc(cc1)CSc2ccsc2 62a_100000738268_100015291786 [0,0,0,0,2,0|1,1,0]=4 32918 B14R2.101 c1ccc(cc1)NCc2ccco2 207a_100000106764_100000186105 [0,0,0,0,2,0|2,0,0]=4 32919 B14R2.101 c1ccc(cc1)NCc2ccco2 270302a_100000106764_100000186105 [0,0,0,0,2,0|2,0,0]=4 32920 B14R2.101 c1ccc(cc1)NCc2cccs2 207a_100000106764_100000209959 [0,0,0,0,2,0|2,0,0]=4 32921 B14R2.101 c1ccc(cc1)NCc2cccs2 270302a_100000106764_100000209959 [0,0,0,0,2,0|2,0,0]=4 32922 B14R2.101 c1ccc(cc1)NCc2ccoc2 207a_100000106764_100011215517 [0,0,0,0,2,0|2,0,0]=4 32923 B14R2.101 c1ccc(cc1)NCc2ccsc2 207a_100000106764_100000188534 [0,0,0,0,2,0|2,0,0]=4 32924 B14R2.101 c1ccc(cc1)NCc2ccsc2 270302a_100000106764_100000188534 [0,0,0,0,2,0|2,0,0]=4 32925 B14R2.101 c1ccc(cc1)NCc2ccsc2 34a_100000106764_100011261437 [0,0,0,0,2,0|2,0,0]=4 32926 B14R2.101 c1ccc(cc1)OCc2c[nH]cn2 34a_100000210340_100000707719 [0,0,0,0,2,0|2,0,0]=4 32927 B14R2.101 c1ccc(cc1)OCc2ccn[nH]2 34a_100000210340_100000728653 [0,0,0,0,2,0|2,0,0]=4 32928 B14R2.101 c1ccc(cc1)OCc2ccn[nH]2 7a_100000210340_100000728653 [0,0,0,0,2,0|2,0,0]=4 32929 B14R2.101 c1ccc(cc1)OCc2ccon2 34a_100000210340_100000234950 [0,0,0,0,2,0|2,0,0]=4 32930 B14R2.101 c1ccc(cc1)OCc2ccon2 7a_100000210340_100000234950 [0,0,0,0,2,0|2,0,0]=4 32931 B14R2.101 c1ccc(cc1)OCc2ccsc2 34a_100000210340_100011261437 [0,0,0,0,2,0|1,0,0]=3 32932 B14R2.101 c1ccc(cc1)OCc2ccsc2 7a_100000210340_100011261437 [0,0,0,0,2,0|1,0,0]=3 32933 B14R2.101 c1ccc(cc1)OCc2cncs2 34a_100000210340_100015185245 [0,0,0,0,2,0|2,0,0]=4 32934 B14R2.101 c1ccc(cc1)OCc2cncs2 7a_100000210340_100015185245 [0,0,0,0,2,0|2,0,0]=4 32935 B14R2.101 c1ccc(cc1)OCc2cscn2 34a_100000210340_100000205941 [0,0,0,0,2,0|2,0,0]=4 32936 B14R2.101 c1ccc(cc1)OCc2cscn2 7a_100000210340_100000205941 [0,0,0,0,2,0|2,0,0]=4 32937 B14R2.101 c1ccc(cc1)OCc2ncc[nH]2 34a_100000210340_100016991755 [0,0,0,0,2,0|2,0,0]=4 32938 B14R2.101 c1ccc(cc1)OCc2ncc[nH]2 7a_100000210340_100000753453 [0,0,0,0,2,0|2,0,0]=4 32939 B14R2.101 c1ccc(cc1)OCc2ncco2 34a_100000210340_103436540062 [0,0,0,0,2,0|2,0,0]=4 32940 B14R2.101 c1ccc(cc1)OCc2ncco2 7a_100000210340_103436540062 [0,0,0,0,2,0|2,0,0]=4 32941 B14R2.101 c1ccc(cc1)OCc2nccs2 34a_100000210340_100015184050 [0,0,0,0,2,0|2,0,0]=4 32942 B14R2.101 c1ccc(cc1)OCc2nccs2 7a_100000210340_100015184050 [0,0,0,0,2,0|2,0,0]=4 32943 B14R2.101 c1ccc(cc1)SCc2ccsc2 62a_100000719477_100011233845 [0,0,0,0,2,0|1,1,0]=4 32944 B14R2.101 c1ccc(cc1)SCc2ccsc2 62a_100011261437_100000041952 [0,0,0,0,2,0|1,1,0]=4 32945 B14R2.101 c1ccc(nc1)COc2ccsc2 34a_100000106738_100000721315 [0,0,0,0,2,0|2,0,0]=4 32946 B14R2.101 c1ccc(nc1)COc2ccsc2 7a_100000106738_100000721315 [0,0,0,0,2,0|2,0,0]=4 32947 B14R2.101 c1cncc(c1)COc2ccsc2 34a_100000106738_100000733263 [0,0,0,0,2,0|2,0,0]=4 32948 B14R2.101 c1cncc(c1)COc2ccsc2 7a_100000106738_100000741622 [0,0,0,0,2,0|2,0,0]=4 32949 B14R2.101 c1cncc(c1)OCc2ccsc2 34a_100000210849_100011261437 [0,0,0,0,2,0|2,0,0]=4 32950 B14R2.101 c1cncc(c1)OCc2ccsc2 7a_100000210849_100011261437 [0,0,0,0,2,0|2,0,0]=4 32951 B14R2.322 c1cc(co1)COCc2ccsc2 34a_100011215357_100011261437 [0,0,0,0,2,0|2,0,0]=4 32952 B14R2.322 c1cc(cs1)COCc2ccsc2 34a_100011215551_100011261437 [0,0,0,0,2,0|2,0,0]=4 32953 B14R2.322 c1coc(c1)COCc2ccsc2 34a_100000210059_100011261437 [0,0,0,0,2,0|2,0,0]=4 32954 B14R2.322 c1csc(c1)COCc2ccsc2 34a_100000211240_100011261437 [0,0,0,0,2,0|2,0,0]=4 32955 B16R1.146 C=CCC(C=C)OCOCc1ccccc1 34a_100000038011_100000763385 [0,0,1,0,0,1|0,0,2]=4 32956 B18R2.2525 C(#Cc1ccccc1)CNCc2ccccc2 2230a_100015324214_100011352542 [0,0,0,0,0,2|1,0,0]=3 32957 B18R2.2525 C(#Cc1ccccc1)CNCc2ccccc2 34a_100000735379_100015291786 [0,0,0,0,0,2|1,0,0]=3 32958 B18R2.2525 C(#Cc1ccccc1)CNCc2ccccc2 34a_100015324214_100011352542 [0,0,0,0,0,2|1,0,0]=3 32959 B18R2.2525 C(#Cc1ccccc1)CNCc2ccccn2 34a_100000735379_100000721315 [0,0,0,0,0,2|2,0,0]=4 32960 B18R2.2525 C(#Cc1ccccc1)CNCc2cccnc2 34a_100000735379_100000733263 [0,0,0,0,0,2|2,0,0]=4 32961 B18R2.2525 C(#Cc1ccccc1)COCc2ccccc2 34a_100000210790_100011352542 [0,0,0,0,0,2|0,0,0]=2 32962 B18R2.2525 C(#Cc1ccccc1)COCc2ccccc2 34a_100011217464_100015291786 [0,0,0,0,0,2|0,0,0]=2 32963 B18R2.2525 C(#Cc1ccccc1)COCc2ccccc2 7a_100000210790_100011352542 [0,0,0,0,0,2|0,0,0]=2 32964 B18R2.2525 C(#Cc1ccccc1)COCc2ccccc2 7a_100011217464_100000211182 [0,0,0,0,0,2|0,0,0]=2 32965 B18R2.2525 C(#Cc1ccccc1)COCc2ccccn2 34a_100011217464_100000721315 [0,0,0,0,0,2|1,0,0]=3 32966 B18R2.2525 C(#Cc1ccccc1)COCc2ccccn2 7a_100011217464_100000721315 [0,0,0,0,0,2|1,0,0]=3 32967 B18R2.2525 C(#Cc1ccccc1)COCc2cccnc2 34a_100011217464_100000733263 [0,0,0,0,0,2|1,0,0]=3 32968 B18R2.2525 C(#Cc1ccccc1)COCc2cccnc2 7a_100011217464_100000741622 [0,0,0,0,0,2|1,0,0]=3 32969 B18R2.2525 C(#Cc1ccccc1)COCc2cccnn2 34a_100011217464_100016990269 [0,0,0,0,0,2|2,0,0]=4 32970 B18R2.2525 C(#Cc1ccccc1)COCc2cccnn2 7a_100011217464_100016990269 [0,0,0,0,0,2|2,0,0]=4 32971 B18R2.2525 C(#Cc1ccccc1)COCc2ccncc2 7a_100011217464_100015193705 [0,0,0,0,0,2|1,0,0]=3 32972 B18R2.2525 C(#Cc1ccccc1)COCc2cnccn2 34a_100011217464_100016995436 [0,0,0,0,0,2|2,0,0]=4 32973 B18R2.2525 C(#Cc1ccccc1)COCc2cnccn2 7a_100011217464_100016995436 [0,0,0,0,0,2|2,0,0]=4 32974 B18R2.2525 C(#Cc1ccccc1)COCc2cncnc2 34a_100011217464_100015196519 [0,0,0,0,0,2|2,0,0]=4 32975 B18R2.2525 C(#Cc1ccccc1)COCc2cncnc2 7a_100011217464_100015196519 [0,0,0,0,0,2|2,0,0]=4 32976 B18R2.2525 C(#Cc1ccccc1)COCc2ncccn2 34a_100011217464_100000703007 [0,0,0,0,0,2|2,0,0]=4 32977 B18R2.2525 C(#Cc1ccccc1)COCc2ncccn2 7a_100011217464_100000703007 [0,0,0,0,0,2|2,0,0]=4 32978 B18R2.2525 C(#Cc1ccccc1)CSCc2ccccc2 62a_100000211182_100011352542 [0,0,0,0,0,2|0,1,0]=3 32979 B18R2.2525 C(#Cc1ccccc1)CSCc2ccccn2 62a_100000721315_100011352542 [0,0,0,0,0,2|1,1,0]=4 32980 B18R2.2525 C(#Cc1ccccc1)CSCc2cccnc2 62a_100000741622_100011352542 [0,0,0,0,0,2|1,1,0]=4 32981 B18R2.2525 C(#Cc1ccccc1)CSCc2ccncc2 62a_100015193705_100011352542 [0,0,0,0,0,2|1,1,0]=4 32982 B18R2.2525 C(#Cc1ccccn1)COCc2ccccc2 34a_100011894333_100015291786 [0,0,0,0,0,2|1,0,0]=3 32983 B18R2.2525 C(#Cc1ccccn1)COCc2ccccn2 34a_100011894333_100000721315 [0,0,0,0,0,2|2,0,0]=4 32984 B18R2.2525 C(#Cc1ccccn1)COCc2cccnc2 34a_100011894333_100000733263 [0,0,0,0,0,2|2,0,0]=4 32985 B18R2.2525 C(#Cc1cccnc1)COCc2ccccc2 34a_100011376247_100015291786 [0,0,0,0,0,2|1,0,0]=3 32986 B18R2.2525 C(#Cc1cccnc1)COCc2ccccn2 34a_100011376247_100000721315 [0,0,0,0,0,2|2,0,0]=4 32987 B18R2.2525 C(#Cc1cccnc1)COCc2cccnc2 34a_100011376247_100000733263 [0,0,0,0,0,2|2,0,0]=4 32988 B18R2.2525 C(#Cc1ccncc1)COCc2ccccc2 34a_100011894393_100015291786 [0,0,0,0,0,2|1,0,0]=3 32989 B18R2.2525 C(#Cc1ccncc1)COCc2ccccn2 34a_100011894393_100000721315 [0,0,0,0,0,2|2,0,0]=4 32990 B18R2.2525 C(#Cc1ccncc1)COCc2cccnc2 34a_100011894393_100000733263 [0,0,0,0,0,2|2,0,0]=4 32991 B18R2.2525 C(=C/c1ccccc1)\CNCc2ccccc2 2230a_100015324214_100016265936 [0,0,0,0,0,2|1,0,0]=3 32992 B18R2.2525 C(=C/c1ccccc1)\CNCc2ccccc2 2230a_100020603302_100015291786 [0,0,0,0,0,2|1,0,0]=3 32993 B18R2.2525 C(=C/c1ccccc1)\CNCc2ccccc2 270004a_100020603302_100015611070 [0,0,0,0,0,2|1,0,0]=3 32994 B18R2.2525 C(=C/c1ccccc1)\CNCc2ccccc2 34a_100015324214_100016265936 [0,0,0,0,0,2|1,0,0]=3 32995 B18R2.2525 C(=C/c1ccccc1)\CNCc2ccccc2 34a_100020603302_100015291786 [0,0,0,0,0,2|1,0,0]=3 32996 B18R2.2525 C(=C/c1ccccc1)\CNCc2ccccn2 2230a_100020603302_100000721315 [0,0,0,0,0,2|2,0,0]=4 32997 B18R2.2525 C(=C/c1ccccc1)\CNCc2ccccn2 270004a_100020603302_100000209966 [0,0,0,0,0,2|2,0,0]=4 32998 B18R2.2525 C(=C/c1ccccc1)\CNCc2ccccn2 34a_100020603302_100000721315 [0,0,0,0,0,2|2,0,0]=4 32999 B18R2.2525 C(=C/c1ccccc1)\CNCc2cccnc2 2230a_100020603302_100000741622 [0,0,0,0,0,2|2,0,0]=4 33000 B18R2.2525 C(=C/c1ccccc1)\CNCc2cccnc2 270004a_100020603302_100000209961 [0,0,0,0,0,2|2,0,0]=4 33001 B18R2.2525 C(=C/c1ccccc1)\CNCc2cccnc2 34a_100020603302_100000733263 [0,0,0,0,0,2|2,0,0]=4 33002 B18R2.2525 C(=C/c1ccccc1)\CNCc2ccncc2 2230a_100020603302_100015193705 [0,0,0,0,0,2|2,0,0]=4 33003 B18R2.2525 C(=C/c1ccccc1)\COCc2ccccc2 34a_100000210256_100015291786 [0,0,0,0,0,2|0,0,0]=2 33004 B18R2.2525 C(=C/c1ccccc1)\COCc2ccccc2 34a_100000210790_100016265936 [0,0,0,0,0,2|0,0,0]=2 33005 B18R2.2525 C(=C/c1ccccc1)\COCc2ccccc2 7a_100000210790_100016265936 [0,0,0,0,0,2|0,0,0]=2 33006 B18R2.2525 C(=C/c1ccccc1)\COCc2ccccn2 34a_100000210256_100000721315 [0,0,0,0,0,2|1,0,0]=3 33007 B18R2.2525 C(=C/c1ccccc1)\COCc2cccnc2 34a_100000210256_100000733263 [0,0,0,0,0,2|1,0,0]=3 33008 B18R2.2525 C(=C/c1ccccc1)\COCc2cccnn2 34a_100000210256_100016990269 [0,0,0,0,0,2|2,0,0]=4 33009 B18R2.2525 C(=C/c1ccccc1)\COCc2cnccn2 34a_100000210256_100016995436 [0,0,0,0,0,2|2,0,0]=4 33010 B18R2.2525 C(=C/c1ccccc1)\COCc2cncnc2 34a_100000210256_100015196519 [0,0,0,0,0,2|2,0,0]=4 33011 B18R2.2525 C(=C/c1ccccc1)\COCc2ncccn2 34a_100000210256_100000703007 [0,0,0,0,0,2|2,0,0]=4 33012 B18R2.2525 C(=C/c1ccccc1)\CSCc2ccccc2 62a_100000211182_100016265936 [0,0,0,0,0,2|0,1,0]=3 33013 B18R2.2525 C(=C/c1ccccc1)\CSCc2ccccc2 62a_100016265936_100015291786 [0,0,0,0,0,2|0,1,0]=3 33014 B18R2.2525 C(=C/c1ccccc1)\CSCc2ccccn2 62a_100000721315_100016265936 [0,0,0,0,0,2|1,1,0]=4 33015 B18R2.2525 C(=C/c1ccccc1)\CSCc2ccccn2 62a_100016265936_100000721315 [0,0,0,0,0,2|1,1,0]=4 33016 B18R2.2525 C(=C/c1ccccc1)\CSCc2cccnc2 62a_100000741622_100016265936 [0,0,0,0,0,2|1,1,0]=4 33017 B18R2.2525 C(=C/c1ccccc1)\CSCc2cccnc2 62a_100016265936_100000741622 [0,0,0,0,0,2|1,1,0]=4 33018 B18R2.2525 C(=C/c1ccccc1)\CSCc2ccncc2 62a_100015193705_100016265936 [0,0,0,0,0,2|1,1,0]=4 33019 B18R2.2525 C(=C/c1ccccc1)\CSCc2ccncc2 62a_100016265936_100015193705 [0,0,0,0,0,2|1,1,0]=4 33020 B18R2.2525 C(=C/c1cccnc1)\COCc2ccccc2 34a_200102594124_100015291786 [0,0,0,0,0,2|1,0,0]=3 33021 B18R2.2525 C(=C/c1cccnc1)\COCc2ccccn2 34a_200102594124_100000721315 [0,0,0,0,0,2|2,0,0]=4 33022 B18R2.2525 C(=C/c1cccnc1)\COCc2cccnc2 34a_200102594124_100000733263 [0,0,0,0,0,2|2,0,0]=4 33023 B18R2.2525 C(=Cc1ccccc1)CNCc2ccccc2 270004a_100015324214_100000210105 [0,0,0,0,0,2|1,0,0]=3 33024 B18R2.2525 C(=Cc1ccccc1)CNCc2ccccn2 270004a_100000210449_100000210105 [0,0,0,0,0,2|2,0,0]=4 33025 B18R2.2525 C(=Cc1ccccc1)CNCc2cccnc2 270004a_100000210453_100000210105 [0,0,0,0,0,2|2,0,0]=4 33026 B18R2.2525 C(=Cc1ccccc1)COCc2ccccc2 271570a_200011106559_100000210277 [0,0,0,0,0,2|0,0,0]=2 33027 B18R2.2525 C(=Cc1ccccn1)COCc2ccccc2 271570a_200011106559_100011216584 [0,0,0,0,0,2|1,0,0]=3 33028 B18R2.2525 C(=Cc1cccnc1)COCc2ccccc2 271570a_200011106559_100000752921 [0,0,0,0,0,2|1,0,0]=3 33029 B18R2.2525 C(=Cc1cccnn1)COCc2ccccc2 271570a_200011106559_100016991348 [0,0,0,0,0,2|2,0,0]=4 33030 B18R2.2525 C(=Cc1ccncc1)COCc2ccccc2 271570a_200011106559_100000035832 [0,0,0,0,0,2|1,0,0]=3 33031 B18R2.2525 C(=Cc1ccncn1)COCc2ccccc2 271570a_200011106559_100000703185 [0,0,0,0,0,2|2,0,0]=4 33032 B18R2.2525 C(=Cc1ccnnc1)COCc2ccccc2 271570a_200011106559_100000732662 [0,0,0,0,0,2|2,0,0]=4 33033 B18R2.2525 C(=Cc1cnccn1)COCc2ccccc2 271570a_200011106559_100000758340 [0,0,0,0,0,2|2,0,0]=4 33034 B18R2.2525 C(=Cc1cncnc1)COCc2ccccc2 271570a_200011106559_100011206942 [0,0,0,0,0,2|2,0,0]=4 33035 B18R2.2525 C(=Cc1ncccn1)COCc2ccccc2 271570a_200011106559_100000211032 [0,0,0,0,0,2|2,0,0]=4 33036 B18R2.2525 C(=NNCCc1ccccc1)c2ccccc2 4a_100000740470_100015611070 [0,0,0,0,0,2|1,0,1]=4 33037 B18R2.2525 C(=NNCc1ccccc1)Cc2ccccc2 4a_100000007032_100000209964 [0,0,0,0,0,2|1,0,0]=3 33038 B18R2.2525 C(=NNCc1ccccn1)Cc2ccccc2 4a_100000736832_100000209964 [0,0,0,0,0,2|2,0,0]=4 33039 B18R2.2525 C(=NNCc1cccnc1)Cc2ccccc2 4a_100000738295_100000209964 [0,0,0,0,0,2|2,0,0]=4 33040 B18R2.2525 C(=NNCc1ccncc1)Cc2ccccc2 4a_100000736929_100000209964 [0,0,0,0,0,2|2,0,0]=4 33041 B18R2.2525 C(=NNc1ccccc1)CCc2ccccc2 4a_100015195140_100000198083 [0,0,0,0,0,2|1,0,1]=4 33042 B18R2.2525 C(=NNc1ccccc1)COc2ccccc2 4a_100015195140_100000758736 [0,0,0,0,0,2|2,0,0]=4 33043 B18R2.2525 C1=CCC(=CC1)CCCOCc2ccccc2 34a_100020667889_100015291786 [0,0,0,0,0,2|0,0,2]=4 33044 B18R2.2525 c1ccc(cc1)CCCCNc2ccccc2 34a_100000106764_100000701786 [0,0,0,0,0,2|1,0,0]=3 33045 B18R2.2525 c1ccc(cc1)CCCCOc2ccccc2 34a_100000210340_100000701786 [0,0,0,0,0,2|1,0,0]=3 33046 B18R2.2525 c1ccc(cc1)CCCCOc2ccccc2 7a_100000210340_100000701786 [0,0,0,0,0,2|1,0,0]=3 33047 B18R2.2525 c1ccc(cc1)CCCCOc2cccnc2 34a_100000210849_100000701786 [0,0,0,0,0,2|2,0,0]=4 33048 B18R2.2525 c1ccc(cc1)CCCCOc2cccnc2 7a_100000210849_100000701786 [0,0,0,0,0,2|2,0,0]=4 33049 B18R2.2525 c1ccc(cc1)CCCCOc2ccncc2 34a_100000212176_100000701786 [0,0,0,0,0,2|2,0,0]=4 33050 B18R2.2525 c1ccc(cc1)CCCCSc2ccccc2 62a_100000701786_100000041952 [0,0,0,0,0,2|1,0,0]=3 33051 B18R2.2525 c1ccc(cc1)CCCCSc2ccccc2 62a_100000719477_100000701786 [0,0,0,0,0,2|1,0,0]=3 33052 B18R2.2525 c1ccc(cc1)CCCCSc2ccccn2 62a_100000701786_100011216584 [0,0,0,0,0,2|2,0,0]=4 33053 B18R2.2525 c1ccc(cc1)CCCCSc2ccccn2 62a_100011216584_100000701786 [0,0,0,0,0,2|2,0,0]=4 33054 B18R2.2525 c1ccc(cc1)CCCCSc2cccnc2 62a_100000210063_100000701786 [0,0,0,0,0,2|2,0,0]=4 33055 B18R2.2525 c1ccc(cc1)CCCCSc2cccnc2 62a_100000701786_100000210063 [0,0,0,0,0,2|2,0,0]=4 33056 B18R2.2525 c1ccc(cc1)CCCCSc2ccncc2 62a_100000701786_100000728582 [0,0,0,0,0,2|2,0,0]=4 33057 B18R2.2525 c1ccc(cc1)CCCCSc2ccncc2 62a_100000728582_100000701786 [0,0,0,0,0,2|2,0,0]=4 33058 B18R2.2525 c1ccc(cc1)CCCNCc2ccccc2 207a_100000211184_100015611070 [0,0,0,0,0,2|1,0,0]=3 33059 B18R2.2525 c1ccc(cc1)CCCNCc2ccccc2 2230a_100000211184_100015291786 [0,0,0,0,0,2|1,0,0]=3 33060 B18R2.2525 c1ccc(cc1)CCCNCc2ccccc2 2230a_100015324214_100000211621 [0,0,0,0,0,2|1,0,0]=3 33061 B18R2.2525 c1ccc(cc1)CCCNCc2ccccc2 270004a_100000211184_100015611070 [0,0,0,0,0,2|1,0,0]=3 33062 B18R2.2525 c1ccc(cc1)CCCNCc2ccccc2 34a_100000211184_100015291786 [0,0,0,0,0,2|1,0,0]=3 33063 B18R2.2525 c1ccc(cc1)CCCNCc2ccccc2 34a_100015324214_100000211621 [0,0,0,0,0,2|1,0,0]=3 33064 B18R2.2525 c1ccc(cc1)CCCNCc2ccccn2 207a_100000211184_100000209966 [0,0,0,0,0,2|2,0,0]=4 33065 B18R2.2525 c1ccc(cc1)CCCNCc2ccccn2 2230a_100000211184_100000721315 [0,0,0,0,0,2|2,0,0]=4 33066 B18R2.2525 c1ccc(cc1)CCCNCc2ccccn2 270004a_100000211184_100000209966 [0,0,0,0,0,2|2,0,0]=4 33067 B18R2.2525 c1ccc(cc1)CCCNCc2ccccn2 34a_100000211184_100000721315 [0,0,0,0,0,2|2,0,0]=4 33068 B18R2.2525 c1ccc(cc1)CCCNCc2cccnc2 207a_100000211184_100000209961 [0,0,0,0,0,2|2,0,0]=4 33069 B18R2.2525 c1ccc(cc1)CCCNCc2cccnc2 2230a_100000211184_100000741622 [0,0,0,0,0,2|2,0,0]=4 33070 B18R2.2525 c1ccc(cc1)CCCNCc2cccnc2 270004a_100000211184_100000209961 [0,0,0,0,0,2|2,0,0]=4 33071 B18R2.2525 c1ccc(cc1)CCCNCc2cccnc2 34a_100000211184_100000733263 [0,0,0,0,0,2|2,0,0]=4 33072 B18R2.2525 c1ccc(cc1)CCCNCc2ccncc2 207a_100000211184_100000186114 [0,0,0,0,0,2|2,0,0]=4 33073 B18R2.2525 c1ccc(cc1)CCCNCc2ccncc2 2230a_100000211184_100015193705 [0,0,0,0,0,2|2,0,0]=4 33074 B18R2.2525 c1ccc(cc1)CCCOCc2ccccc2 34a_100000210790_100000211621 [0,0,0,0,0,2|0,0,0]=2 33075 B18R2.2525 c1ccc(cc1)CCCOCc2ccccc2 34a_100000210828_100015291786 [0,0,0,0,0,2|0,0,0]=2 33076 B18R2.2525 c1ccc(cc1)CCCOCc2ccccc2 7a_100000210790_100000211621 [0,0,0,0,0,2|0,0,0]=2 33077 B18R2.2525 c1ccc(cc1)CCCOCc2ccccc2 7a_100000210828_100000211182 [0,0,0,0,0,2|0,0,0]=2 33078 B18R2.2525 c1ccc(cc1)CCCOCc2ccccn2 34a_100000210828_100000721315 [0,0,0,0,0,2|1,0,0]=3 33079 B18R2.2525 c1ccc(cc1)CCCOCc2ccccn2 7a_100000210828_100000721315 [0,0,0,0,0,2|1,0,0]=3 33080 B18R2.2525 c1ccc(cc1)CCCOCc2cccnc2 34a_100000210828_100000733263 [0,0,0,0,0,2|1,0,0]=3 33081 B18R2.2525 c1ccc(cc1)CCCOCc2cccnc2 7a_100000210828_100000741622 [0,0,0,0,0,2|1,0,0]=3 33082 B18R2.2525 c1ccc(cc1)CCCOCc2cccnn2 34a_100000210828_100016990269 [0,0,0,0,0,2|2,0,0]=4 33083 B18R2.2525 c1ccc(cc1)CCCOCc2cccnn2 7a_100000210828_100016990269 [0,0,0,0,0,2|2,0,0]=4 33084 B18R2.2525 c1ccc(cc1)CCCOCc2ccncc2 7a_100000210828_100015193705 [0,0,0,0,0,2|1,0,0]=3 33085 B18R2.2525 c1ccc(cc1)CCCOCc2cnccn2 34a_100000210828_100016995436 [0,0,0,0,0,2|2,0,0]=4 33086 B18R2.2525 c1ccc(cc1)CCCOCc2cnccn2 7a_100000210828_100016995436 [0,0,0,0,0,2|2,0,0]=4 33087 B18R2.2525 c1ccc(cc1)CCCOCc2cncnc2 34a_100000210828_100015196519 [0,0,0,0,0,2|2,0,0]=4 33088 B18R2.2525 c1ccc(cc1)CCCOCc2cncnc2 7a_100000210828_100015196519 [0,0,0,0,0,2|2,0,0]=4 33089 B18R2.2525 c1ccc(cc1)CCCOCc2ncccn2 34a_100000210828_100000703007 [0,0,0,0,0,2|2,0,0]=4 33090 B18R2.2525 c1ccc(cc1)CCCOCc2ncccn2 7a_100000210828_100000703007 [0,0,0,0,0,2|2,0,0]=4 33091 B18R2.2525 c1ccc(cc1)CCCSCc2ccccc2 62a_100000211182_100000211621 [0,0,0,0,0,2|0,1,0]=3 33092 B18R2.2525 c1ccc(cc1)CCCSCc2ccccc2 62a_100000211621_100015291786 [0,0,0,0,0,2|0,1,0]=3 33093 B18R2.2525 c1ccc(cc1)CCCSCc2ccccn2 62a_100000211621_100000721315 [0,0,0,0,0,2|1,1,0]=4 33094 B18R2.2525 c1ccc(cc1)CCCSCc2ccccn2 62a_100000721315_100000211621 [0,0,0,0,0,2|1,1,0]=4 33095 B18R2.2525 c1ccc(cc1)CCCSCc2cccnc2 62a_100000211621_100000741622 [0,0,0,0,0,2|1,1,0]=4 33096 B18R2.2525 c1ccc(cc1)CCCSCc2cccnc2 62a_100000741622_100000211621 [0,0,0,0,0,2|1,1,0]=4 33097 B18R2.2525 c1ccc(cc1)CCCSCc2ccncc2 62a_100000211621_100015193705 [0,0,0,0,0,2|1,1,0]=4 33098 B18R2.2525 c1ccc(cc1)CCCSCc2ccncc2 62a_100015193705_100000211621 [0,0,0,0,0,2|1,1,0]=4 33099 B18R2.2525 c1ccc(cc1)CCNCCc2ccccc2 2230a_100000106460_100000765856 [0,0,0,0,0,2|1,0,0]=3 33100 B18R2.2525 c1ccc(cc1)CCNCCc2ccccc2 34a_100000106460_100000765856 [0,0,0,0,0,2|1,0,0]=3 33101 B18R2.2525 c1ccc(cc1)CCNCCc2ccccn2 2230a_100000106460_100015183660 [0,0,0,0,0,2|2,0,0]=4 33102 B18R2.2525 c1ccc(cc1)CCNCCc2cccnc2 2230a_100000106460_200011713674 [0,0,0,0,0,2|2,0,0]=4 33103 B18R2.2525 c1ccc(cc1)CCNCCc2cccnc2 2230a_100000736294_100000765856 [0,0,0,0,0,2|2,0,0]=4 33104 B18R2.2525 c1ccc(cc1)CCNCCc2ccncc2 2230a_100000106460_100000723409 [0,0,0,0,0,2|2,0,0]=4 33105 B18R2.2525 c1ccc(cc1)CCNCSc2ccccc2 2230a_100000106460_100011218342 [0,0,0,0,0,2|1,0,0]=3 33106 B18R2.2525 c1ccc(cc1)CCOCCc2ccccc2 34a_100000210268_100000765856 [0,0,0,0,0,2|0,0,0]=2 33107 B18R2.2525 c1ccc(cc1)CCOCCc2ccccc2 7a_100000210268_100000765856 [0,0,0,0,0,2|0,0,0]=2 33108 B18R2.2525 c1ccc(cc1)CCOCCc2ccccn2 34a_100000210271_100000765856 [0,0,0,0,0,2|1,0,0]=3 33109 B18R2.2525 c1ccc(cc1)CCOCCc2ccccn2 7a_100000210268_100015183660 [0,0,0,0,0,2|1,0,0]=3 33110 B18R2.2525 c1ccc(cc1)CCOCCc2cccnc2 34a_100011217484_100000765856 [0,0,0,0,0,2|1,0,0]=3 33111 B18R2.2525 c1ccc(cc1)CCOCCc2cccnc2 7a_100000210268_200011713674 [0,0,0,0,0,2|1,0,0]=3 33112 B18R2.2525 c1ccc(cc1)CCOCCc2ccncc2 34a_100011216225_100000765856 [0,0,0,0,0,2|1,0,0]=3 33113 B18R2.2525 c1ccc(cc1)CCOCCc2ccncc2 7a_100000210268_100000723409 [0,0,0,0,0,2|1,0,0]=3 33114 B18R2.2525 c1ccc(cc1)CCOCCc2cnccn2 34a_100011349526_100000765856 [0,0,0,0,0,2|2,0,0]=4 33115 B18R2.2525 c1ccc(cc1)CCOCCc2cncnc2 34a_100011709255_100000765856 [0,0,0,0,0,2|2,0,0]=4 33116 B18R2.2525 c1ccc(cc1)CCSCCc2ccccc2 62a_100000765856_100011218657 [0,0,0,0,0,2|0,1,0]=3 33117 B18R2.2525 c1ccc(cc1)CCSCCc2ccccn2 62a_100000765856_100015183660 [0,0,0,0,0,2|1,1,0]=4 33118 B18R2.2525 c1ccc(cc1)CCSCCc2ccccn2 62a_100015183660_100011218657 [0,0,0,0,0,2|1,1,0]=4 33119 B18R2.2525 c1ccc(cc1)CCSCCc2cccnc2 62a_100000765856_200011713674 [0,0,0,0,0,2|1,1,0]=4 33120 B18R2.2525 c1ccc(cc1)CCSCCc2cccnc2 62a_200011713674_100011218657 [0,0,0,0,0,2|1,1,0]=4 33121 B18R2.2525 c1ccc(cc1)CCSCCc2ccncc2 62a_100000723409_100011218657 [0,0,0,0,0,2|1,1,0]=4 33122 B18R2.2525 c1ccc(cc1)CCSCCc2ccncc2 62a_100000765856_100000723409 [0,0,0,0,0,2|1,1,0]=4 33123 B18R2.2525 c1ccc(cc1)CCSCSc2ccccc2 62a_100000765856_100011218342 [0,0,0,0,0,2|0,1,0]=3 33124 B18R2.2525 c1ccc(cc1)CCSCSc2ccccc2 62a_100011218342_100011218657 [0,0,0,0,0,2|0,1,0]=3 33125 B18R2.2525 c1ccc(cc1)CNCCCc2ccccn2 207a_100000689020_100015611070 [0,0,0,0,0,2|2,0,0]=4 33126 B18R2.2525 c1ccc(cc1)CNCCCc2ccccn2 270004a_100000689020_100015611070 [0,0,0,0,0,2|2,0,0]=4 33127 B18R2.2525 c1ccc(cc1)CNCCCc2cccnc2 207a_100011532358_100015611070 [0,0,0,0,0,2|2,0,0]=4 33128 B18R2.2525 c1ccc(cc1)CNCCCc2cccnc2 2230a_100011532358_100015291786 [0,0,0,0,0,2|2,0,0]=4 33129 B18R2.2525 c1ccc(cc1)CNCCCc2cccnc2 270004a_100011532358_100015611070 [0,0,0,0,0,2|2,0,0]=4 33130 B18R2.2525 c1ccc(cc1)CNCCCc2cccnc2 34a_100011532358_100015291786 [0,0,0,0,0,2|2,0,0]=4 33131 B18R2.2525 c1ccc(cc1)CNCCCc2ccncc2 207a_100011275580_100015611070 [0,0,0,0,0,2|2,0,0]=4 33132 B18R2.2525 c1ccc(cc1)CNCCCc2ccncc2 2230a_100011275580_100015291786 [0,0,0,0,0,2|2,0,0]=4 33133 B18R2.2525 c1ccc(cc1)CNCCCc2ccncc2 270004a_100011275580_100015611070 [0,0,0,0,0,2|2,0,0]=4 33134 B18R2.2525 c1ccc(cc1)CNCCOc2ccccc2 207a_100000174943_100015611070 [0,0,0,0,0,2|1,0,0]=3 33135 B18R2.2525 c1ccc(cc1)CNCCOc2ccccc2 2230a_100000174943_100015291786 [0,0,0,0,0,2|1,0,0]=3 33136 B18R2.2525 c1ccc(cc1)CNCCOc2ccccc2 2230a_100015324214_100000184471 [0,0,0,0,0,2|1,0,0]=3 33137 B18R2.2525 c1ccc(cc1)CNCCOc2ccccc2 270004a_100000174943_100015611070 [0,0,0,0,0,2|1,0,0]=3 33138 B18R2.2525 c1ccc(cc1)CNCCOc2ccccc2 270004a_100015324214_100000758736 [0,0,0,0,0,2|1,0,0]=3 33139 B18R2.2525 c1ccc(cc1)CNCCOc2ccccc2 34a_100000174943_100015291786 [0,0,0,0,0,2|1,0,0]=3 33140 B18R2.2525 c1ccc(cc1)CNCCOc2ccccc2 34a_100015324214_100000184471 [0,0,0,0,0,2|1,0,0]=3 33141 B18R2.2525 c1ccc(cc1)CNCCOc2ccccn2 207a_106741647558_100015611070 [0,0,0,0,0,2|2,0,0]=4 33142 B18R2.2525 c1ccc(cc1)CNCCOc2ccccn2 2230a_106741647558_100015291786 [0,0,0,0,0,2|2,0,0]=4 33143 B18R2.2525 c1ccc(cc1)CNCCOc2ccccn2 270004a_106741647558_100015611070 [0,0,0,0,0,2|2,0,0]=4 33144 B18R2.2525 c1ccc(cc1)CNCCOc2cccnc2 207a_100000754688_100015611070 [0,0,0,0,0,2|2,0,0]=4 33145 B18R2.2525 c1ccc(cc1)CNCCOc2cccnc2 2230a_100000754688_100015291786 [0,0,0,0,0,2|2,0,0]=4 33146 B18R2.2525 c1ccc(cc1)CNCCOc2cccnc2 270004a_100000754688_100015611070 [0,0,0,0,0,2|2,0,0]=4 33147 B18R2.2525 c1ccc(cc1)CNCCOc2ccncc2 207a_100025717301_100015611070 [0,0,0,0,0,2|2,0,0]=4 33148 B18R2.2525 c1ccc(cc1)CNCCOc2ccncc2 270004a_100025717301_100015611070 [0,0,0,0,0,2|2,0,0]=4 33149 B18R2.2525 c1ccc(cc1)CNCCSc2ccccc2 207a_100000189519_100015611070 [0,0,0,0,0,2|1,0,0]=3 33150 B18R2.2525 c1ccc(cc1)CNCCSc2ccccc2 2230a_100000189519_100015291786 [0,0,0,0,0,2|1,0,0]=3 33151 B18R2.2525 c1ccc(cc1)CNCCSc2ccccc2 2230a_100015324214_100000246102 [0,0,0,0,0,2|1,0,0]=3 33152 B18R2.2525 c1ccc(cc1)CNCCSc2ccccc2 270004a_100000189519_100015611070 [0,0,0,0,0,2|1,0,0]=3 33153 B18R2.2525 c1ccc(cc1)CNCCSc2ccccc2 34a_100015324214_100000246102 [0,0,0,0,0,2|1,0,0]=3 33154 B18R2.2525 c1ccc(cc1)CNCOCc2ccccc2 2230a_100015324214_100000763385 [0,0,0,0,0,2|0,0,0]=2 33155 B18R2.2525 c1ccc(cc1)CNCOCc2ccccc2 34a_100015324214_100000763385 [0,0,0,0,0,2|0,0,0]=2 33156 B18R2.2525 c1ccc(cc1)CNCSCc2ccccc2 2230a_100015324214_200011217039 [0,0,0,0,0,2|0,1,0]=3 33157 B18R2.2525 c1ccc(cc1)CNCSCc2ccccc2 34a_100015324214_200011217039 [0,0,0,0,0,2|0,1,0]=3 33158 B18R2.2525 c1ccc(cc1)COCCCc2ccccn2 34a_100011215068_100015291786 [0,0,0,0,0,2|1,0,0]=3 33159 B18R2.2525 c1ccc(cc1)COCCCc2cccnc2 34a_100000211284_100015291786 [0,0,0,0,0,2|1,0,0]=3 33160 B18R2.2525 c1ccc(cc1)COCCCc2ccncc2 34a_100000210659_100015291786 [0,0,0,0,0,2|1,0,0]=3 33161 B18R2.2525 c1ccc(cc1)COCCNc2ccccc2 34a_100000106764_100000234347 [0,0,0,0,0,2|0,0,0]=2 33162 B18R2.2525 c1ccc(cc1)COCCNc2ccccc2 34a_100000211345_100015291786 [0,0,0,0,0,2|0,0,0]=2 33163 B18R2.2525 c1ccc(cc1)COCCNc2cccnn2 27a_100000753106_100016991348 [0,0,0,0,0,2|2,0,0]=4 33164 B18R2.2525 c1ccc(cc1)COCCNc2ccncc2 34a_200011243140_100015291786 [0,0,0,0,0,2|1,0,0]=3 33165 B18R2.2525 c1ccc(cc1)COCCNc2ccncn2 27a_100000753106_100000703185 [0,0,0,0,0,2|2,0,0]=4 33166 B18R2.2525 c1ccc(cc1)COCCNc2cnccn2 27a_100000753106_100000211759 [0,0,0,0,0,2|2,0,0]=4 33167 B18R2.2525 c1ccc(cc1)COCCNc2ncccn2 27a_100000753106_100000211032 [0,0,0,0,0,2|2,0,0]=4 33168 B18R2.2525 c1ccc(cc1)COCCOc2ccccc2 34a_100000210260_100015291786 [0,0,0,0,0,2|0,0,0]=2 33169 B18R2.2525 c1ccc(cc1)COCCOc2ccccc2 34a_100000210340_100000234347 [0,0,0,0,0,2|0,0,0]=2 33170 B18R2.2525 c1ccc(cc1)COCCOc2ccccc2 34a_100000210790_100000184471 [0,0,0,0,0,2|0,0,0]=2 33171 B18R2.2525 c1ccc(cc1)COCCOc2ccccc2 7a_100000210260_100000211182 [0,0,0,0,0,2|0,0,0]=2 33172 B18R2.2525 c1ccc(cc1)COCCOc2ccccc2 7a_100000210340_100000234347 [0,0,0,0,0,2|0,0,0]=2 33173 B18R2.2525 c1ccc(cc1)COCCOc2ccccc2 7a_100000210790_100000184471 [0,0,0,0,0,2|0,0,0]=2 33174 B18R2.2525 c1ccc(cc1)COCCOc2cccnc2 34a_100000210849_100000234347 [0,0,0,0,0,2|1,0,0]=3 33175 B18R2.2525 c1ccc(cc1)COCCOc2cccnc2 7a_100000210849_100000234347 [0,0,0,0,0,2|1,0,0]=3 33176 B18R2.2525 c1ccc(cc1)COCCOc2ccncc2 34a_100000212176_100000234347 [0,0,0,0,0,2|1,0,0]=3 33177 B18R2.2525 c1ccc(cc1)COCCOc2ccnnc2 34a_100015204005_100000234347 [0,0,0,0,0,2|2,0,0]=4 33178 B18R2.2525 c1ccc(cc1)COCCOc2cncnc2 7a_100000754086_100000234347 [0,0,0,0,0,2|2,0,0]=4 33179 B18R2.2525 c1ccc(cc1)COCCSc2ccccc2 34a_100000210790_100000246102 [0,0,0,0,0,2|0,0,0]=2 33180 B18R2.2525 c1ccc(cc1)COCCSc2ccccc2 62a_100000234347_100000041952 [0,0,0,0,0,2|0,0,0]=2 33181 B18R2.2525 c1ccc(cc1)COCCSc2ccccc2 62a_100000719477_100000234347 [0,0,0,0,0,2|0,0,0]=2 33182 B18R2.2525 c1ccc(cc1)COCCSc2ccccc2 7a_100000210790_100000246102 [0,0,0,0,0,2|0,0,0]=2 33183 B18R2.2525 c1ccc(cc1)COCCSc2ccccc2 7a_100000230494_100000211182 [0,0,0,0,0,2|0,0,0]=2 33184 B18R2.2525 c1ccc(cc1)COCCSc2ccccn2 62a_100000234347_100011216584 [0,0,0,0,0,2|1,0,0]=3 33185 B18R2.2525 c1ccc(cc1)COCCSc2ccccn2 62a_100011216584_100000234347 [0,0,0,0,0,2|1,0,0]=3 33186 B18R2.2525 c1ccc(cc1)COCCSc2ccccn2 7a_100000156319_100000211182 [0,0,0,0,0,2|1,0,0]=3 33187 B18R2.2525 c1ccc(cc1)COCCSc2cccnc2 62a_100000210063_100000234347 [0,0,0,0,0,2|1,0,0]=3 33188 B18R2.2525 c1ccc(cc1)COCCSc2cccnc2 62a_100000234347_100000210063 [0,0,0,0,0,2|1,0,0]=3 33189 B18R2.2525 c1ccc(cc1)COCCSc2cccnn2 62a_100000234347_100016991348 [0,0,0,0,0,2|2,0,0]=4 33190 B18R2.2525 c1ccc(cc1)COCCSc2cccnn2 62a_100016991348_100000234347 [0,0,0,0,0,2|2,0,0]=4 33191 B18R2.2525 c1ccc(cc1)COCCSc2ccncc2 62a_100000234347_100000728582 [0,0,0,0,0,2|1,0,0]=3 33192 B18R2.2525 c1ccc(cc1)COCCSc2ccncc2 62a_100000728582_100000234347 [0,0,0,0,0,2|1,0,0]=3 33193 B18R2.2525 c1ccc(cc1)COCCSc2ccncn2 62a_100000234347_100000703185 [0,0,0,0,0,2|2,0,0]=4 33194 B18R2.2525 c1ccc(cc1)COCCSc2ccncn2 62a_100000703185_100000234347 [0,0,0,0,0,2|2,0,0]=4 33195 B18R2.2525 c1ccc(cc1)COCCSc2ccnnc2 62a_100000234347_100000732662 [0,0,0,0,0,2|2,0,0]=4 33196 B18R2.2525 c1ccc(cc1)COCCSc2ccnnc2 62a_100000732662_100000234347 [0,0,0,0,0,2|2,0,0]=4 33197 B18R2.2525 c1ccc(cc1)COCCSc2cnccn2 62a_100000211759_100000234347 [0,0,0,0,0,2|2,0,0]=4 33198 B18R2.2525 c1ccc(cc1)COCCSc2cnccn2 62a_100000234347_100000211759 [0,0,0,0,0,2|2,0,0]=4 33199 B18R2.2525 c1ccc(cc1)COCCSc2cncnc2 62a_100000234347_100011206942 [0,0,0,0,0,2|2,0,0]=4 33200 B18R2.2525 c1ccc(cc1)COCCSc2cncnc2 62a_100011206942_100000234347 [0,0,0,0,0,2|2,0,0]=4 33201 B18R2.2525 c1ccc(cc1)COCCSc2ncccn2 62a_100000211032_100000234347 [0,0,0,0,0,2|2,0,0]=4 33202 B18R2.2525 c1ccc(cc1)COCCSc2ncccn2 62a_100000234347_100000211032 [0,0,0,0,0,2|2,0,0]=4 33203 B18R2.2525 c1ccc(cc1)COCNCc2cccnn2 2230a_100159270163_100000763385 [0,0,0,0,0,2|2,0,0]=4 33204 B18R2.2525 c1ccc(cc1)COCNCc2cncnc2 2230a_100011243677_100000763385 [0,0,0,0,0,2|2,0,0]=4 33205 B18R2.2525 c1ccc(cc1)COCOCc2ccccc2 34a_100000210790_100000763385 [0,0,0,0,0,2|0,0,0]=2 33206 B18R2.2525 c1ccc(cc1)COCSCc2ccccc2 34a_100000210790_200011217039 [0,0,0,0,0,2|0,0,0]=2 33207 B18R2.2525 c1ccc(cc1)COCSCc2ccccc2 62a_100000211182_100000763385 [0,0,0,0,0,2|0,0,0]=2 33208 B18R2.2525 c1ccc(cc1)COCSCc2ccccc2 62a_100000763385_100015291786 [0,0,0,0,0,2|0,0,0]=2 33209 B18R2.2525 c1ccc(cc1)COCSCc2ccccn2 62a_100000721315_100000763385 [0,0,0,0,0,2|1,0,0]=3 33210 B18R2.2525 c1ccc(cc1)COCSCc2ccccn2 62a_100000763385_100000721315 [0,0,0,0,0,2|1,0,0]=3 33211 B18R2.2525 c1ccc(cc1)COCSCc2cccnc2 62a_100000741622_100000763385 [0,0,0,0,0,2|1,0,0]=3 33212 B18R2.2525 c1ccc(cc1)COCSCc2cccnc2 62a_100000763385_100000741622 [0,0,0,0,0,2|1,0,0]=3 33213 B18R2.2525 c1ccc(cc1)COCSCc2cccnn2 62a_100000763385_100016990269 [0,0,0,0,0,2|2,0,0]=4 33214 B18R2.2525 c1ccc(cc1)COCSCc2cccnn2 62a_100016990269_100000763385 [0,0,0,0,0,2|2,0,0]=4 33215 B18R2.2525 c1ccc(cc1)COCSCc2ccncc2 62a_100000763385_100015193705 [0,0,0,0,0,2|1,0,0]=3 33216 B18R2.2525 c1ccc(cc1)COCSCc2ccncc2 62a_100015193705_100000763385 [0,0,0,0,0,2|1,0,0]=3 33217 B18R2.2525 c1ccc(cc1)COCSCc2cnccn2 62a_100000763385_100016995436 [0,0,0,0,0,2|2,0,0]=4 33218 B18R2.2525 c1ccc(cc1)COCSCc2cnccn2 62a_100016995436_100000763385 [0,0,0,0,0,2|2,0,0]=4 33219 B18R2.2525 c1ccc(cc1)COCSCc2cncnc2 62a_100000763385_100015196519 [0,0,0,0,0,2|2,0,0]=4 33220 B18R2.2525 c1ccc(cc1)COCSCc2cncnc2 62a_100015196519_100000763385 [0,0,0,0,0,2|2,0,0]=4 33221 B18R2.2525 c1ccc(cc1)COCSCc2ncccn2 62a_100000703007_100000763385 [0,0,0,0,0,2|2,0,0]=4 33222 B18R2.2525 c1ccc(cc1)COCSCc2ncccn2 62a_100000763385_100000703007 [0,0,0,0,0,2|2,0,0]=4 33223 B18R2.2525 c1ccc(cc1)CSCCNc2ccccc2 34a_100000106764_200011297719 [0,0,0,0,0,2|0,1,0]=3 33224 B18R2.2525 c1ccc(cc1)CSCCOc2ccccc2 34a_100000210340_200011297719 [0,0,0,0,0,2|0,1,0]=3 33225 B18R2.2525 c1ccc(cc1)CSCCOc2ccccc2 62a_100000184471_100015291786 [0,0,0,0,0,2|0,1,0]=3 33226 B18R2.2525 c1ccc(cc1)CSCCOc2ccccc2 62a_100000211182_100000184471 [0,0,0,0,0,2|0,1,0]=3 33227 B18R2.2525 c1ccc(cc1)CSCCOc2cccnc2 34a_100000210849_200011297719 [0,0,0,0,0,2|1,1,0]=4 33228 B18R2.2525 c1ccc(cc1)CSCCOc2ccncc2 34a_100000212176_200011297719 [0,0,0,0,0,2|1,1,0]=4 33229 B18R2.2525 c1ccc(cc1)CSCCSc2ccccc2 62a_100000211182_100000246102 [0,0,0,0,0,2|0,1,0]=3 33230 B18R2.2525 c1ccc(cc1)CSCCSc2ccccc2 62a_100000246102_100015291786 [0,0,0,0,0,2|0,1,0]=3 33231 B18R2.2525 c1ccc(cc1)CSCCSc2ccccc2 62a_100000719477_200011297719 [0,0,0,0,0,2|0,1,0]=3 33232 B18R2.2525 c1ccc(cc1)CSCCSc2ccccc2 62a_200011297719_100000041952 [0,0,0,0,0,2|0,1,0]=3 33233 B18R2.2525 c1ccc(cc1)CSCCSc2ccccn2 62a_100011216584_200011297719 [0,0,0,0,0,2|1,1,0]=4 33234 B18R2.2525 c1ccc(cc1)CSCCSc2ccccn2 62a_200011297719_100011216584 [0,0,0,0,0,2|1,1,0]=4 33235 B18R2.2525 c1ccc(cc1)CSCCSc2cccnc2 62a_100000210063_200011297719 [0,0,0,0,0,2|1,1,0]=4 33236 B18R2.2525 c1ccc(cc1)CSCCSc2cccnc2 62a_200011297719_100000210063 [0,0,0,0,0,2|1,1,0]=4 33237 B18R2.2525 c1ccc(cc1)CSCCSc2ccncc2 62a_100000728582_200011297719 [0,0,0,0,0,2|1,1,0]=4 33238 B18R2.2525 c1ccc(cc1)CSCCSc2ccncc2 62a_200011297719_100000728582 [0,0,0,0,0,2|1,1,0]=4 33239 B18R2.2525 c1ccc(cc1)CSCSCc2ccccc2 62a_100000211182_200011217039 [0,0,0,0,0,2|0,1,0]=3 33240 B18R2.2525 c1ccc(cc1)CSCSCc2ccccc2 62a_200011217039_100015291786 [0,0,0,0,0,2|0,1,0]=3 33241 B18R2.2525 c1ccc(cc1)CSCSCc2ccccn2 62a_100000721315_200011217039 [0,0,0,0,0,2|1,1,0]=4 33242 B18R2.2525 c1ccc(cc1)CSCSCc2ccccn2 62a_200011217039_100000721315 [0,0,0,0,0,2|1,1,0]=4 33243 B18R2.2525 c1ccc(cc1)CSCSCc2cccnc2 62a_100000741622_200011217039 [0,0,0,0,0,2|1,1,0]=4 33244 B18R2.2525 c1ccc(cc1)CSCSCc2cccnc2 62a_200011217039_100000741622 [0,0,0,0,0,2|1,1,0]=4 33245 B18R2.2525 c1ccc(cc1)CSCSCc2ccncc2 62a_100015193705_200011217039 [0,0,0,0,0,2|1,1,0]=4 33246 B18R2.2525 c1ccc(cc1)CSCSCc2ccncc2 62a_200011217039_100015193705 [0,0,0,0,0,2|1,1,0]=4 33247 B18R2.2525 c1ccc(cc1)NCCCOc2ccccc2 34a_100000106764_100000199009 [0,0,0,0,0,2|1,0,0]=3 33248 B18R2.2525 c1ccc(cc1)NCCCSc2ccccc2 34a_100000106764_200011203293 [0,0,0,0,0,2|1,0,0]=3 33249 B18R2.2525 c1ccc(cc1)NCCOCc2ccccn2 34a_100000211345_100000721315 [0,0,0,0,0,2|1,0,0]=3 33250 B18R2.2525 c1ccc(cc1)NCCOCc2cccnc2 34a_100000211345_100000733263 [0,0,0,0,0,2|1,0,0]=3 33251 B18R2.2525 c1ccc(cc1)NCCOCc2cccnn2 34a_100000211345_100016990269 [0,0,0,0,0,2|2,0,0]=4 33252 B18R2.2525 c1ccc(cc1)NCCOCc2cnccn2 34a_100000211345_100016995436 [0,0,0,0,0,2|2,0,0]=4 33253 B18R2.2525 c1ccc(cc1)NCCOCc2cncnc2 34a_100000211345_100015196519 [0,0,0,0,0,2|2,0,0]=4 33254 B18R2.2525 c1ccc(cc1)NCCOCc2ncccn2 34a_100000211345_100000703007 [0,0,0,0,0,2|2,0,0]=4 33255 B18R2.2525 c1ccc(cc1)OCCCCc2ccncc2 7a_100000210340_100020630000 [0,0,0,0,0,2|2,0,0]=4 33256 B18R2.2525 c1ccc(cc1)OCCCOc2ccccc2 34a_100000210340_100000199009 [0,0,0,0,0,2|1,0,0]=3 33257 B18R2.2525 c1ccc(cc1)OCCCOc2ccccc2 7a_100000210340_100000199009 [0,0,0,0,0,2|1,0,0]=3 33258 B18R2.2525 c1ccc(cc1)OCCCOc2cccnc2 34a_100000210849_100000199009 [0,0,0,0,0,2|2,0,0]=4 33259 B18R2.2525 c1ccc(cc1)OCCCOc2cccnc2 7a_100000210849_100000199009 [0,0,0,0,0,2|2,0,0]=4 33260 B18R2.2525 c1ccc(cc1)OCCCOc2ccncc2 34a_100000212176_100000199009 [0,0,0,0,0,2|2,0,0]=4 33261 B18R2.2525 c1ccc(cc1)OCCCSc2ccccc2 34a_100000210340_200011203293 [0,0,0,0,0,2|1,0,0]=3 33262 B18R2.2525 c1ccc(cc1)OCCCSc2ccccc2 62a_100000199009_100000041952 [0,0,0,0,0,2|1,0,0]=3 33263 B18R2.2525 c1ccc(cc1)OCCCSc2ccccc2 62a_100000719477_100000199009 [0,0,0,0,0,2|1,0,0]=3 33264 B18R2.2525 c1ccc(cc1)OCCCSc2ccccc2 7a_100000210340_200011203293 [0,0,0,0,0,2|1,0,0]=3 33265 B18R2.2525 c1ccc(cc1)OCCCSc2ccccn2 62a_100000199009_100011216584 [0,0,0,0,0,2|2,0,0]=4 33266 B18R2.2525 c1ccc(cc1)OCCCSc2ccccn2 62a_100011216584_100000199009 [0,0,0,0,0,2|2,0,0]=4 33267 B18R2.2525 c1ccc(cc1)OCCCSc2cccnc2 62a_100000199009_100000210063 [0,0,0,0,0,2|2,0,0]=4 33268 B18R2.2525 c1ccc(cc1)OCCCSc2cccnc2 62a_100000210063_100000199009 [0,0,0,0,0,2|2,0,0]=4 33269 B18R2.2525 c1ccc(cc1)OCCCSc2ccncc2 62a_100000199009_100000728582 [0,0,0,0,0,2|2,0,0]=4 33270 B18R2.2525 c1ccc(cc1)OCCCSc2ccncc2 62a_100000728582_100000199009 [0,0,0,0,0,2|2,0,0]=4 33271 B18R2.2525 c1ccc(cc1)OCCNCc2ccccn2 207a_100000174943_100000209966 [0,0,0,0,0,2|2,0,0]=4 33272 B18R2.2525 c1ccc(cc1)OCCNCc2ccccn2 2230a_100000174943_100000721315 [0,0,0,0,0,2|2,0,0]=4 33273 B18R2.2525 c1ccc(cc1)OCCNCc2ccccn2 270004a_100000174943_100000209966 [0,0,0,0,0,2|2,0,0]=4 33274 B18R2.2525 c1ccc(cc1)OCCNCc2ccccn2 270004a_100000210449_100000758736 [0,0,0,0,0,2|2,0,0]=4 33275 B18R2.2525 c1ccc(cc1)OCCNCc2ccccn2 34a_100000174943_100000721315 [0,0,0,0,0,2|2,0,0]=4 33276 B18R2.2525 c1ccc(cc1)OCCNCc2cccnc2 207a_100000174943_100000209961 [0,0,0,0,0,2|2,0,0]=4 33277 B18R2.2525 c1ccc(cc1)OCCNCc2cccnc2 2230a_100000174943_100000741622 [0,0,0,0,0,2|2,0,0]=4 33278 B18R2.2525 c1ccc(cc1)OCCNCc2cccnc2 270004a_100000174943_100000209961 [0,0,0,0,0,2|2,0,0]=4 33279 B18R2.2525 c1ccc(cc1)OCCNCc2cccnc2 270004a_100000210453_100000758736 [0,0,0,0,0,2|2,0,0]=4 33280 B18R2.2525 c1ccc(cc1)OCCNCc2cccnc2 34a_100000174943_100000733263 [0,0,0,0,0,2|2,0,0]=4 33281 B18R2.2525 c1ccc(cc1)OCCNCc2ccncc2 207a_100000174943_100000186114 [0,0,0,0,0,2|2,0,0]=4 33282 B18R2.2525 c1ccc(cc1)OCCNCc2ccncc2 2230a_100000174943_100015193705 [0,0,0,0,0,2|2,0,0]=4 33283 B18R2.2525 c1ccc(cc1)OCCOCc2ccccn2 34a_100000210260_100000721315 [0,0,0,0,0,2|1,0,0]=3 33284 B18R2.2525 c1ccc(cc1)OCCOCc2ccccn2 7a_100000210260_100000721315 [0,0,0,0,0,2|1,0,0]=3 33285 B18R2.2525 c1ccc(cc1)OCCOCc2cccnc2 34a_100000210260_100000733263 [0,0,0,0,0,2|1,0,0]=3 33286 B18R2.2525 c1ccc(cc1)OCCOCc2cccnc2 7a_100000210260_100000741622 [0,0,0,0,0,2|1,0,0]=3 33287 B18R2.2525 c1ccc(cc1)OCCOCc2cccnn2 34a_100000210260_100016990269 [0,0,0,0,0,2|2,0,0]=4 33288 B18R2.2525 c1ccc(cc1)OCCOCc2cccnn2 7a_100000210260_100016990269 [0,0,0,0,0,2|2,0,0]=4 33289 B18R2.2525 c1ccc(cc1)OCCOCc2ccncc2 7a_100000210260_100015193705 [0,0,0,0,0,2|1,0,0]=3 33290 B18R2.2525 c1ccc(cc1)OCCOCc2cnccn2 34a_100000210260_100016995436 [0,0,0,0,0,2|2,0,0]=4 33291 B18R2.2525 c1ccc(cc1)OCCOCc2cnccn2 7a_100000210260_100016995436 [0,0,0,0,0,2|2,0,0]=4 33292 B18R2.2525 c1ccc(cc1)OCCOCc2cncnc2 34a_100000210260_100015196519 [0,0,0,0,0,2|2,0,0]=4 33293 B18R2.2525 c1ccc(cc1)OCCOCc2cncnc2 7a_100000210260_100015196519 [0,0,0,0,0,2|2,0,0]=4 33294 B18R2.2525 c1ccc(cc1)OCCOCc2ncccn2 34a_100000210260_100000703007 [0,0,0,0,0,2|2,0,0]=4 33295 B18R2.2525 c1ccc(cc1)OCCOCc2ncccn2 7a_100000210260_100000703007 [0,0,0,0,0,2|2,0,0]=4 33296 B18R2.2525 c1ccc(cc1)OCCSCc2ccccn2 62a_100000184471_100000721315 [0,0,0,0,0,2|1,1,0]=4 33297 B18R2.2525 c1ccc(cc1)OCCSCc2ccccn2 62a_100000721315_100000184471 [0,0,0,0,0,2|1,1,0]=4 33298 B18R2.2525 c1ccc(cc1)OCCSCc2cccnc2 62a_100000184471_100000741622 [0,0,0,0,0,2|1,1,0]=4 33299 B18R2.2525 c1ccc(cc1)OCCSCc2cccnc2 62a_100000741622_100000184471 [0,0,0,0,0,2|1,1,0]=4 33300 B18R2.2525 c1ccc(cc1)OCCSCc2ccncc2 62a_100000184471_100015193705 [0,0,0,0,0,2|1,1,0]=4 33301 B18R2.2525 c1ccc(cc1)OCCSCc2ccncc2 62a_100015193705_100000184471 [0,0,0,0,0,2|1,1,0]=4 33302 B18R2.2525 c1ccc(cc1)SCCCCc2ccncc2 62a_100000719477_100020630000 [0,0,0,0,0,2|2,0,0]=4 33303 B18R2.2525 c1ccc(cc1)SCCCCc2ccncc2 62a_100020630000_100000041952 [0,0,0,0,0,2|2,0,0]=4 33304 B18R2.2525 c1ccc(cc1)SCCCOc2cccnc2 34a_100000210849_200011203293 [0,0,0,0,0,2|2,0,0]=4 33305 B18R2.2525 c1ccc(cc1)SCCCOc2cccnc2 7a_100000210849_200011203293 [0,0,0,0,0,2|2,0,0]=4 33306 B18R2.2525 c1ccc(cc1)SCCCOc2ccncc2 34a_100000212176_200011203293 [0,0,0,0,0,2|2,0,0]=4 33307 B18R2.2525 c1ccc(cc1)SCCCSc2ccccc2 62a_100000719477_200011203293 [0,0,0,0,0,2|1,0,0]=3 33308 B18R2.2525 c1ccc(cc1)SCCCSc2ccccc2 62a_200011203293_100000041952 [0,0,0,0,0,2|1,0,0]=3 33309 B18R2.2525 c1ccc(cc1)SCCCSc2ccccn2 62a_100011216584_200011203293 [0,0,0,0,0,2|2,0,0]=4 33310 B18R2.2525 c1ccc(cc1)SCCCSc2ccccn2 62a_200011203293_100011216584 [0,0,0,0,0,2|2,0,0]=4 33311 B18R2.2525 c1ccc(cc1)SCCCSc2cccnc2 62a_100000210063_200011203293 [0,0,0,0,0,2|2,0,0]=4 33312 B18R2.2525 c1ccc(cc1)SCCCSc2cccnc2 62a_200011203293_100000210063 [0,0,0,0,0,2|2,0,0]=4 33313 B18R2.2525 c1ccc(cc1)SCCCSc2ccncc2 62a_100000728582_200011203293 [0,0,0,0,0,2|2,0,0]=4 33314 B18R2.2525 c1ccc(cc1)SCCCSc2ccncc2 62a_200011203293_100000728582 [0,0,0,0,0,2|2,0,0]=4 33315 B18R2.2525 c1ccc(cc1)SCCNCc2ccccn2 207a_100000189519_100000209966 [0,0,0,0,0,2|2,0,0]=4 33316 B18R2.2525 c1ccc(cc1)SCCNCc2ccccn2 2230a_100000189519_100000721315 [0,0,0,0,0,2|2,0,0]=4 33317 B18R2.2525 c1ccc(cc1)SCCNCc2ccccn2 270004a_100000189519_100000209966 [0,0,0,0,0,2|2,0,0]=4 33318 B18R2.2525 c1ccc(cc1)SCCNCc2cccnc2 207a_100000189519_100000209961 [0,0,0,0,0,2|2,0,0]=4 33319 B18R2.2525 c1ccc(cc1)SCCNCc2cccnc2 2230a_100000189519_100000741622 [0,0,0,0,0,2|2,0,0]=4 33320 B18R2.2525 c1ccc(cc1)SCCNCc2cccnc2 270004a_100000189519_100000209961 [0,0,0,0,0,2|2,0,0]=4 33321 B18R2.2525 c1ccc(cc1)SCCNCc2ccncc2 207a_100000189519_100000186114 [0,0,0,0,0,2|2,0,0]=4 33322 B18R2.2525 c1ccc(cc1)SCCNCc2ccncc2 2230a_100000189519_100015193705 [0,0,0,0,0,2|2,0,0]=4 33323 B18R2.2525 c1ccc(cc1)SCCOCc2ccccn2 7a_100000230494_100000721315 [0,0,0,0,0,2|1,0,0]=3 33324 B18R2.2525 c1ccc(cc1)SCCOCc2cccnc2 7a_100000230494_100000741622 [0,0,0,0,0,2|1,0,0]=3 33325 B18R2.2525 c1ccc(cc1)SCCOCc2cccnn2 7a_100000230494_100016990269 [0,0,0,0,0,2|2,0,0]=4 33326 B18R2.2525 c1ccc(cc1)SCCOCc2ccncc2 7a_100000230494_100015193705 [0,0,0,0,0,2|1,0,0]=3 33327 B18R2.2525 c1ccc(cc1)SCCOCc2cnccn2 7a_100000230494_100016995436 [0,0,0,0,0,2|2,0,0]=4 33328 B18R2.2525 c1ccc(cc1)SCCOCc2cncnc2 7a_100000230494_100015196519 [0,0,0,0,0,2|2,0,0]=4 33329 B18R2.2525 c1ccc(cc1)SCCOCc2ncccn2 7a_100000230494_100000703007 [0,0,0,0,0,2|2,0,0]=4 33330 B18R2.2525 c1ccc(cc1)SCCSCc2ccccn2 62a_100000246102_100000721315 [0,0,0,0,0,2|1,1,0]=4 33331 B18R2.2525 c1ccc(cc1)SCCSCc2ccccn2 62a_100000721315_100000246102 [0,0,0,0,0,2|1,1,0]=4 33332 B18R2.2525 c1ccc(cc1)SCCSCc2cccnc2 62a_100000246102_100000741622 [0,0,0,0,0,2|1,1,0]=4 33333 B18R2.2525 c1ccc(cc1)SCCSCc2cccnc2 62a_100000741622_100000246102 [0,0,0,0,0,2|1,1,0]=4 33334 B18R2.2525 c1ccc(cc1)SCCSCc2ccncc2 62a_100000246102_100015193705 [0,0,0,0,0,2|1,1,0]=4 33335 B18R2.2525 c1ccc(cc1)SCCSCc2ccncc2 62a_100015193705_100000246102 [0,0,0,0,0,2|1,1,0]=4 33336 B18R2.2525 c1ccc(cc1)SCNCCc2cccnc2 2230a_100000736294_100011218342 [0,0,0,0,0,2|2,0,0]=4 33337 B18R2.2525 c1ccc(cc1)SCSCCc2ccccn2 62a_100011218342_100015183660 [0,0,0,0,0,2|1,1,0]=4 33338 B18R2.2525 c1ccc(cc1)SCSCCc2ccccn2 62a_100015183660_100011218342 [0,0,0,0,0,2|1,1,0]=4 33339 B18R2.2525 c1ccc(cc1)SCSCCc2cccnc2 62a_100011218342_200011713674 [0,0,0,0,0,2|1,1,0]=4 33340 B18R2.2525 c1ccc(cc1)SCSCCc2cccnc2 62a_200011713674_100011218342 [0,0,0,0,0,2|1,1,0]=4 33341 B18R2.2525 c1ccc(cc1)SCSCCc2ccncc2 62a_100000723409_100011218342 [0,0,0,0,0,2|1,1,0]=4 33342 B18R2.2525 c1ccc(cc1)SCSCCc2ccncc2 62a_100011218342_100000723409 [0,0,0,0,0,2|1,1,0]=4 33343 B18R2.2525 c1ccc(cc1)SCSCSc2ccccc2 62a_100011218342_100011218342 [0,0,0,0,0,2|0,1,0]=3 33344 B18R2.2525 c1ccc(nc1)CCCOCc2ccccn2 34a_100011215068_100000721315 [0,0,0,0,0,2|2,0,0]=4 33345 B18R2.2525 c1ccc(nc1)CCCOCc2cccnc2 34a_100011215068_100000733263 [0,0,0,0,0,2|2,0,0]=4 33346 B18R2.2525 c1ccc(nc1)COCCCc2cccnc2 34a_100000211284_100000721315 [0,0,0,0,0,2|2,0,0]=4 33347 B18R2.2525 c1ccc(nc1)COCCCc2ccncc2 34a_100000210659_100000721315 [0,0,0,0,0,2|2,0,0]=4 33348 B18R2.2525 c1ccc(nc1)COCCNc2ccncc2 34a_200011243140_100000721315 [0,0,0,0,0,2|2,0,0]=4 33349 B18R2.2525 c1ccc(nc1)COCCSc2ccccn2 7a_100000156319_100000721315 [0,0,0,0,0,2|2,0,0]=4 33350 B18R2.2525 c1ccc(nc1)SCCOCc2cccnc2 7a_100000156319_100000741622 [0,0,0,0,0,2|2,0,0]=4 33351 B18R2.2525 c1ccc(nc1)SCCOCc2ccncc2 7a_100000156319_100015193705 [0,0,0,0,0,2|2,0,0]=4 33352 B18R2.2525 c1cncc(c1)CCCOCc2cccnc2 34a_100000211284_100000733263 [0,0,0,0,0,2|2,0,0]=4 33353 B18R2.2525 c1cncc(c1)COCCCc2ccncc2 34a_100000210659_100000733263 [0,0,0,0,0,2|2,0,0]=4 33354 B18R2.2525 c1cncc(c1)COCCNc2ccncc2 34a_200011243140_100000733263 [0,0,0,0,0,2|2,0,0]=4