0 B18R2.8976 Cc1cc(n[nH]c1=O)C=CCc2ccccc2 271570a_200016263579_100012187101 [0,0,0,0,0,0|1,0,2]=3 1 B18R2.8976 Cc1cc(n[nH]c1=O)SCCc2ccccc2 62a_100000765856_100012187101 [0,0,0,0,0,0|2,0,0]=2 2 B18R2.8976 Cc1cc(n[nH]c1=O)SCCc2ccccn2 62a_100015183660_100012187101 [0,0,0,0,0,0|3,0,0]=3 3 B18R2.8976 Cc1cc(n[nH]c1=O)SCCc2cccnc2 62a_200011713674_100012187101 [0,0,0,0,0,0|3,0,0]=3 4 B18R2.8976 Cc1cc(n[nH]c1=O)SCCc2ccncc2 62a_100000723409_100012187101 [0,0,0,0,0,0|3,0,0]=3 5 B18R2.8976 Cc1cc(n[nH]c1=O)SCSc2ccccc2 62a_100011218342_100012187101 [0,0,0,0,0,0|3,0,0]=3 6 B18R2.8976 Cc1cc(ncc1Br)CNCc2ccccc2 207a_100015324214_100009814806 [0,0,0,0,0,0|4,0,0]=4 7 B18R2.8976 Cc1cc(ncc1Br)CNCc2ccccc2 270004a_100015324214_100009814806 [0,0,0,0,0,0|4,0,0]=4 8 B18R2.8976 Cc1cc(ncc1Br)COCc2ccccc2 34a_200010713146_100015291786 [0,0,0,0,0,0|4,0,0]=4 9 B18R2.8976 Cc1cc(ncc1Br)OCCc2ccccc2 34a_100000766222_100000765856 [0,0,0,0,0,0|4,0,0]=4 10 B18R2.8976 Cc1cc(ncc1Br)SCCc2ccccc2 62a_100000765856_100012356354 [0,0,0,0,0,0|4,0,0]=4 11 B18R2.8976 Cc1cc(ncc1Br)SCCc2ccccc2 62a_100012356354_100011218657 [0,0,0,0,0,0|4,0,0]=4 12 B18R2.8976 Cc1cc(ncc1Cl)OCCc2ccccc2 34a_200000085746_100000765856 [0,0,0,0,0,0|4,0,0]=4 13 B18R2.8976 Cc1cc(ncc1F)SCCc2ccccc2 62a_100000765856_100009818257 [0,0,0,0,0,0|4,0,0]=4 14 B18R2.8976 Cc1cc(ncc1F)SCCc2ccccc2 62a_100009818257_100011218657 [0,0,0,0,0,0|4,0,0]=4 15 B18R2.8976 Cc1cc(ncc1N)SCCc2ccccc2 62a_100000067204_100011218657 [0,0,0,0,0,0|4,0,0]=4 16 B18R2.8976 Cc1cc(ncc1N)SCCc2ccccc2 62a_100000765856_100000067204 [0,0,0,0,0,0|4,0,0]=4 17 B18R2.8976 Cc1cc(ncc1O)SCCc2ccccc2 62a_100000765856_100000692680 [0,0,0,0,0,0|3,0,1]=4 18 B18R2.8976 Cc1cc(nnc1N)SCCc2ccccc2 62a_100000765856_100153394926 [0,0,0,0,0,0|3,0,1]=4 19 B18R2.8976 Cc1cc(nnc1N)SCCc2ccccc2 62a_100153394926_100011218657 [0,0,0,0,0,0|3,0,1]=4 20 B18R2.8976 Cc1ccc(cc1O)NCCc2ccccc2 34a_100000759471_100000765856 [0,0,0,0,0,0|4,0,0]=4 21 B18R2.8976 Cc1ccc(cc1O)NCCc2ccccc2 7a_100000759471_100000765856 [0,0,0,0,0,0|4,0,0]=4 22 B18R2.8976 Cc1ccc(cc1O)SCCc2ccccc2 62a_100000685420_100011218657 [0,0,0,0,0,0|4,0,0]=4 23 B18R2.8976 Cc1ccc(cc1O)SCCc2ccccc2 62a_100000765856_100000685420 [0,0,0,0,0,0|4,0,0]=4 24 B18R2.8976 Cc1cnc(cc1Br)CNCc2ccccc2 207a_100015324214_100010174032 [0,0,0,0,0,0|4,0,0]=4 25 B18R2.8976 Cc1cnc(cc1Br)CNCc2ccccc2 270004a_100015324214_100010174032 [0,0,0,0,0,0|4,0,0]=4 26 B18R2.8976 Cc1cnc(cc1Br)COCc2ccccc2 34a_100010113723_100015291786 [0,0,0,0,0,0|4,0,0]=4 27 B18R2.8976 Cc1cnc(cc1Br)COCc2ccccc2 7a_100010113723_100000211182 [0,0,0,0,0,0|4,0,0]=4 28 B18R2.8976 Cc1cnc(cc1Br)OCCc2ccccc2 34a_100009831917_100000765856 [0,0,0,0,0,0|4,0,0]=4 29 B18R2.8976 Cc1cnc(cc1C)SCCc2ccccc2 62a_100000765856_100009850809 [0,0,0,0,0,0|4,0,0]=4 30 B18R2.8976 Cc1cnc(cc1C)SCCc2ccccc2 62a_100009850809_100011218657 [0,0,0,0,0,0|4,0,0]=4 31 B18R2.8976 Cc1cnc(cc1Cl)COCc2ccccc2 34a_200000144627_100015291786 [0,0,0,0,0,0|4,0,0]=4 32 B18R2.8976 Cc1cnc(cc1Cl)COCc2ccccc2 7a_200000144627_100000211182 [0,0,0,0,0,0|4,0,0]=4 33 B18R2.8976 Cc1cnc(cc1F)NCCc2ccccc2 27a_100000106460_100009841206 [0,0,0,0,0,0|4,0,0]=4 34 B18R2.8976 Cc1cnc(cc1F)SCCc2ccccc2 62a_100000765856_100009841206 [0,0,0,0,0,0|4,0,0]=4 35 B18R2.8976 Cc1cnc(cc1F)SCCc2ccccc2 62a_100009841206_100011218657 [0,0,0,0,0,0|4,0,0]=4 36 B18R2.8976 Cc1cnc(cc1N)SCCc2ccccc2 62a_100000126663_100011218657 [0,0,0,0,0,0|4,0,0]=4 37 B18R2.8976 Cc1cnc(cc1N)SCCc2ccccc2 62a_100000765856_100000126663 [0,0,0,0,0,0|4,0,0]=4 38 B18R2.8976 Cc1cnc(cc1O)C=CCc2ccccc2 271570a_200016263579_100000704368 [0,0,0,0,0,0|2,0,2]=4 39 B18R2.8976 Cc1cnc(cc1O)SCCc2ccccc2 62a_100000704368_100011218657 [0,0,0,0,0,0|3,0,0]=3 40 B18R2.8976 Cc1cnc(cc1O)SCCc2ccccc2 62a_100000765856_100000704368 [0,0,0,0,0,0|3,0,0]=3 41 B18R2.8976 Cc1cnc(cc1O)SCCc2ccccn2 62a_100000704368_100015183660 [0,0,0,0,0,0|4,0,0]=4 42 B18R2.8976 Cc1cnc(cc1O)SCCc2ccccn2 62a_100015183660_100000704368 [0,0,0,0,0,0|4,0,0]=4 43 B18R2.8976 Cc1cnc(cc1O)SCCc2cccnc2 62a_100000704368_200011713674 [0,0,0,0,0,0|4,0,0]=4 44 B18R2.8976 Cc1cnc(cc1O)SCCc2cccnc2 62a_200011713674_100000704368 [0,0,0,0,0,0|4,0,0]=4 45 B18R2.8976 Cc1cnc(cc1O)SCCc2ccncc2 62a_100000704368_100000723409 [0,0,0,0,0,0|4,0,0]=4 46 B18R2.8976 Cc1cnc(cc1O)SCCc2ccncc2 62a_100000723409_100000704368 [0,0,0,0,0,0|4,0,0]=4 47 B18R2.8976 Cc1cnc(cc1O)SCSc2ccccc2 62a_100000704368_100011218342 [0,0,0,0,0,0|4,0,0]=4 48 B18R2.8976 Cc1cnc(cc1O)SCSc2ccccc2 62a_100011218342_100000704368 [0,0,0,0,0,0|4,0,0]=4 49 B18R2.8976 Cc1nc(c[nH]c1=O)SCCc2ccccc2 62a_100000765856_100010363809 [0,0,0,0,0,0|4,0,0]=4 50 B18R2.8976 Cc1nc(c[nH]c1=O)SCCc2ccccc2 62a_100010363809_100011218657 [0,0,0,0,0,0|4,0,0]=4 51 B18R2.8976 Cc1ncc(cc1O)SCCc2ccccc2 62a_100000765856_100009864810 [0,0,0,0,0,0|3,0,1]=4 52 B18R2.8976 Cc1ncc(cc1O)SCCc2ccccc2 62a_100009864810_100011218657 [0,0,0,0,0,0|3,0,1]=4 53 B18R2.8976 Clc1cc(ncc1Br)OCCc2ccccc2 34a_100010369989_100000765856 [0,0,0,0,0,0|4,0,0]=4 54 B18R2.8976 Clc1cnc(cc1Cl)OCCc2ccccc2 34a_200000099200_100000765856 [0,0,0,0,0,0|4,0,0]=4 55 B18R2.8976 Cn1cc(ncc1=O)SCCc2ccccc2 62a_100000765856_100009843036 [0,0,0,0,0,0|4,0,0]=4 56 B18R2.8976 Cn1cc(ncc1=O)SCCc2ccccc2 62a_100009843036_100011218657 [0,0,0,0,0,0|4,0,0]=4 57 B18R2.8976 Nc1cc(n[nH]c1=O)C=CCc2ccccc2 271570a_200016263579_100000102183 [0,0,0,0,0,0|1,0,2]=3 58 B18R2.8976 Nc1cc(n[nH]c1=O)SCCc2ccccc2 62a_100000765856_100000102183 [0,0,0,0,0,0|2,0,0]=2 59 B18R2.8976 Nc1cc(n[nH]c1=O)SCCc2ccccn2 62a_100015183660_100000102183 [0,0,0,0,0,0|3,0,0]=3 60 B18R2.8976 Nc1cc(n[nH]c1=O)SCCc2cccnc2 62a_200011713674_100000102183 [0,0,0,0,0,0|3,0,0]=3 61 B18R2.8976 Nc1cc(n[nH]c1=O)SCCc2ccncc2 62a_100000723409_100000102183 [0,0,0,0,0,0|3,0,0]=3 62 B18R2.8976 Nc1cc(n[nH]c1=O)SCSc2ccccc2 62a_100011218342_100000102183 [0,0,0,0,0,0|3,0,0]=3 63 B18R2.8976 Nc1cc(ncc1F)SCCc2ccccc2 62a_100000126464_100011218657 [0,0,0,0,0,0|4,0,0]=4 64 B18R2.8976 Nc1cc(ncc1F)SCCc2ccccc2 62a_100000765856_100000126464 [0,0,0,0,0,0|4,0,0]=4 65 B18R2.8976 Nc1cc(ncc1O)SCCc2ccccc2 62a_100000765856_100009819941 [0,0,0,0,0,0|3,0,1]=4 66 B18R2.8976 Nc1cc(ncc1O)SCCc2ccccc2 62a_100009819941_100011218657 [0,0,0,0,0,0|3,0,1]=4 67 B18R2.8976 Nc1ccc(cc1O)SCCc2ccccc2 62a_100000739049_100011218657 [0,0,0,0,0,0|4,0,0]=4 68 B18R2.8976 Nc1ccc(cc1O)SCCc2ccccc2 62a_100000765856_100000739049 [0,0,0,0,0,0|4,0,0]=4 69 B18R2.8976 Nc1cnc(cc1N)SCCc2ccccc2 62a_100000067514_100011218657 [0,0,0,0,0,0|4,0,0]=4 70 B18R2.8976 Nc1cnc(cc1N)SCCc2ccccc2 62a_100000765856_100000067514 [0,0,0,0,0,0|4,0,0]=4 71 B18R2.8976 Nc1ncc(cc1O)SCCc2ccccc2 62a_100000765856_100009819042 [0,0,0,0,0,0|3,0,1]=4 72 B18R2.8976 Nc1ncc(cc1O)SCCc2ccccc2 62a_100009819042_100011218657 [0,0,0,0,0,0|3,0,1]=4 73 B18R2.8976 O=c1[nH]cc(cc1Br)C=CCc2ccccc2 271570a_200016263579_100010125443 [0,0,0,0,0,0|2,0,2]=4 74 B18R2.8976 O=c1[nH]cc(cc1Br)SCCc2ccccc2 62a_100000765856_100010125443 [0,0,0,0,0,0|3,0,0]=3 75 B18R2.8976 O=c1[nH]cc(cc1Br)SCCc2ccccc2 62a_100010125443_100011218657 [0,0,0,0,0,0|3,0,0]=3 76 B18R2.8976 O=c1[nH]cc(cc1Br)SCCc2ccccn2 62a_100010125443_100015183660 [0,0,0,0,0,0|4,0,0]=4 77 B18R2.8976 O=c1[nH]cc(cc1Br)SCCc2ccccn2 62a_100015183660_100010125443 [0,0,0,0,0,0|4,0,0]=4 78 B18R2.8976 O=c1[nH]cc(cc1Br)SCCc2cccnc2 62a_100010125443_200011713674 [0,0,0,0,0,0|4,0,0]=4 79 B18R2.8976 O=c1[nH]cc(cc1Br)SCCc2cccnc2 62a_200011713674_100010125443 [0,0,0,0,0,0|4,0,0]=4 80 B18R2.8976 O=c1[nH]cc(cc1Br)SCCc2ccncc2 62a_100000723409_100010125443 [0,0,0,0,0,0|4,0,0]=4 81 B18R2.8976 O=c1[nH]cc(cc1Br)SCCc2ccncc2 62a_100010125443_100000723409 [0,0,0,0,0,0|4,0,0]=4 82 B18R2.8976 O=c1[nH]cc(cc1Br)SCSc2ccccc2 62a_100010125443_100011218342 [0,0,0,0,0,0|4,0,0]=4 83 B18R2.8976 O=c1[nH]cc(cc1Br)SCSc2ccccc2 62a_100011218342_100010125443 [0,0,0,0,0,0|4,0,0]=4 84 B18R2.8976 O=c1[nH]cc(cc1Cl)CNCc2ccccc2 207a_100015324214_100000051075 [0,0,0,0,0,0|3,0,0]=3 85 B18R2.8976 O=c1[nH]cc(cc1Cl)CNCc2ccccc2 270004a_100015324214_100000051075 [0,0,0,0,0,0|3,0,0]=3 86 B18R2.8976 O=c1[nH]cc(cc1Cl)CNCc2ccccn2 270004a_100000210449_100000051075 [0,0,0,0,0,0|4,0,0]=4 87 B18R2.8976 O=c1[nH]cc(cc1Cl)CNCc2cccnc2 207a_100000210453_100000051075 [0,0,0,0,0,0|4,0,0]=4 88 B18R2.8976 O=c1[nH]cc(cc1Cl)CNCc2cccnc2 270004a_100000210453_100000051075 [0,0,0,0,0,0|4,0,0]=4 89 B18R2.8976 O=c1[nH]cc(cc1F)C=CCc2ccccc2 271570a_200016263579_100000723523 [0,0,0,0,0,0|2,0,2]=4 90 B18R2.8976 O=c1[nH]cc(cc1F)SCCc2ccccc2 62a_100000723523_100011218657 [0,0,0,0,0,0|3,0,0]=3 91 B18R2.8976 O=c1[nH]cc(cc1F)SCCc2ccccc2 62a_100000765856_100000723523 [0,0,0,0,0,0|3,0,0]=3 92 B18R2.8976 O=c1[nH]cc(cc1F)SCCc2ccccn2 62a_100000723523_100015183660 [0,0,0,0,0,0|4,0,0]=4 93 B18R2.8976 O=c1[nH]cc(cc1F)SCCc2ccccn2 62a_100015183660_100000723523 [0,0,0,0,0,0|4,0,0]=4 94 B18R2.8976 O=c1[nH]cc(cc1F)SCCc2cccnc2 62a_100000723523_200011713674 [0,0,0,0,0,0|4,0,0]=4 95 B18R2.8976 O=c1[nH]cc(cc1F)SCCc2cccnc2 62a_200011713674_100000723523 [0,0,0,0,0,0|4,0,0]=4 96 B18R2.8976 O=c1[nH]cc(cc1F)SCCc2ccncc2 62a_100000723409_100000723523 [0,0,0,0,0,0|4,0,0]=4 97 B18R2.8976 O=c1[nH]cc(cc1F)SCCc2ccncc2 62a_100000723523_100000723409 [0,0,0,0,0,0|4,0,0]=4 98 B18R2.8976 O=c1[nH]cc(cc1F)SCSc2ccccc2 62a_100000723523_100011218342 [0,0,0,0,0,0|4,0,0]=4 99 B18R2.8976 O=c1[nH]cc(cc1F)SCSc2ccccc2 62a_100011218342_100000723523 [0,0,0,0,0,0|4,0,0]=4 100 B18R2.8976 O=c1[nH]cc(cc1O)C=CCc2ccccc2 271570a_200016263579_100009814561 [0,0,0,0,0,0|1,0,2]=3 101 B18R2.8976 O=c1[nH]cc(cc1O)SCCc2ccccc2 62a_100000765856_100009814561 [0,0,0,0,0,0|2,0,0]=2 102 B18R2.8976 O=c1[nH]cc(cc1O)SCCc2ccccn2 62a_100015183660_100009814561 [0,0,0,0,0,0|3,0,0]=3 103 B18R2.8976 O=c1[nH]cc(cc1O)SCCc2cccnc2 62a_200011713674_100009814561 [0,0,0,0,0,0|3,0,0]=3 104 B18R2.8976 O=c1[nH]cc(cc1O)SCCc2ccncc2 62a_100000723409_100009814561 [0,0,0,0,0,0|3,0,0]=3 105 B18R2.8976 O=c1[nH]cc(cc1O)SCSc2ccccc2 62a_100011218342_100009814561 [0,0,0,0,0,0|3,0,0]=3 106 B18R2.8976 Oc1cc(ccc1Br)SCCc2ccccc2 62a_100000765856_100012356990 [0,0,0,0,0,0|4,0,0]=4 107 B18R2.8976 Oc1cc(ccc1Br)SCCc2ccccc2 62a_100012356990_100011218657 [0,0,0,0,0,0|4,0,0]=4 108 B18R2.8976 Oc1cc(ccc1Cl)CNCc2ccccc2 34a_100020636435_100015291786 [0,0,0,0,0,0|4,0,0]=4 109 B18R2.8976 Oc1cc(ccc1Cl)NCCc2ccccc2 34a_100011934209_100000765856 [0,0,0,0,0,0|4,0,0]=4 110 B18R2.8976 Oc1cc(ccc1Cl)SCCc2ccccc2 62a_100000765856_100011356854 [0,0,0,0,0,0|4,0,0]=4 111 B18R2.8976 Oc1cc(ccc1Cl)SCCc2ccccc2 62a_100011356854_100011218657 [0,0,0,0,0,0|4,0,0]=4 112 B18R2.8976 Oc1cc(ccc1F)CNCc2ccccc2 207a_100160469508_100015611070 [0,0,0,0,0,0|4,0,0]=4 113 B18R2.8976 Oc1cc(ccc1F)CNCc2ccccc2 270004a_100160469508_100015611070 [0,0,0,0,0,0|4,0,0]=4 114 B18R2.8976 Oc1cc(ccc1F)CNCc2ccccc2 34a_100160469508_100015291786 [0,0,0,0,0,0|4,0,0]=4 115 B18R2.8976 Oc1cc(ccc1F)NCCc2ccccc2 34a_100012017398_100000765856 [0,0,0,0,0,0|4,0,0]=4 116 B18R2.8976 Oc1cc(ccc1F)NCCc2ccccc2 7a_100012017398_100000765856 [0,0,0,0,0,0|4,0,0]=4 117 B18R2.8976 Oc1cc(ccc1F)SCCc2ccccc2 62a_100000686035_100011218657 [0,0,0,0,0,0|4,0,0]=4 118 B18R2.8976 Oc1cc(ccc1F)SCCc2ccccc2 62a_100000765856_100000686035 [0,0,0,0,0,0|4,0,0]=4 119 B18R2.8976 Oc1cc(cnc1F)SCCc2ccccc2 62a_100000765856_100009819871 [0,0,0,0,0,0|3,0,1]=4 120 B18R2.8976 Oc1cc(cnc1F)SCCc2ccccc2 62a_100009819871_100011218657 [0,0,0,0,0,0|3,0,1]=4 121 B18R2.8976 Oc1cc(ncc1F)C=CCc2ccccc2 271570a_200016263579_100009854642 [0,0,0,0,0,0|2,0,2]=4 122 B18R2.8976 Oc1cc(ncc1F)SCCc2ccccc2 62a_100000765856_100009854642 [0,0,0,0,0,0|3,0,0]=3 123 B18R2.8976 Oc1cc(ncc1F)SCCc2ccccc2 62a_100009854642_100011218657 [0,0,0,0,0,0|3,0,0]=3 124 B18R2.8976 Oc1cc(ncc1F)SCCc2ccccn2 62a_100009854642_100015183660 [0,0,0,0,0,0|4,0,0]=4 125 B18R2.8976 Oc1cc(ncc1F)SCCc2ccccn2 62a_100015183660_100009854642 [0,0,0,0,0,0|4,0,0]=4 126 B18R2.8976 Oc1cc(ncc1F)SCCc2cccnc2 62a_100009854642_200011713674 [0,0,0,0,0,0|4,0,0]=4 127 B18R2.8976 Oc1cc(ncc1F)SCCc2cccnc2 62a_200011713674_100009854642 [0,0,0,0,0,0|4,0,0]=4 128 B18R2.8976 Oc1cc(ncc1F)SCCc2ccncc2 62a_100000723409_100009854642 [0,0,0,0,0,0|4,0,0]=4 129 B18R2.8976 Oc1cc(ncc1F)SCCc2ccncc2 62a_100009854642_100000723409 [0,0,0,0,0,0|4,0,0]=4 130 B18R2.8976 Oc1cc(ncc1F)SCSc2ccccc2 62a_100009854642_100011218342 [0,0,0,0,0,0|4,0,0]=4 131 B18R2.8976 Oc1cc(ncc1F)SCSc2ccccc2 62a_100011218342_100009854642 [0,0,0,0,0,0|4,0,0]=4 132 B18R2.8976 Oc1ccc(cc1O)CCOc2ccccc2 7a_100000210340_200010393615 [0,0,0,0,0,0|3,0,1]=4 133 B18R2.8976 Oc1ccc(cc1O)CCSc2ccccc2 62a_100000719477_200010393615 [0,0,0,0,0,0|3,0,1]=4 134 B18R2.8976 Oc1ccc(cc1O)CNCc2ccccc2 34a_100000010075_100015291786 [0,0,0,0,0,0|3,0,1]=4 135 B18R2.8976 Oc1ccc(cc1O)NCCc2ccccc2 34a_100102946323_100000765856 [0,0,0,0,0,0|3,0,1]=4 136 B18R2.8976 Oc1ccc(cc1O)SCCc2ccccc2 62a_100000765856_100009813601 [0,0,0,0,0,0|3,0,1]=4 137 B18R2.8976 Oc1nc(ncc1F)NCCc2ccccc2 27a_100000106460_100011995740 [0,0,0,0,0,0|4,0,0]=4 138 B18R2.8976 Oc1nc(ncc1F)SCCc2ccccc2 62a_100000765856_100011995740 [0,0,0,0,0,0|4,0,0]=4 139 B17R2.216 Brc1ccc(nc1)CNCc2ccccc2 207a_100015324214_100000754260 [1,0,0,0,0,0|3,0,0]=4 140 B17R2.216 Brc1ccc(nc1)CNCc2ccccc2 2230a_100015324214_100000702658 [1,0,0,0,0,0|3,0,0]=4 141 B17R2.216 Brc1ccc(nc1)CNCc2ccccc2 270004a_100015324214_100000754260 [1,0,0,0,0,0|3,0,0]=4 142 B17R2.216 Brc1ccc(nc1)CNCc2ccccc2 34a_100015188789_100015291786 [1,0,0,0,0,0|3,0,0]=4 143 B17R2.216 Brc1ccc(nc1)CNCc2ccccc2 34a_100015324214_100000702658 [1,0,0,0,0,0|3,0,0]=4 144 B17R2.216 Brc1ccc(nc1)COCc2ccccc2 34a_100000210790_100000702658 [1,0,0,0,0,0|3,0,0]=4 145 B17R2.216 Brc1ccc(nc1)COCc2ccccc2 34a_100000754261_100015291786 [1,0,0,0,0,0|3,0,0]=4 146 B17R2.216 Brc1ccc(nc1)COCc2ccccc2 7a_100000210790_100000702658 [1,0,0,0,0,0|3,0,0]=4 147 B17R2.216 Brc1ccc(nc1)CSCc2ccccc2 62a_100000211182_100000702658 [1,0,0,0,0,0|3,0,0]=4 148 B17R2.216 Brc1ccc(nc1)CSCc2ccccc2 62a_100000702658_100015291786 [1,0,0,0,0,0|3,0,0]=4 149 B17R2.216 Brc1ccc(nc1)NCCc2ccccc2 27a_100000106460_100000686858 [1,0,0,0,0,0|3,0,0]=4 150 B17R2.216 Brc1ccc(nc1)SCCc2ccccc2 62a_100000686858_100011218657 [1,0,0,0,0,0|3,0,0]=4 151 B17R2.216 Brc1ccc(nc1)SCCc2ccccc2 62a_100000765856_100000686858 [1,0,0,0,0,0|3,0,0]=4 152 B17R2.216 Cc1ccc(nc1)CNCc2ccccc2 207a_100015324214_100000050478 [1,0,0,0,0,0|3,0,0]=4 153 B17R2.216 Cc1ccc(nc1)CNCc2ccccc2 2230a_100015324214_100000691093 [1,0,0,0,0,0|3,0,0]=4 154 B17R2.216 Cc1ccc(nc1)CNCc2ccccc2 270004a_100015324214_100000050478 [1,0,0,0,0,0|3,0,0]=4 155 B17R2.216 Cc1ccc(nc1)CNCc2ccccc2 34a_100015187455_100015291786 [1,0,0,0,0,0|3,0,0]=4 156 B17R2.216 Cc1ccc(nc1)CNCc2ccccc2 34a_100015324214_100000691093 [1,0,0,0,0,0|3,0,0]=4 157 B17R2.216 Cc1ccc(nc1)COCc2ccccc2 34a_100000210790_100000691093 [1,0,0,0,0,0|3,0,0]=4 158 B17R2.216 Cc1ccc(nc1)COCc2ccccc2 34a_100012001401_100015291786 [1,0,0,0,0,0|3,0,0]=4 159 B17R2.216 Cc1ccc(nc1)COCc2ccccc2 7a_100000210790_100000691093 [1,0,0,0,0,0|3,0,0]=4 160 B17R2.216 Cc1ccc(nc1)CSCc2ccccc2 62a_100000211182_100000691093 [1,0,0,0,0,0|3,0,0]=4 161 B17R2.216 Cc1ccc(nc1)CSCc2ccccc2 62a_100000691093_100015291786 [1,0,0,0,0,0|3,0,0]=4 162 B17R2.216 Cc1ccc(nc1)OCCc2ccccc2 34a_100000759353_100000765856 [1,0,0,0,0,0|3,0,0]=4 163 B17R2.216 Cc1ccc(nc1)SCCc2ccccc2 62a_100000765856_100000754016 [1,0,0,0,0,0|3,0,0]=4 164 B17R2.216 Cc1ccc(nc1)SCCc2ccccc2 62a_100011192072_100011218657 [1,0,0,0,0,0|3,0,0]=4 165 B17R2.216 Cc1ccc(nn1)NCCc2ccccc2 27a_100000106460_100000744512 [1,0,0,0,0,0|2,0,1]=4 166 B17R2.216 Cc1ccc(nn1)SCCc2ccccc2 62a_100000744512_100011218657 [1,0,0,0,0,0|2,0,1]=4 167 B17R2.216 Cc1ccc(nn1)SCCc2ccccc2 62a_100000765856_100000744512 [1,0,0,0,0,0|2,0,1]=4 168 B17R2.216 Clc1ccc(nc1)CNCc2ccccc2 207a_100015324214_100011361569 [1,0,0,0,0,0|3,0,0]=4 169 B17R2.216 Clc1ccc(nc1)CNCc2ccccc2 2230a_100015324214_100012066911 [1,0,0,0,0,0|3,0,0]=4 170 B17R2.216 Clc1ccc(nc1)CNCc2ccccc2 270004a_100000697193_100015611070 [1,0,0,0,0,0|3,0,0]=4 171 B17R2.216 Clc1ccc(nc1)CNCc2ccccc2 270004a_100015324214_100011361569 [1,0,0,0,0,0|3,0,0]=4 172 B17R2.216 Clc1ccc(nc1)CNCc2ccccc2 34a_100000697193_100015291786 [1,0,0,0,0,0|3,0,0]=4 173 B17R2.216 Clc1ccc(nc1)CNCc2ccccc2 34a_100015324214_100012066911 [1,0,0,0,0,0|3,0,0]=4 174 B17R2.216 Clc1ccc(nc1)COCc2ccccc2 34a_100000210790_100012066911 [1,0,0,0,0,0|3,0,0]=4 175 B17R2.216 Clc1ccc(nc1)COCc2ccccc2 34a_100000703999_100015291786 [1,0,0,0,0,0|3,0,0]=4 176 B17R2.216 Clc1ccc(nc1)COCc2ccccc2 7a_100000210790_100012066911 [1,0,0,0,0,0|3,0,0]=4 177 B17R2.216 Clc1ccc(nc1)CSCc2ccccc2 62a_100000211182_100000697101 [1,0,0,0,0,0|3,0,0]=4 178 B17R2.216 Clc1ccc(nc1)CSCc2ccccc2 62a_100012066911_100015291786 [1,0,0,0,0,0|3,0,0]=4 179 B17R2.216 Clc1ccc(nc1)OCCc2ccccc2 34a_100011215309_100000765856 [1,0,0,0,0,0|3,0,0]=4 180 B17R2.216 Clc1ccc(nc1)SCCc2ccccc2 62a_100000765856_100011356976 [1,0,0,0,0,0|3,0,0]=4 181 B17R2.216 Clc1ccc(nc1)SCCc2ccccc2 62a_100011356976_100011218657 [1,0,0,0,0,0|3,0,0]=4 182 B17R2.216 Clc1ccc(nn1)CNCc2ccccc2 2230a_100015324214_100016992710 [1,0,0,0,0,0|2,0,1]=4 183 B17R2.216 Clc1ccc(nn1)CNCc2ccccc2 270004a_100015324214_100000044651 [1,0,0,0,0,0|2,0,1]=4 184 B17R2.216 Clc1ccc(nn1)CNCc2ccccc2 34a_100015324214_100016992710 [1,0,0,0,0,0|2,0,1]=4 185 B17R2.216 Clc1ccc(nn1)COCc2ccccc2 34a_100000210790_100016992710 [1,0,0,0,0,0|2,0,1]=4 186 B17R2.216 Clc1ccc(nn1)COCc2ccccc2 7a_100000210790_100016992710 [1,0,0,0,0,0|2,0,1]=4 187 B17R2.216 Clc1ccc(nn1)CSCc2ccccc2 62a_100000211182_100016992710 [1,0,0,0,0,0|2,0,1]=4 188 B17R2.216 Clc1ccc(nn1)CSCc2ccccc2 62a_100016992710_100015291786 [1,0,0,0,0,0|2,0,1]=4 189 B17R2.216 Clc1ccc(nn1)SCCc2ccccc2 62a_100000068654_100011218657 [1,0,0,0,0,0|2,0,1]=4 190 B17R2.216 Clc1ccc(nn1)SCCc2ccccc2 62a_100000765856_100000068654 [1,0,0,0,0,0|2,0,1]=4 191 B17R2.216 Fc1ccc(nc1)CNCc2ccccc2 207a_100015324214_100011934744 [1,0,0,0,0,0|3,0,0]=4 192 B17R2.216 Fc1ccc(nc1)CNCc2ccccc2 2230a_100015324214_100000703193 [1,0,0,0,0,0|3,0,0]=4 193 B17R2.216 Fc1ccc(nc1)CNCc2ccccc2 270004a_100015324214_100011934744 [1,0,0,0,0,0|3,0,0]=4 194 B17R2.216 Fc1ccc(nc1)CNCc2ccccc2 34a_100015324214_100000703193 [1,0,0,0,0,0|3,0,0]=4 195 B17R2.216 Fc1ccc(nc1)CNCc2ccccc2 34a_100020620131_100015291786 [1,0,0,0,0,0|3,0,0]=4 196 B17R2.216 Fc1ccc(nc1)COCc2ccccc2 34a_100000210790_100000703193 [1,0,0,0,0,0|3,0,0]=4 197 B17R2.216 Fc1ccc(nc1)COCc2ccccc2 34a_100011999454_100015291786 [1,0,0,0,0,0|3,0,0]=4 198 B17R2.216 Fc1ccc(nc1)COCc2ccccc2 7a_100000210790_100000703193 [1,0,0,0,0,0|3,0,0]=4 199 B17R2.216 Fc1ccc(nc1)CSCc2ccccc2 62a_100000211182_100000703193 [1,0,0,0,0,0|3,0,0]=4 200 B17R2.216 Fc1ccc(nc1)CSCc2ccccc2 62a_100000703193_100015291786 [1,0,0,0,0,0|3,0,0]=4 201 B17R2.216 Fc1ccc(nc1)OCCc2ccccc2 34a_100000742473_100000765856 [1,0,0,0,0,0|3,0,0]=4 202 B17R2.216 Fc1ccc(nc1)SCCc2ccccc2 62a_100000744514_100011218657 [1,0,0,0,0,0|3,0,0]=4 203 B17R2.216 Fc1ccc(nc1)SCCc2ccccc2 62a_100000765856_100000744514 [1,0,0,0,0,0|3,0,0]=4 204 B17R2.216 Nc1ccc(nc1)COCc2ccccc2 34a_100011998161_100015291786 [1,0,0,0,0,0|3,0,0]=4 205 B17R2.216 Nc1ccc(nc1)OCCc2ccccc2 34a_100000729260_100000765856 [1,0,0,0,0,0|3,0,0]=4 206 B17R2.216 Nc1ccc(nc1)SCCc2ccccc2 62a_100000737798_100011218657 [1,0,0,0,0,0|3,0,0]=4 207 B17R2.216 Nc1ccc(nc1)SCCc2ccccc2 62a_100000765856_100000737798 [1,0,0,0,0,0|3,0,0]=4 208 B17R2.216 Nc1ccc(nn1)SCCc2ccccc2 62a_100000765856_100010219413 [1,0,0,0,0,0|2,0,1]=4 209 B17R2.216 Nc1ccc(nn1)SCCc2ccccc2 62a_100010219413_100011218657 [1,0,0,0,0,0|2,0,1]=4 210 B17R2.216 O=c1ccc(c[nH]1)C=CCc2ccccc2 271570a_200016263579_100000212171 [1,0,0,0,0,0|1,0,2]=4 211 B17R2.216 O=c1ccc(c[nH]1)COCc2ccccc2 34a_100011999846_100015291786 [1,0,0,0,0,0|2,0,0]=3 212 B17R2.216 O=c1ccc(c[nH]1)COCc2ccccn2 34a_100011999846_100000721315 [1,0,0,0,0,0|3,0,0]=4 213 B17R2.216 O=c1ccc(c[nH]1)COCc2cccnc2 34a_100011999846_100000733263 [1,0,0,0,0,0|3,0,0]=4 214 B17R2.216 O=c1ccc(c[nH]1)OCCc2ccccc2 34a_100000075641_100000765856 [1,0,0,0,0,0|2,0,0]=3 215 B17R2.216 O=c1ccc(c[nH]1)SCCc2ccccc2 62a_100000212171_100011218657 [1,0,0,0,0,0|2,0,0]=3 216 B17R2.216 O=c1ccc(c[nH]1)SCCc2ccccc2 62a_100000765856_100000212171 [1,0,0,0,0,0|2,0,0]=3 217 B17R2.216 O=c1ccc(c[nH]1)SCCc2ccccn2 62a_100000212171_100015183660 [1,0,0,0,0,0|3,0,0]=4 218 B17R2.216 O=c1ccc(c[nH]1)SCCc2ccccn2 62a_100015183660_100000212171 [1,0,0,0,0,0|3,0,0]=4 219 B17R2.216 O=c1ccc(c[nH]1)SCCc2cccnc2 62a_100000212171_200011713674 [1,0,0,0,0,0|3,0,0]=4 220 B17R2.216 O=c1ccc(c[nH]1)SCCc2cccnc2 62a_200011713674_100000212171 [1,0,0,0,0,0|3,0,0]=4 221 B17R2.216 O=c1ccc(c[nH]1)SCCc2ccncc2 62a_100000212171_100000723409 [1,0,0,0,0,0|3,0,0]=4 222 B17R2.216 O=c1ccc(c[nH]1)SCCc2ccncc2 62a_100000723409_100000212171 [1,0,0,0,0,0|3,0,0]=4 223 B17R2.216 O=c1ccc(c[nH]1)SCSc2ccccc2 62a_100000212171_100011218342 [1,0,0,0,0,0|3,0,0]=4 224 B17R2.216 O=c1ccc(c[nH]1)SCSc2ccccc2 62a_100011218342_100000212171 [1,0,0,0,0,0|3,0,0]=4 225 B17R2.216 O=c1ccc(n[nH]1)C=CCc2ccccc2 271570a_200016263579_100009820020 [1,0,0,0,0,0|0,0,2]=3 226 B17R2.216 O=c1ccc(n[nH]1)C=NNc2ccccc2 4a_100015195140_100011361533 [1,0,0,0,0,0|2,0,1]=4 227 B17R2.216 O=c1ccc(n[nH]1)CNCc2ccccc2 207a_100015324214_100011361533 [1,0,0,0,0,0|1,0,0]=2 228 B17R2.216 O=c1ccc(n[nH]1)CNCc2ccccc2 270004a_100015324214_100011361533 [1,0,0,0,0,0|1,0,0]=2 229 B17R2.216 O=c1ccc(n[nH]1)CNCc2ccccn2 270004a_100000210449_100011361533 [1,0,0,0,0,0|2,0,0]=3 230 B17R2.216 O=c1ccc(n[nH]1)CNCc2cccnc2 207a_100000210453_100011361533 [1,0,0,0,0,0|2,0,0]=3 231 B17R2.216 O=c1ccc(n[nH]1)CNCc2cccnc2 270004a_100000210453_100011361533 [1,0,0,0,0,0|2,0,0]=3 232 B17R2.216 O=c1ccc(n[nH]1)CNCc2cncnc2 207a_100011243677_100011361533 [1,0,0,0,0,0|3,0,0]=4 233 B17R2.216 O=c1ccc(n[nH]1)CNCc2cncnc2 270004a_100011243677_100011361533 [1,0,0,0,0,0|3,0,0]=4 234 B17R2.216 O=c1ccc(n[nH]1)SCCc2ccccc2 62a_100000765856_100009820020 [1,0,0,0,0,0|1,0,0]=2 235 B17R2.216 O=c1ccc(n[nH]1)SCCc2ccccc2 62a_100009820020_100011218657 [1,0,0,0,0,0|1,0,0]=2 236 B17R2.216 O=c1ccc(n[nH]1)SCCc2ccccn2 62a_100009820020_100015183660 [1,0,0,0,0,0|2,0,0]=3 237 B17R2.216 O=c1ccc(n[nH]1)SCCc2ccccn2 62a_100015183660_100009820020 [1,0,0,0,0,0|2,0,0]=3 238 B17R2.216 O=c1ccc(n[nH]1)SCCc2cccnc2 62a_100009820020_200011713674 [1,0,0,0,0,0|2,0,0]=3 239 B17R2.216 O=c1ccc(n[nH]1)SCCc2cccnc2 62a_200011713674_100009820020 [1,0,0,0,0,0|2,0,0]=3 240 B17R2.216 O=c1ccc(n[nH]1)SCCc2ccncc2 62a_100000723409_100009820020 [1,0,0,0,0,0|2,0,0]=3 241 B17R2.216 O=c1ccc(n[nH]1)SCCc2ccncc2 62a_100009820020_100000723409 [1,0,0,0,0,0|2,0,0]=3 242 B17R2.216 O=c1ccc(n[nH]1)SCSc2ccccc2 62a_100009820020_100011218342 [1,0,0,0,0,0|2,0,0]=3 243 B17R2.216 O=c1ccc(n[nH]1)SCSc2ccccc2 62a_100011218342_100009820020 [1,0,0,0,0,0|2,0,0]=3 244 B17R2.216 O=c1ncc(c[nH]1)SCCc2ccccc2 62a_100000765856_102495366499 [1,0,0,0,0,0|3,0,0]=4 245 B17R2.216 O=c1ncc(c[nH]1)SCCc2ccccc2 62a_102495366499_100011218657 [1,0,0,0,0,0|3,0,0]=4 246 B17R2.216 Oc1ccc(nc1)SCCc2ccccc2 62a_100000685995_100011218657 [1,0,0,0,0,0|2,0,1]=4 247 B17R2.216 Oc1ccc(nc1)SCCc2ccccc2 62a_100000765856_100000744096 [1,0,0,0,0,0|2,0,1]=4 248 B17R2.216 Oc1ccc(nn1)NCCc2ccccc2 271570a_203496583355_100000215314 [1,0,0,0,0,0|1,0,2]=4 249 B17R2.5301 Brc1ccnc(c1)CNCc2ccccc2 2230a_100015324214_100010173614 [1,0,0,0,0,0|3,0,0]=4 250 B17R2.5301 Brc1ccnc(c1)CNCc2ccccc2 270004a_100015324214_100009818557 [1,0,0,0,0,0|3,0,0]=4 251 B17R2.5301 Brc1ccnc(c1)CNCc2ccccc2 34a_100015324214_100010173614 [1,0,0,0,0,0|3,0,0]=4 252 B17R2.5301 Brc1ccnc(c1)COCc2ccccc2 34a_100000210790_100010173614 [1,0,0,0,0,0|3,0,0]=4 253 B17R2.5301 Brc1ccnc(c1)COCc2ccccc2 7a_100000210790_100010173614 [1,0,0,0,0,0|3,0,0]=4 254 B17R2.5301 Brc1ccnc(c1)CSCc2ccccc2 62a_100000211182_100010173614 [1,0,0,0,0,0|3,0,0]=4 255 B17R2.5301 Brc1ccnc(c1)CSCc2ccccc2 62a_100010173614_100015291786 [1,0,0,0,0,0|3,0,0]=4 256 B17R2.5301 Cc1ccnc(c1)CNCc2ccccc2 207a_100015324214_100011361488 [1,0,0,0,0,0|3,0,0]=4 257 B17R2.5301 Cc1ccnc(c1)CNCc2ccccc2 2230a_100015324214_100000718516 [1,0,0,0,0,0|3,0,0]=4 258 B17R2.5301 Cc1ccnc(c1)CNCc2ccccc2 270004a_100015324214_100011361488 [1,0,0,0,0,0|3,0,0]=4 259 B17R2.5301 Cc1ccnc(c1)CNCc2ccccc2 34a_100015324214_100000718516 [1,0,0,0,0,0|3,0,0]=4 260 B17R2.5301 Cc1ccnc(c1)COCc2ccccc2 34a_100000210790_100000718516 [1,0,0,0,0,0|3,0,0]=4 261 B17R2.5301 Cc1ccnc(c1)COCc2ccccc2 34a_100011998357_100015291786 [1,0,0,0,0,0|3,0,0]=4 262 B17R2.5301 Cc1ccnc(c1)COCc2ccccc2 7a_100000210790_100000718516 [1,0,0,0,0,0|3,0,0]=4 263 B17R2.5301 Cc1ccnc(c1)CSCc2ccccc2 62a_100000211182_100000718516 [1,0,0,0,0,0|3,0,0]=4 264 B17R2.5301 Cc1ccnc(c1)CSCc2ccccc2 62a_100000718516_100015291786 [1,0,0,0,0,0|3,0,0]=4 265 B17R2.5301 Cc1ccnc(c1)SCCc2ccccc2 62a_100000750283_100011218657 [1,0,0,0,0,0|3,0,0]=4 266 B17R2.5301 Cc1ccnc(c1)SCCc2ccccc2 62a_100000765856_100000750283 [1,0,0,0,0,0|3,0,0]=4 267 B17R2.5301 Cc1cnnc(c1)COCc2ccccc2 34a_100016212594_100015291786 [1,0,0,0,0,0|2,0,1]=4 268 B17R2.5301 Cc1cnnc(c1)NCCc2ccccc2 27a_100000106460_100000070100 [1,0,0,0,0,0|2,0,1]=4 269 B17R2.5301 Cc1cnnc(c1)OCCc2ccccc2 34a_100000766097_100000765856 [1,0,0,0,0,0|2,0,1]=4 270 B17R2.5301 Cc1cnnc(c1)SCCc2ccccc2 62a_100000070100_100011218657 [1,0,0,0,0,0|2,0,1]=4 271 B17R2.5301 Cc1cnnc(c1)SCCc2ccccc2 62a_100000765856_100000070100 [1,0,0,0,0,0|2,0,1]=4 272 B17R2.5301 Clc1ccnc(c1)CNCc2ccccc2 2230a_100015324214_100016988179 [1,0,0,0,0,0|3,0,0]=4 273 B17R2.5301 Clc1ccnc(c1)CNCc2ccccc2 270004a_100015324214_100011998288 [1,0,0,0,0,0|3,0,0]=4 274 B17R2.5301 Clc1ccnc(c1)CNCc2ccccc2 34a_100015324214_100016988179 [1,0,0,0,0,0|3,0,0]=4 275 B17R2.5301 Clc1ccnc(c1)COCc2ccccc2 34a_100000210790_100016988179 [1,0,0,0,0,0|3,0,0]=4 276 B17R2.5301 Clc1ccnc(c1)COCc2ccccc2 34a_100000748867_100015291786 [1,0,0,0,0,0|3,0,0]=4 277 B17R2.5301 Clc1ccnc(c1)COCc2ccccc2 7a_100000210790_100016988179 [1,0,0,0,0,0|3,0,0]=4 278 B17R2.5301 Clc1ccnc(c1)CSCc2ccccc2 62a_100000211182_100016988179 [1,0,0,0,0,0|3,0,0]=4 279 B17R2.5301 Clc1ccnc(c1)CSCc2ccccc2 62a_100016988179_100015291786 [1,0,0,0,0,0|3,0,0]=4 280 B17R2.5301 Clc1ccnc(c1)SCCc2ccccc2 62a_100000765856_100010167805 [1,0,0,0,0,0|3,0,0]=4 281 B17R2.5301 Clc1ccnc(c1)SCCc2ccccc2 62a_100010167805_100011218657 [1,0,0,0,0,0|3,0,0]=4 282 B17R2.5301 Fc1ccnc(c1)NCCc2ccccc2 27a_100000106460_100000764206 [1,0,0,0,0,0|3,0,0]=4 283 B17R2.5301 Fc1ccnc(c1)SCCc2ccccc2 62a_100000764206_100011218657 [1,0,0,0,0,0|3,0,0]=4 284 B17R2.5301 Fc1ccnc(c1)SCCc2ccccc2 62a_100000765856_100000764206 [1,0,0,0,0,0|3,0,0]=4 285 B17R2.5301 Nc1ccnc(c1)COCc2ccccc2 34a_100000692640_100015291786 [1,0,0,0,0,0|3,0,0]=4 286 B17R2.5301 Nc1ccnc(c1)SCCc2ccccc2 62a_100000765856_100009814236 [1,0,0,0,0,0|3,0,0]=4 287 B17R2.5301 Nc1ccnc(c1)SCCc2ccccc2 62a_100009814236_100011218657 [1,0,0,0,0,0|3,0,0]=4 288 B17R2.5301 Nc1cnnc(c1)SCCc2ccccc2 62a_100000765856_100011996757 [1,0,0,0,0,0|2,0,1]=4 289 B17R2.5301 Nc1cnnc(c1)SCCc2ccccc2 62a_100011996757_100011218657 [1,0,0,0,0,0|2,0,1]=4 290 B17R2.5301 Oc1cc(ncn1)NCCc2ccccc2 27a_100000106460_100000765262 [1,0,0,0,0,0|3,0,0]=4 291 B17R2.5301 Oc1cc(ncn1)SCCc2ccccc2 62a_100000765856_100000765262 [1,0,0,0,0,0|3,0,0]=4 292 B17R2.5301 Oc1cccc(c1)CNCc2ccccc2 207a_100000743036_100015611070 [1,0,0,0,0,0|3,0,0]=4 293 B17R2.5301 Oc1cccc(c1)CNCc2ccccc2 207a_100015324214_100000188321 [1,0,0,0,0,0|3,0,0]=4 294 B17R2.5301 Oc1cccc(c1)CNCc2ccccc2 2230a_100000743036_100015291786 [1,0,0,0,0,0|3,0,0]=4 295 B17R2.5301 Oc1cccc(c1)CNCc2ccccc2 2230a_100015324214_100011660834 [1,0,0,0,0,0|3,0,0]=4 296 B17R2.5301 Oc1cccc(c1)CNCc2ccccc2 270004a_100000743036_100015611070 [1,0,0,0,0,0|3,0,0]=4 297 B17R2.5301 Oc1cccc(c1)CNCc2ccccc2 270004a_100015324214_100000188321 [1,0,0,0,0,0|3,0,0]=4 298 B17R2.5301 Oc1cccc(c1)CNCc2ccccc2 34a_100000743036_100015291786 [1,0,0,0,0,0|3,0,0]=4 299 B17R2.5301 Oc1cccc(c1)CNCc2ccccc2 34a_100015324214_100011660834 [1,0,0,0,0,0|3,0,0]=4 300 B17R2.5301 Oc1cccc(c1)COCc2ccccc2 34a_100000210790_100011660834 [1,0,0,0,0,0|3,0,0]=4 301 B17R2.5301 Oc1cccc(c1)COCc2ccccc2 7a_100000210790_100000084143 [1,0,0,0,0,0|3,0,0]=4 302 B17R2.5301 Oc1cccc(c1)CSCc2ccccc2 62a_100000211182_100011660834 [1,0,0,0,0,0|3,0,0]=4 303 B17R2.5301 Oc1cccc(c1)CSCc2ccccc2 62a_100011660834_100015291786 [1,0,0,0,0,0|3,0,0]=4 304 B17R2.5301 Oc1cccc(c1)NCCc2ccccc2 34a_100000210217_100000765856 [1,0,0,0,0,0|3,0,0]=4 305 B17R2.5301 Oc1cccc(c1)SCCc2ccccc2 62a_100000765856_100000211634 [1,0,0,0,0,0|3,0,0]=4 306 B17R2.5301 Oc1ccnc(c1)C=CCc2ccccc2 271570a_200016263579_100000762945 [1,0,0,0,0,0|1,0,2]=4 307 B17R2.5301 Oc1ccnc(c1)SCCc2ccccc2 62a_100000765856_100000762945 [1,0,0,0,0,0|2,0,0]=3 308 B17R2.5301 Oc1ccnc(c1)SCCc2ccccn2 62a_100015183660_100000762945 [1,0,0,0,0,0|3,0,0]=4 309 B17R2.5301 Oc1ccnc(c1)SCCc2cccnc2 62a_200011713674_100000762945 [1,0,0,0,0,0|3,0,0]=4 310 B17R2.5301 Oc1ccnc(c1)SCCc2ccncc2 62a_100000723409_100000762945 [1,0,0,0,0,0|3,0,0]=4 311 B17R2.5301 Oc1ccnc(c1)SCSc2ccccc2 62a_100011218342_100000762945 [1,0,0,0,0,0|3,0,0]=4 312 B17R2.5301 Oc1ccnc(n1)NCCc2ccccc2 27a_100000106460_100011649813 [1,0,0,0,0,0|3,0,0]=4 313 B17R2.5301 Oc1ccnc(n1)SCCc2ccccc2 62a_100000765856_100011649813 [1,0,0,0,0,0|3,0,0]=4 314 B17R2.5301 Oc1cncc(c1)CNCc2ccccc2 207a_100015324214_100012187055 [1,0,0,0,0,0|2,0,1]=4 315 B17R2.5301 Oc1cncc(c1)CNCc2ccccc2 270004a_100015324214_100012187055 [1,0,0,0,0,0|2,0,1]=4 316 B17R2.5301 Oc1cncc(c1)SCCc2ccccc2 62a_100000754920_100011218657 [1,0,0,0,0,0|2,0,1]=4 317 B17R2.5301 Oc1cncc(c1)SCCc2ccccc2 62a_100000765856_100000754920 [1,0,0,0,0,0|2,0,1]=4 318 B17R2.5301 Oc1cnnc(c1)C=CCc2ccccc2 271570a_200016263579_200010734679 [1,0,0,0,0,0|0,0,3]=4 319 B17R2.5301 Oc1cnnc(c1)SCCc2ccccc2 62a_100000765856_200010734679 [1,0,0,0,0,0|1,0,1]=3 320 B17R2.5301 Oc1cnnc(c1)SCCc2ccccn2 62a_100015183660_200010734679 [1,0,0,0,0,0|2,0,1]=4 321 B17R2.5301 Oc1cnnc(c1)SCCc2cccnc2 62a_200011713674_200010734679 [1,0,0,0,0,0|2,0,1]=4 322 B17R2.5301 Oc1cnnc(c1)SCCc2ccncc2 62a_100000723409_200010734679 [1,0,0,0,0,0|2,0,1]=4 323 B17R2.5301 Oc1cnnc(c1)SCSc2ccccc2 62a_100011218342_200010734679 [1,0,0,0,0,0|2,0,1]=4 324 B19R2.281 CC(Cc1ccccc1)Sc2c[nH]c(=O)c(c2)Br 62a_100010125443_200011218536 [0,1,0,0,0,0|3,0,0]=4 325 B19R2.281 CC(Cc1ccccc1)Sc2c[nH]c(=O)c(c2)Br 62a_200011218536_100010125443 [0,1,0,0,0,0|3,0,0]=4 326 B19R2.281 CC(Cc1ccccc1)Sc2c[nH]c(=O)c(c2)F 62a_100000723523_200011218536 [0,1,0,0,0,0|3,0,0]=4 327 B19R2.281 CC(Cc1ccccc1)Sc2c[nH]c(=O)c(c2)F 62a_200011218536_100000723523 [0,1,0,0,0,0|3,0,0]=4 328 B19R2.281 CC(Cc1ccccc1)Sc2c[nH]c(=O)c(c2)O 62a_200011218536_100009814561 [0,1,0,0,0,0|2,0,0]=3 329 B19R2.281 CC(Cc1ccccc1)Sc2cc(c(=O)[nH]n2)N 62a_200011218536_100000102183 [0,1,0,0,0,0|2,0,0]=3 330 B19R2.281 CC(Cc1ccccc1)Sc2cc(c(cn2)F)O 62a_100009854642_200011218536 [0,1,0,0,0,0|3,0,0]=4 331 B19R2.281 CC(Cc1ccccc1)Sc2cc(c(cn2)F)O 62a_200011218536_100009854642 [0,1,0,0,0,0|3,0,0]=4 332 B19R2.281 CN(Cc1ccccc1)Cc2c[nH]c(=O)c(c2)Cl 270004a_100000186898_100000051075 [0,1,0,0,0,0|3,0,0]=4 333 B19R2.281 Cc1cc(n[nH]c1=O)SC(C)Cc2ccccc2 62a_200011218536_100012187101 [0,1,0,0,0,0|2,0,0]=3 334 B19R2.281 Cc1cnc(cc1O)SC(C)Cc2ccccc2 62a_100000704368_200011218536 [0,1,0,0,0,0|3,0,0]=4 335 B19R2.281 Cc1cnc(cc1O)SC(C)Cc2ccccc2 62a_200011218536_100000704368 [0,1,0,0,0,0|3,0,0]=4 336 B19R2.2863 COc1cc(c[nH]c1=O)C=CCc2ccccc2 271570a_200016263579_100010125397 [0,1,0,0,0,0|1,0,2]=4 337 B19R2.2863 COc1cc(c[nH]c1=O)SCCc2ccccc2 62a_100000765856_100010125397 [0,1,0,0,0,0|2,0,0]=3 338 B19R2.2863 COc1cc(c[nH]c1=O)SCCc2ccccn2 62a_100015183660_100010125397 [0,1,0,0,0,0|3,0,0]=4 339 B19R2.2863 COc1cc(c[nH]c1=O)SCCc2cccnc2 62a_200011713674_100010125397 [0,1,0,0,0,0|3,0,0]=4 340 B19R2.2863 COc1cc(c[nH]c1=O)SCCc2ccncc2 62a_100000723409_100010125397 [0,1,0,0,0,0|3,0,0]=4 341 B19R2.2863 COc1cc(c[nH]c1=O)SCSc2ccccc2 62a_100011218342_100010125397 [0,1,0,0,0,0|3,0,0]=4 342 B19R2.2863 COc1cc(ncc1Br)COCc2ccccc2 34a_100010999569_100015291786 [0,1,0,0,0,0|3,0,0]=4 343 B19R2.2863 COc1cc(ncc1C)SCCc2ccccc2 62a_100000765856_100010067687 [0,1,0,0,0,0|3,0,0]=4 344 B19R2.2863 COc1cc(ncc1C)SCCc2ccccc2 62a_100010067687_100011218657 [0,1,0,0,0,0|3,0,0]=4 345 B19R2.2863 COc1cc(ncc1F)SCCc2ccccc2 62a_100000765856_200010136270 [0,1,0,0,0,0|3,0,0]=4 346 B19R2.2863 COc1cc(ncc1F)SCCc2ccccc2 62a_200010136270_100011218657 [0,1,0,0,0,0|3,0,0]=4 347 B19R2.2863 COc1cc(ncc1N)SCCc2ccccc2 62a_100000765856_100009887741 [0,1,0,0,0,0|3,0,0]=4 348 B19R2.2863 COc1cc(ncc1N)SCCc2ccccc2 62a_100009887741_100011218657 [0,1,0,0,0,0|3,0,0]=4 349 B19R2.2863 COc1cc(nnc1N)SCCc2ccccc2 62a_100000688033_100011218657 [0,1,0,0,0,0|2,0,1]=4 350 B19R2.2863 COc1cc(nnc1N)SCCc2ccccc2 62a_100000765856_100000688033 [0,1,0,0,0,0|2,0,1]=4 351 B19R2.2863 OCc1cc(ncc1F)SCCc2ccccc2 62a_100000081974_100011218657 [0,1,0,0,0,0|3,0,0]=4 352 B19R2.2863 OCc1cc(ncc1F)SCCc2ccccc2 62a_100000765856_100000081974 [0,1,0,0,0,0|3,0,0]=4 353 B19R2.7722 Cc1[nH]c(=O)c(cc1SCCc2ccccc2)N 62a_100000765856_100010126670 [0,1,0,0,0,0|3,0,0]=4 354 B19R2.7722 Cc1[nH]c(=O)c(cc1SCCc2ccccc2)N 62a_100010126670_100011218657 [0,1,0,0,0,0|3,0,0]=4 355 B19R2.11834 CC(CSc1c[nH]c(=O)c(c1)Br)c2ccccc2 62a_100000756946_100010125443 [0,1,0,0,0,0|3,0,0]=4 356 B19R2.11834 CC(CSc1c[nH]c(=O)c(c1)Br)c2ccccc2 62a_100010125443_100000756946 [0,1,0,0,0,0|3,0,0]=4 357 B19R2.11834 CC(CSc1c[nH]c(=O)c(c1)F)c2ccccc2 62a_100000723523_100000756946 [0,1,0,0,0,0|3,0,0]=4 358 B19R2.11834 CC(CSc1c[nH]c(=O)c(c1)F)c2ccccc2 62a_100000756946_100000723523 [0,1,0,0,0,0|3,0,0]=4 359 B19R2.11834 CC(CSc1c[nH]c(=O)c(c1)O)c2ccccc2 62a_100000756946_100009814561 [0,1,0,0,0,0|2,0,0]=3 360 B19R2.11834 CC(CSc1cc(c(=O)[nH]n1)N)c2ccccc2 62a_100000756946_100000102183 [0,1,0,0,0,0|2,0,0]=3 361 B19R2.11834 CC(CSc1cc(c(cn1)F)O)c2ccccc2 62a_100000756946_100009854642 [0,1,0,0,0,0|3,0,0]=4 362 B19R2.11834 CC(CSc1cc(c(cn1)F)O)c2ccccc2 62a_100009854642_100000756946 [0,1,0,0,0,0|3,0,0]=4 363 B19R2.11834 C[C@@H](NCc1c[nH]c(=O)c(c1)Cl)c2ccccc2 207a_100000751104_100000051075 [0,1,0,0,0,0|3,0,0]=4 364 B19R2.11834 C[C@@H](NCc1c[nH]c(=O)c(c1)Cl)c2ccccc2 270004a_100000751104_100000051075 [0,1,0,0,0,0|3,0,0]=4 365 B19R2.11834 Cc1cc(n[nH]c1=O)SCC(=O)c2ccccc2 62a_100000211460_100012187101 [0,1,0,0,0,0|2,0,1]=4 366 B19R2.11834 Cc1cc(n[nH]c1=O)SCC(C)c2ccccc2 62a_100000756946_100012187101 [0,1,0,0,0,0|2,0,0]=3 367 B19R2.11834 Cc1cc(n[nH]c1=O)SCC(O)c2ccccc2 62a_100000185958_100012187101 [0,1,0,0,0,0|2,0,0]=3 368 B19R2.11834 Cc1cc(n[nH]c1=O)SC[C@@H](O)c2ccccc2 62a_100011933945_100012187101 [0,1,0,0,0,0|2,0,0]=3 369 B19R2.11834 Cc1cnc(cc1O)SCC(C)c2ccccc2 62a_100000704368_100000756946 [0,1,0,0,0,0|3,0,0]=4 370 B19R2.11834 Cc1cnc(cc1O)SCC(C)c2ccccc2 62a_100000756946_100000704368 [0,1,0,0,0,0|3,0,0]=4 371 B19R2.11834 Cc1cnc(cc1O)SCC(O)c2ccccc2 62a_100000185958_100000704368 [0,1,0,0,0,0|3,0,0]=4 372 B19R2.11834 Cc1cnc(cc1O)SCC(O)c2ccccc2 62a_100000704368_100000185958 [0,1,0,0,0,0|3,0,0]=4 373 B19R2.11834 Cc1cnc(cc1O)SC[C@@H](O)c2ccccc2 62a_100000704368_100011933945 [0,1,0,0,0,0|3,0,0]=4 374 B19R2.11834 Cc1cnc(cc1O)SC[C@@H](O)c2ccccc2 62a_100011933945_100000704368 [0,1,0,0,0,0|3,0,0]=4 375 B19R2.11834 Nc1cc(n[nH]c1=O)SCC(=O)c2ccccc2 62a_100000211460_100000102183 [0,1,0,0,0,0|2,0,1]=4 376 B19R2.11834 Nc1cc(n[nH]c1=O)SCC(O)c2ccccc2 62a_100000185958_100000102183 [0,1,0,0,0,0|2,0,0]=3 377 B19R2.11834 Nc1cc(n[nH]c1=O)SC[C@@H](O)c2ccccc2 62a_100011933945_100000102183 [0,1,0,0,0,0|2,0,0]=3 378 B19R2.11834 O=C(CSc1c[nH]c(=O)c(c1)O)c2ccccc2 62a_100000211460_100009814561 [0,1,0,0,0,0|2,0,1]=4 379 B19R2.11834 O=c1[nH]cc(cc1Br)SCC(O)c2ccccc2 62a_100000185958_100010125443 [0,1,0,0,0,0|3,0,0]=4 380 B19R2.11834 O=c1[nH]cc(cc1Br)SCC(O)c2ccccc2 62a_100010125443_100000185958 [0,1,0,0,0,0|3,0,0]=4 381 B19R2.11834 O=c1[nH]cc(cc1Br)SC[C@@H](O)c2ccccc2 62a_100010125443_100011933945 [0,1,0,0,0,0|3,0,0]=4 382 B19R2.11834 O=c1[nH]cc(cc1Br)SC[C@@H](O)c2ccccc2 62a_100011933945_100010125443 [0,1,0,0,0,0|3,0,0]=4 383 B19R2.11834 O=c1[nH]cc(cc1F)SCC(O)c2ccccc2 62a_100000185958_100000723523 [0,1,0,0,0,0|3,0,0]=4 384 B19R2.11834 O=c1[nH]cc(cc1F)SCC(O)c2ccccc2 62a_100000723523_100000185958 [0,1,0,0,0,0|3,0,0]=4 385 B19R2.11834 O=c1[nH]cc(cc1F)SC[C@@H](O)c2ccccc2 62a_100000723523_100011933945 [0,1,0,0,0,0|3,0,0]=4 386 B19R2.11834 O=c1[nH]cc(cc1F)SC[C@@H](O)c2ccccc2 62a_100011933945_100000723523 [0,1,0,0,0,0|3,0,0]=4 387 B19R2.11834 O=c1[nH]cc(cc1O)SCC(O)c2ccccc2 62a_100000185958_100009814561 [0,1,0,0,0,0|2,0,0]=3 388 B19R2.11834 O=c1[nH]cc(cc1O)SC[C@@H](O)c2ccccc2 62a_100011933945_100009814561 [0,1,0,0,0,0|2,0,0]=3 389 B19R2.11834 Oc1cc(ncc1F)SCC(O)c2ccccc2 62a_100000185958_100009854642 [0,1,0,0,0,0|3,0,0]=4 390 B19R2.11834 Oc1cc(ncc1F)SCC(O)c2ccccc2 62a_100009854642_100000185958 [0,1,0,0,0,0|3,0,0]=4 391 B19R2.11834 Oc1cc(ncc1F)SC[C@@H](O)c2ccccc2 62a_100009854642_100011933945 [0,1,0,0,0,0|3,0,0]=4 392 B19R2.11834 Oc1cc(ncc1F)SC[C@@H](O)c2ccccc2 62a_100011933945_100009854642 [0,1,0,0,0,0|3,0,0]=4 393 B19R2.12305 Cc1cc(n[nH]c1=O)SCCc2ccc(cc2)Br 62a_100011740612_100012187101 [0,1,0,0,0,0|2,0,0]=3 394 B19R2.12305 Cc1cc(n[nH]c1=O)SCCc2ccc(cc2)Cl 62a_100011713675_100012187101 [0,1,0,0,0,0|2,0,0]=3 395 B19R2.12305 Cc1cc(n[nH]c1=O)SCCc2ccc(cc2)F 62a_100011217392_100012187101 [0,1,0,0,0,0|2,0,0]=3 396 B19R2.12305 Cc1cc(n[nH]c1=O)SCCc2ccc(cc2)O 62a_100009816426_100012187101 [0,1,0,0,0,0|2,0,0]=3 397 B19R2.12305 Cc1ccc(cc1)CCSc2c[nH]c(=O)c(c2)Br 62a_100010125443_100011713686 [0,1,0,0,0,0|3,0,0]=4 398 B19R2.12305 Cc1ccc(cc1)CCSc2c[nH]c(=O)c(c2)Br 62a_100011713686_100010125443 [0,1,0,0,0,0|3,0,0]=4 399 B19R2.12305 Cc1ccc(cc1)CCSc2c[nH]c(=O)c(c2)F 62a_100000723523_100011713686 [0,1,0,0,0,0|3,0,0]=4 400 B19R2.12305 Cc1ccc(cc1)CCSc2c[nH]c(=O)c(c2)F 62a_100011713686_100000723523 [0,1,0,0,0,0|3,0,0]=4 401 B19R2.12305 Cc1ccc(cc1)CCSc2c[nH]c(=O)c(c2)O 62a_100011713686_100009814561 [0,1,0,0,0,0|2,0,0]=3 402 B19R2.12305 Cc1ccc(cc1)CCSc2cc(c(=O)[nH]n2)C 62a_100011713686_100012187101 [0,1,0,0,0,0|2,0,0]=3 403 B19R2.12305 Cc1ccc(cc1)CCSc2cc(c(=O)[nH]n2)N 62a_100011713686_100000102183 [0,1,0,0,0,0|2,0,0]=3 404 B19R2.12305 Cc1ccc(cc1)CCSc2cc(c(cn2)C)O 62a_100000704368_100011713686 [0,1,0,0,0,0|3,0,0]=4 405 B19R2.12305 Cc1ccc(cc1)CCSc2cc(c(cn2)C)O 62a_100011713686_100000704368 [0,1,0,0,0,0|3,0,0]=4 406 B19R2.12305 Cc1ccc(cc1)CCSc2cc(c(cn2)F)O 62a_100009854642_100011713686 [0,1,0,0,0,0|3,0,0]=4 407 B19R2.12305 Cc1ccc(cc1)CCSc2cc(c(cn2)F)O 62a_100011713686_100009854642 [0,1,0,0,0,0|3,0,0]=4 408 B19R2.12305 Cc1ccc(cc1)CNCc2c[nH]c(=O)c(c2)Cl 207a_100000174908_100000051075 [0,1,0,0,0,0|3,0,0]=4 409 B19R2.12305 Cc1ccc(cc1)CNCc2c[nH]c(=O)c(c2)Cl 270004a_100000174908_100000051075 [0,1,0,0,0,0|3,0,0]=4 410 B19R2.12305 Cc1cnc(cc1O)SCCc2ccc(cc2)Br 62a_100000704368_100011740612 [0,1,0,0,0,0|3,0,0]=4 411 B19R2.12305 Cc1cnc(cc1O)SCCc2ccc(cc2)Br 62a_100011740612_100000704368 [0,1,0,0,0,0|3,0,0]=4 412 B19R2.12305 Cc1cnc(cc1O)SCCc2ccc(cc2)Cl 62a_100000704368_100011713675 [0,1,0,0,0,0|3,0,0]=4 413 B19R2.12305 Cc1cnc(cc1O)SCCc2ccc(cc2)Cl 62a_100011713675_100000704368 [0,1,0,0,0,0|3,0,0]=4 414 B19R2.12305 Cc1cnc(cc1O)SCCc2ccc(cc2)F 62a_100000704368_100011217392 [0,1,0,0,0,0|3,0,0]=4 415 B19R2.12305 Cc1cnc(cc1O)SCCc2ccc(cc2)F 62a_100011217392_100000704368 [0,1,0,0,0,0|3,0,0]=4 416 B19R2.12305 Cc1cnc(cc1O)SCCc2ccc(cc2)O 62a_100000704368_100009816426 [0,1,0,0,0,0|3,0,0]=4 417 B19R2.12305 Cc1cnc(cc1O)SCCc2ccc(cc2)O 62a_100009816426_100000704368 [0,1,0,0,0,0|3,0,0]=4 418 B19R2.12305 Nc1cc(n[nH]c1=O)SCCc2ccc(cc2)Br 62a_100011740612_100000102183 [0,1,0,0,0,0|2,0,0]=3 419 B19R2.12305 Nc1cc(n[nH]c1=O)SCCc2ccc(cc2)Cl 62a_100011713675_100000102183 [0,1,0,0,0,0|2,0,0]=3 420 B19R2.12305 Nc1cc(n[nH]c1=O)SCCc2ccc(cc2)F 62a_100011217392_100000102183 [0,1,0,0,0,0|2,0,0]=3 421 B19R2.12305 Nc1cc(n[nH]c1=O)SCCc2ccc(cc2)O 62a_100009816426_100000102183 [0,1,0,0,0,0|2,0,0]=3 422 B19R2.12305 O=c1[nH]cc(cc1Br)SCCc2ccc(cc2)Br 62a_100010125443_100011740612 [0,1,0,0,0,0|3,0,0]=4 423 B19R2.12305 O=c1[nH]cc(cc1Br)SCCc2ccc(cc2)Br 62a_100011740612_100010125443 [0,1,0,0,0,0|3,0,0]=4 424 B19R2.12305 O=c1[nH]cc(cc1Br)SCCc2ccc(cc2)Cl 62a_100010125443_100011713675 [0,1,0,0,0,0|3,0,0]=4 425 B19R2.12305 O=c1[nH]cc(cc1Br)SCCc2ccc(cc2)Cl 62a_100011713675_100010125443 [0,1,0,0,0,0|3,0,0]=4 426 B19R2.12305 O=c1[nH]cc(cc1Br)SCCc2ccc(cc2)F 62a_100010125443_100011217392 [0,1,0,0,0,0|3,0,0]=4 427 B19R2.12305 O=c1[nH]cc(cc1Br)SCCc2ccc(cc2)F 62a_100011217392_100010125443 [0,1,0,0,0,0|3,0,0]=4 428 B19R2.12305 O=c1[nH]cc(cc1Br)SCCc2ccc(cc2)O 62a_100009816426_100010125443 [0,1,0,0,0,0|3,0,0]=4 429 B19R2.12305 O=c1[nH]cc(cc1Br)SCCc2ccc(cc2)O 62a_100010125443_100009816426 [0,1,0,0,0,0|3,0,0]=4 430 B19R2.12305 O=c1[nH]cc(cc1Cl)CNCc2ccc(cc2)Br 207a_100000174875_100000051075 [0,1,0,0,0,0|3,0,0]=4 431 B19R2.12305 O=c1[nH]cc(cc1Cl)CNCc2ccc(cc2)Br 270004a_100000174875_100000051075 [0,1,0,0,0,0|3,0,0]=4 432 B19R2.12305 O=c1[nH]cc(cc1Cl)CNCc2ccc(cc2)Cl 207a_100000174871_100000051075 [0,1,0,0,0,0|3,0,0]=4 433 B19R2.12305 O=c1[nH]cc(cc1Cl)CNCc2ccc(cc2)Cl 270004a_100000174871_100000051075 [0,1,0,0,0,0|3,0,0]=4 434 B19R2.12305 O=c1[nH]cc(cc1Cl)CNCc2ccc(cc2)F 207a_100000174882_100000051075 [0,1,0,0,0,0|3,0,0]=4 435 B19R2.12305 O=c1[nH]cc(cc1Cl)CNCc2ccc(cc2)F 270004a_100000174882_100000051075 [0,1,0,0,0,0|3,0,0]=4 436 B19R2.12305 O=c1[nH]cc(cc1Cl)CNCc2ccc(cc2)I 207a_100016989417_100000051075 [0,1,0,0,0,0|3,0,0]=4 437 B19R2.12305 O=c1[nH]cc(cc1Cl)CNCc2ccc(cc2)I 270004a_100016989417_100000051075 [0,1,0,0,0,0|3,0,0]=4 438 B19R2.12305 O=c1[nH]cc(cc1F)SCCc2ccc(cc2)Br 62a_100000723523_100011740612 [0,1,0,0,0,0|3,0,0]=4 439 B19R2.12305 O=c1[nH]cc(cc1F)SCCc2ccc(cc2)Br 62a_100011740612_100000723523 [0,1,0,0,0,0|3,0,0]=4 440 B19R2.12305 O=c1[nH]cc(cc1F)SCCc2ccc(cc2)Cl 62a_100000723523_100011713675 [0,1,0,0,0,0|3,0,0]=4 441 B19R2.12305 O=c1[nH]cc(cc1F)SCCc2ccc(cc2)Cl 62a_100011713675_100000723523 [0,1,0,0,0,0|3,0,0]=4 442 B19R2.12305 O=c1[nH]cc(cc1F)SCCc2ccc(cc2)F 62a_100000723523_100011217392 [0,1,0,0,0,0|3,0,0]=4 443 B19R2.12305 O=c1[nH]cc(cc1F)SCCc2ccc(cc2)F 62a_100011217392_100000723523 [0,1,0,0,0,0|3,0,0]=4 444 B19R2.12305 O=c1[nH]cc(cc1F)SCCc2ccc(cc2)O 62a_100000723523_100009816426 [0,1,0,0,0,0|3,0,0]=4 445 B19R2.12305 O=c1[nH]cc(cc1F)SCCc2ccc(cc2)O 62a_100009816426_100000723523 [0,1,0,0,0,0|3,0,0]=4 446 B19R2.12305 O=c1[nH]cc(cc1O)SCCc2ccc(cc2)Br 62a_100011740612_100009814561 [0,1,0,0,0,0|2,0,0]=3 447 B19R2.12305 O=c1[nH]cc(cc1O)SCCc2ccc(cc2)Cl 62a_100011713675_100009814561 [0,1,0,0,0,0|2,0,0]=3 448 B19R2.12305 O=c1[nH]cc(cc1O)SCCc2ccc(cc2)F 62a_100011217392_100009814561 [0,1,0,0,0,0|2,0,0]=3 449 B19R2.12305 O=c1[nH]cc(cc1O)SCCc2ccc(cc2)O 62a_100009816426_100009814561 [0,1,0,0,0,0|2,0,0]=3 450 B19R2.12305 Oc1cc(ncc1F)SCCc2ccc(cc2)Br 62a_100009854642_100011740612 [0,1,0,0,0,0|3,0,0]=4 451 B19R2.12305 Oc1cc(ncc1F)SCCc2ccc(cc2)Br 62a_100011740612_100009854642 [0,1,0,0,0,0|3,0,0]=4 452 B19R2.12305 Oc1cc(ncc1F)SCCc2ccc(cc2)Cl 62a_100009854642_100011713675 [0,1,0,0,0,0|3,0,0]=4 453 B19R2.12305 Oc1cc(ncc1F)SCCc2ccc(cc2)Cl 62a_100011713675_100009854642 [0,1,0,0,0,0|3,0,0]=4 454 B19R2.12305 Oc1cc(ncc1F)SCCc2ccc(cc2)F 62a_100009854642_100011217392 [0,1,0,0,0,0|3,0,0]=4 455 B19R2.12305 Oc1cc(ncc1F)SCCc2ccc(cc2)F 62a_100011217392_100009854642 [0,1,0,0,0,0|3,0,0]=4 456 B19R2.12305 Oc1ccc(cc1)CCSc2cc(c(cn2)F)O 62a_100009816426_100009854642 [0,1,0,0,0,0|3,0,0]=4 457 B19R2.12305 Oc1ccc(cc1)CCSc2cc(c(cn2)F)O 62a_100009854642_100009816426 [0,1,0,0,0,0|3,0,0]=4 458 B19R2.28208 COc1cnc(cc1O)SCCc2ccccc2 62a_100000765856_100010264082 [0,1,0,0,0,0|2,0,1]=4 459 B19R2.28208 Cc1cc(ncc1C=O)SCCc2ccccc2 62a_100000085382_100011218657 [0,1,0,0,0,0|3,0,0]=4 460 B19R2.28208 Cc1cc(ncc1C=O)SCCc2ccccc2 62a_100000765856_100000085382 [0,1,0,0,0,0|3,0,0]=4 461 B19R2.28208 Nc1cc(ncc1C=O)SCCc2ccccc2 62a_100000050503_100011218657 [0,1,0,0,0,0|3,0,0]=4 462 B19R2.28208 Nc1cc(ncc1C=O)SCCc2ccccc2 62a_100000765856_100000050503 [0,1,0,0,0,0|3,0,0]=4 463 B19R2.28208 O=Cc1ccc(cc1O)SCCc2ccccc2 62a_100000765856_100011277552 [0,1,0,0,0,0|3,0,0]=4 464 B19R2.28208 O=Cc1ccc(cc1O)SCCc2ccccc2 62a_100011277552_100011218657 [0,1,0,0,0,0|3,0,0]=4 465 B19R2.50071 Cc1cc(n[nH]c1=O)SCCc2ccccc2Br 62a_100012161201_100012187101 [0,1,0,0,0,0|2,0,0]=3 466 B19R2.50071 Cc1cc(n[nH]c1=O)SCCc2ccccc2Cl 62a_100011713703_100012187101 [0,1,0,0,0,0|2,0,0]=3 467 B19R2.50071 Cc1cc(n[nH]c1=O)SCCc2ccccc2F 62a_100011713696_100012187101 [0,1,0,0,0,0|2,0,0]=3 468 B19R2.50071 Cc1cc(n[nH]c1=O)SCCc2ccccc2O 62a_100000722297_100012187101 [0,1,0,0,0,0|2,0,0]=3 469 B19R2.50071 Cc1ccccc1CCSc2c[nH]c(=O)c(c2)Br 62a_100010125443_100011713688 [0,1,0,0,0,0|3,0,0]=4 470 B19R2.50071 Cc1ccccc1CCSc2c[nH]c(=O)c(c2)Br 62a_100011713688_100010125443 [0,1,0,0,0,0|3,0,0]=4 471 B19R2.50071 Cc1ccccc1CCSc2c[nH]c(=O)c(c2)F 62a_100000723523_100011713688 [0,1,0,0,0,0|3,0,0]=4 472 B19R2.50071 Cc1ccccc1CCSc2c[nH]c(=O)c(c2)F 62a_100011713688_100000723523 [0,1,0,0,0,0|3,0,0]=4 473 B19R2.50071 Cc1ccccc1CCSc2c[nH]c(=O)c(c2)O 62a_100011713688_100009814561 [0,1,0,0,0,0|2,0,0]=3 474 B19R2.50071 Cc1ccccc1CCSc2cc(c(=O)[nH]n2)C 62a_100011713688_100012187101 [0,1,0,0,0,0|2,0,0]=3 475 B19R2.50071 Cc1ccccc1CCSc2cc(c(=O)[nH]n2)N 62a_100011713688_100000102183 [0,1,0,0,0,0|2,0,0]=3 476 B19R2.50071 Cc1ccccc1CCSc2cc(c(cn2)F)O 62a_100009854642_100011713688 [0,1,0,0,0,0|3,0,0]=4 477 B19R2.50071 Cc1ccccc1CCSc2cc(c(cn2)F)O 62a_100011713688_100009854642 [0,1,0,0,0,0|3,0,0]=4 478 B19R2.50071 Cc1ccccc1CNCc2c[nH]c(=O)c(c2)Cl 207a_100000174972_100000051075 [0,1,0,0,0,0|3,0,0]=4 479 B19R2.50071 Cc1ccccc1CNCc2c[nH]c(=O)c(c2)Cl 270004a_100000174972_100000051075 [0,1,0,0,0,0|3,0,0]=4 480 B19R2.50071 Cc1cnc(cc1O)SCCc2ccccc2Br 62a_100000704368_100012161201 [0,1,0,0,0,0|3,0,0]=4 481 B19R2.50071 Cc1cnc(cc1O)SCCc2ccccc2Br 62a_100012161201_100000704368 [0,1,0,0,0,0|3,0,0]=4 482 B19R2.50071 Cc1cnc(cc1O)SCCc2ccccc2C 62a_100000704368_100011713688 [0,1,0,0,0,0|3,0,0]=4 483 B19R2.50071 Cc1cnc(cc1O)SCCc2ccccc2C 62a_100011713688_100000704368 [0,1,0,0,0,0|3,0,0]=4 484 B19R2.50071 Cc1cnc(cc1O)SCCc2ccccc2Cl 62a_100000704368_100011713703 [0,1,0,0,0,0|3,0,0]=4 485 B19R2.50071 Cc1cnc(cc1O)SCCc2ccccc2Cl 62a_100011713703_100000704368 [0,1,0,0,0,0|3,0,0]=4 486 B19R2.50071 Cc1cnc(cc1O)SCCc2ccccc2F 62a_100000704368_100011713696 [0,1,0,0,0,0|3,0,0]=4 487 B19R2.50071 Cc1cnc(cc1O)SCCc2ccccc2F 62a_100011713696_100000704368 [0,1,0,0,0,0|3,0,0]=4 488 B19R2.50071 Cc1cnc(cc1O)SCCc2ccccc2O 62a_100000704368_100000722297 [0,1,0,0,0,0|3,0,0]=4 489 B19R2.50071 Cc1cnc(cc1O)SCCc2ccccc2O 62a_100000722297_100000704368 [0,1,0,0,0,0|3,0,0]=4 490 B19R2.50071 Nc1cc(n[nH]c1=O)SCCc2ccccc2Br 62a_100012161201_100000102183 [0,1,0,0,0,0|2,0,0]=3 491 B19R2.50071 Nc1cc(n[nH]c1=O)SCCc2ccccc2Cl 62a_100011713703_100000102183 [0,1,0,0,0,0|2,0,0]=3 492 B19R2.50071 Nc1cc(n[nH]c1=O)SCCc2ccccc2F 62a_100011713696_100000102183 [0,1,0,0,0,0|2,0,0]=3 493 B19R2.50071 Nc1cc(n[nH]c1=O)SCCc2ccccc2O 62a_100000722297_100000102183 [0,1,0,0,0,0|2,0,0]=3 494 B19R2.50071 O=c1[nH]cc(cc1Br)SCCc2ccccc2Br 62a_100010125443_100012161201 [0,1,0,0,0,0|3,0,0]=4 495 B19R2.50071 O=c1[nH]cc(cc1Br)SCCc2ccccc2Br 62a_100012161201_100010125443 [0,1,0,0,0,0|3,0,0]=4 496 B19R2.50071 O=c1[nH]cc(cc1Br)SCCc2ccccc2Cl 62a_100010125443_100011713703 [0,1,0,0,0,0|3,0,0]=4 497 B19R2.50071 O=c1[nH]cc(cc1Br)SCCc2ccccc2Cl 62a_100011713703_100010125443 [0,1,0,0,0,0|3,0,0]=4 498 B19R2.50071 O=c1[nH]cc(cc1Br)SCCc2ccccc2F 62a_100010125443_100011713696 [0,1,0,0,0,0|3,0,0]=4 499 B19R2.50071 O=c1[nH]cc(cc1Br)SCCc2ccccc2F 62a_100011713696_100010125443 [0,1,0,0,0,0|3,0,0]=4 500 B19R2.50071 O=c1[nH]cc(cc1Br)SCCc2ccccc2O 62a_100000722297_100010125443 [0,1,0,0,0,0|3,0,0]=4 501 B19R2.50071 O=c1[nH]cc(cc1Br)SCCc2ccccc2O 62a_100010125443_100000722297 [0,1,0,0,0,0|3,0,0]=4 502 B19R2.50071 O=c1[nH]cc(cc1Cl)CNCc2ccccc2Br 207a_100000689332_100000051075 [0,1,0,0,0,0|3,0,0]=4 503 B19R2.50071 O=c1[nH]cc(cc1Cl)CNCc2ccccc2Br 270004a_100000689332_100000051075 [0,1,0,0,0,0|3,0,0]=4 504 B19R2.50071 O=c1[nH]cc(cc1Cl)CNCc2ccccc2Cl 207a_100000174879_100000051075 [0,1,0,0,0,0|3,0,0]=4 505 B19R2.50071 O=c1[nH]cc(cc1Cl)CNCc2ccccc2Cl 270004a_100000174879_100000051075 [0,1,0,0,0,0|3,0,0]=4 506 B19R2.50071 O=c1[nH]cc(cc1Cl)CNCc2ccccc2F 207a_100000174869_100000051075 [0,1,0,0,0,0|3,0,0]=4 507 B19R2.50071 O=c1[nH]cc(cc1Cl)CNCc2ccccc2F 270004a_100000174869_100000051075 [0,1,0,0,0,0|3,0,0]=4 508 B19R2.50071 O=c1[nH]cc(cc1Cl)CNCc2ccccc2I 207a_100015347259_100000051075 [0,1,0,0,0,0|3,0,0]=4 509 B19R2.50071 O=c1[nH]cc(cc1Cl)CNCc2ccccc2I 270004a_100015347259_100000051075 [0,1,0,0,0,0|3,0,0]=4 510 B19R2.50071 O=c1[nH]cc(cc1Cl)CNCc2ccccc2O 207a_100000185550_100000051075 [0,1,0,0,0,0|3,0,0]=4 511 B19R2.50071 O=c1[nH]cc(cc1Cl)CNCc2ccccc2O 270004a_100000185550_100000051075 [0,1,0,0,0,0|3,0,0]=4 512 B19R2.50071 O=c1[nH]cc(cc1F)SCCc2ccccc2Br 62a_100000723523_100012161201 [0,1,0,0,0,0|3,0,0]=4 513 B19R2.50071 O=c1[nH]cc(cc1F)SCCc2ccccc2Br 62a_100012161201_100000723523 [0,1,0,0,0,0|3,0,0]=4 514 B19R2.50071 O=c1[nH]cc(cc1F)SCCc2ccccc2Cl 62a_100000723523_100011713703 [0,1,0,0,0,0|3,0,0]=4 515 B19R2.50071 O=c1[nH]cc(cc1F)SCCc2ccccc2Cl 62a_100011713703_100000723523 [0,1,0,0,0,0|3,0,0]=4 516 B19R2.50071 O=c1[nH]cc(cc1F)SCCc2ccccc2F 62a_100000723523_100011713696 [0,1,0,0,0,0|3,0,0]=4 517 B19R2.50071 O=c1[nH]cc(cc1F)SCCc2ccccc2F 62a_100011713696_100000723523 [0,1,0,0,0,0|3,0,0]=4 518 B19R2.50071 O=c1[nH]cc(cc1F)SCCc2ccccc2O 62a_100000722297_100000723523 [0,1,0,0,0,0|3,0,0]=4 519 B19R2.50071 O=c1[nH]cc(cc1F)SCCc2ccccc2O 62a_100000723523_100000722297 [0,1,0,0,0,0|3,0,0]=4 520 B19R2.50071 O=c1[nH]cc(cc1O)SCCc2ccccc2Br 62a_100012161201_100009814561 [0,1,0,0,0,0|2,0,0]=3 521 B19R2.50071 O=c1[nH]cc(cc1O)SCCc2ccccc2Cl 62a_100011713703_100009814561 [0,1,0,0,0,0|2,0,0]=3 522 B19R2.50071 O=c1[nH]cc(cc1O)SCCc2ccccc2F 62a_100011713696_100009814561 [0,1,0,0,0,0|2,0,0]=3 523 B19R2.50071 O=c1[nH]cc(cc1O)SCCc2ccccc2O 62a_100000722297_100009814561 [0,1,0,0,0,0|2,0,0]=3 524 B19R2.50071 Oc1cc(ncc1F)SCCc2ccccc2Br 62a_100009854642_100012161201 [0,1,0,0,0,0|3,0,0]=4 525 B19R2.50071 Oc1cc(ncc1F)SCCc2ccccc2Br 62a_100012161201_100009854642 [0,1,0,0,0,0|3,0,0]=4 526 B19R2.50071 Oc1cc(ncc1F)SCCc2ccccc2Cl 62a_100009854642_100011713703 [0,1,0,0,0,0|3,0,0]=4 527 B19R2.50071 Oc1cc(ncc1F)SCCc2ccccc2Cl 62a_100011713703_100009854642 [0,1,0,0,0,0|3,0,0]=4 528 B19R2.50071 Oc1cc(ncc1F)SCCc2ccccc2F 62a_100009854642_100011713696 [0,1,0,0,0,0|3,0,0]=4 529 B19R2.50071 Oc1cc(ncc1F)SCCc2ccccc2F 62a_100011713696_100009854642 [0,1,0,0,0,0|3,0,0]=4 530 B19R2.50071 Oc1cc(ncc1F)SCCc2ccccc2O 62a_100000722297_100009854642 [0,1,0,0,0,0|3,0,0]=4 531 B19R2.50071 Oc1cc(ncc1F)SCCc2ccccc2O 62a_100009854642_100000722297 [0,1,0,0,0,0|3,0,0]=4 532 B19R2.101617 Cc1cc(n[nH]c1=O)SCCc2cccc(c2)Br 62a_100011740638_100012187101 [0,1,0,0,0,0|2,0,0]=3 533 B19R2.101617 Cc1cc(n[nH]c1=O)SCCc2cccc(c2)Cl 62a_100011713710_100012187101 [0,1,0,0,0,0|2,0,0]=3 534 B19R2.101617 Cc1cc(n[nH]c1=O)SCCc2cccc(c2)F 62a_100011217235_100012187101 [0,1,0,0,0,0|2,0,0]=3 535 B19R2.101617 Cc1cccc(c1)CCSc2c[nH]c(=O)c(c2)Br 62a_100010125443_100011713685 [0,1,0,0,0,0|3,0,0]=4 536 B19R2.101617 Cc1cccc(c1)CCSc2c[nH]c(=O)c(c2)Br 62a_100011713685_100010125443 [0,1,0,0,0,0|3,0,0]=4 537 B19R2.101617 Cc1cccc(c1)CCSc2c[nH]c(=O)c(c2)F 62a_100000723523_100011713685 [0,1,0,0,0,0|3,0,0]=4 538 B19R2.101617 Cc1cccc(c1)CCSc2c[nH]c(=O)c(c2)F 62a_100011713685_100000723523 [0,1,0,0,0,0|3,0,0]=4 539 B19R2.101617 Cc1cccc(c1)CCSc2c[nH]c(=O)c(c2)O 62a_100011713685_100009814561 [0,1,0,0,0,0|2,0,0]=3 540 B19R2.101617 Cc1cccc(c1)CCSc2cc(c(=O)[nH]n2)C 62a_100011713685_100012187101 [0,1,0,0,0,0|2,0,0]=3 541 B19R2.101617 Cc1cccc(c1)CCSc2cc(c(=O)[nH]n2)N 62a_100011713685_100000102183 [0,1,0,0,0,0|2,0,0]=3 542 B19R2.101617 Cc1cccc(c1)CCSc2cc(c(cn2)C)O 62a_100000704368_100011713685 [0,1,0,0,0,0|3,0,0]=4 543 B19R2.101617 Cc1cccc(c1)CCSc2cc(c(cn2)C)O 62a_100011713685_100000704368 [0,1,0,0,0,0|3,0,0]=4 544 B19R2.101617 Cc1cccc(c1)CCSc2cc(c(cn2)F)O 62a_100009854642_100011713685 [0,1,0,0,0,0|3,0,0]=4 545 B19R2.101617 Cc1cccc(c1)CCSc2cc(c(cn2)F)O 62a_100011713685_100009854642 [0,1,0,0,0,0|3,0,0]=4 546 B19R2.101617 Cc1cccc(c1)CNCc2c[nH]c(=O)c(c2)Cl 207a_100000185548_100000051075 [0,1,0,0,0,0|3,0,0]=4 547 B19R2.101617 Cc1cccc(c1)CNCc2c[nH]c(=O)c(c2)Cl 270004a_100000185548_100000051075 [0,1,0,0,0,0|3,0,0]=4 548 B19R2.101617 Cc1cnc(cc1O)SCCc2cccc(c2)Br 62a_100000704368_100011740638 [0,1,0,0,0,0|3,0,0]=4 549 B19R2.101617 Cc1cnc(cc1O)SCCc2cccc(c2)Br 62a_100011740638_100000704368 [0,1,0,0,0,0|3,0,0]=4 550 B19R2.101617 Cc1cnc(cc1O)SCCc2cccc(c2)Cl 62a_100000704368_100011713710 [0,1,0,0,0,0|3,0,0]=4 551 B19R2.101617 Cc1cnc(cc1O)SCCc2cccc(c2)Cl 62a_100011713710_100000704368 [0,1,0,0,0,0|3,0,0]=4 552 B19R2.101617 Cc1cnc(cc1O)SCCc2cccc(c2)F 62a_100000704368_100011217235 [0,1,0,0,0,0|3,0,0]=4 553 B19R2.101617 Cc1cnc(cc1O)SCCc2cccc(c2)F 62a_100011217235_100000704368 [0,1,0,0,0,0|3,0,0]=4 554 B19R2.101617 Nc1cc(n[nH]c1=O)SCCc2cccc(c2)Br 62a_100011740638_100000102183 [0,1,0,0,0,0|2,0,0]=3 555 B19R2.101617 Nc1cc(n[nH]c1=O)SCCc2cccc(c2)Cl 62a_100011713710_100000102183 [0,1,0,0,0,0|2,0,0]=3 556 B19R2.101617 Nc1cc(n[nH]c1=O)SCCc2cccc(c2)F 62a_100011217235_100000102183 [0,1,0,0,0,0|2,0,0]=3 557 B19R2.101617 O=c1[nH]cc(cc1Br)SCCc2cccc(c2)Br 62a_100010125443_100011740638 [0,1,0,0,0,0|3,0,0]=4 558 B19R2.101617 O=c1[nH]cc(cc1Br)SCCc2cccc(c2)Br 62a_100011740638_100010125443 [0,1,0,0,0,0|3,0,0]=4 559 B19R2.101617 O=c1[nH]cc(cc1Br)SCCc2cccc(c2)Cl 62a_100010125443_100011713710 [0,1,0,0,0,0|3,0,0]=4 560 B19R2.101617 O=c1[nH]cc(cc1Br)SCCc2cccc(c2)Cl 62a_100011713710_100010125443 [0,1,0,0,0,0|3,0,0]=4 561 B19R2.101617 O=c1[nH]cc(cc1Br)SCCc2cccc(c2)F 62a_100010125443_100011217235 [0,1,0,0,0,0|3,0,0]=4 562 B19R2.101617 O=c1[nH]cc(cc1Br)SCCc2cccc(c2)F 62a_100011217235_100010125443 [0,1,0,0,0,0|3,0,0]=4 563 B19R2.101617 O=c1[nH]cc(cc1Cl)CNCc2cccc(c2)Br 207a_100000174977_100000051075 [0,1,0,0,0,0|3,0,0]=4 564 B19R2.101617 O=c1[nH]cc(cc1Cl)CNCc2cccc(c2)Br 270004a_100000174977_100000051075 [0,1,0,0,0,0|3,0,0]=4 565 B19R2.101617 O=c1[nH]cc(cc1Cl)CNCc2cccc(c2)Cl 207a_100000174878_100000051075 [0,1,0,0,0,0|3,0,0]=4 566 B19R2.101617 O=c1[nH]cc(cc1Cl)CNCc2cccc(c2)Cl 270004a_100000174878_100000051075 [0,1,0,0,0,0|3,0,0]=4 567 B19R2.101617 O=c1[nH]cc(cc1Cl)CNCc2cccc(c2)F 207a_100000174948_100000051075 [0,1,0,0,0,0|3,0,0]=4 568 B19R2.101617 O=c1[nH]cc(cc1Cl)CNCc2cccc(c2)F 270004a_100000174948_100000051075 [0,1,0,0,0,0|3,0,0]=4 569 B19R2.101617 O=c1[nH]cc(cc1Cl)CNCc2cccc(c2)I 207a_100000106179_100000051075 [0,1,0,0,0,0|3,0,0]=4 570 B19R2.101617 O=c1[nH]cc(cc1Cl)CNCc2cccc(c2)I 270004a_100000106179_100000051075 [0,1,0,0,0,0|3,0,0]=4 571 B19R2.101617 O=c1[nH]cc(cc1Cl)CNCc2cccc(c2)O 207a_100000743036_100000051075 [0,1,0,0,0,0|3,0,0]=4 572 B19R2.101617 O=c1[nH]cc(cc1Cl)CNCc2cccc(c2)O 270004a_100000743036_100000051075 [0,1,0,0,0,0|3,0,0]=4 573 B19R2.101617 O=c1[nH]cc(cc1F)SCCc2cccc(c2)Br 62a_100000723523_100011740638 [0,1,0,0,0,0|3,0,0]=4 574 B19R2.101617 O=c1[nH]cc(cc1F)SCCc2cccc(c2)Br 62a_100011740638_100000723523 [0,1,0,0,0,0|3,0,0]=4 575 B19R2.101617 O=c1[nH]cc(cc1F)SCCc2cccc(c2)Cl 62a_100000723523_100011713710 [0,1,0,0,0,0|3,0,0]=4 576 B19R2.101617 O=c1[nH]cc(cc1F)SCCc2cccc(c2)Cl 62a_100011713710_100000723523 [0,1,0,0,0,0|3,0,0]=4 577 B19R2.101617 O=c1[nH]cc(cc1F)SCCc2cccc(c2)F 62a_100000723523_100011217235 [0,1,0,0,0,0|3,0,0]=4 578 B19R2.101617 O=c1[nH]cc(cc1F)SCCc2cccc(c2)F 62a_100011217235_100000723523 [0,1,0,0,0,0|3,0,0]=4 579 B19R2.101617 O=c1[nH]cc(cc1O)SCCc2cccc(c2)Br 62a_100011740638_100009814561 [0,1,0,0,0,0|2,0,0]=3 580 B19R2.101617 O=c1[nH]cc(cc1O)SCCc2cccc(c2)Cl 62a_100011713710_100009814561 [0,1,0,0,0,0|2,0,0]=3 581 B19R2.101617 O=c1[nH]cc(cc1O)SCCc2cccc(c2)F 62a_100011217235_100009814561 [0,1,0,0,0,0|2,0,0]=3 582 B19R2.101617 Oc1cc(ncc1F)SCCc2cccc(c2)Br 62a_100009854642_100011740638 [0,1,0,0,0,0|3,0,0]=4 583 B19R2.101617 Oc1cc(ncc1F)SCCc2cccc(c2)Br 62a_100011740638_100009854642 [0,1,0,0,0,0|3,0,0]=4 584 B19R2.101617 Oc1cc(ncc1F)SCCc2cccc(c2)Cl 62a_100009854642_100011713710 [0,1,0,0,0,0|3,0,0]=4 585 B19R2.101617 Oc1cc(ncc1F)SCCc2cccc(c2)Cl 62a_100011713710_100009854642 [0,1,0,0,0,0|3,0,0]=4 586 B19R2.101617 Oc1cc(ncc1F)SCCc2cccc(c2)F 62a_100009854642_100011217235 [0,1,0,0,0,0|3,0,0]=4 587 B19R2.101617 Oc1cc(ncc1F)SCCc2cccc(c2)F 62a_100011217235_100009854642 [0,1,0,0,0,0|3,0,0]=4 588 B19R2.103257 Cc1c(c[nH]c(=O)c1N)SCCc2ccccc2 62a_100000765856_100010163742 [0,1,0,0,0,0|3,0,0]=4 589 B19R2.103257 Cc1c(c[nH]c(=O)c1N)SCCc2ccccc2 62a_100010163742_100011218657 [0,1,0,0,0,0|3,0,0]=4 590 B19R2.867575 Cc1cc(cn(c1=O)C)SCCc2ccccc2 62a_100000765856_100011830242 [0,1,0,0,0,0|3,0,0]=4 591 B19R2.867575 Cc1cc(cn(c1=O)C)SCCc2ccccc2 62a_100011830242_100011218657 [0,1,0,0,0,0|3,0,0]=4 592 B19R2.867575 Cc1cc(nn(c1=O)C)C=CCc2ccccc2 271570a_200016263579_100010988966 [0,1,0,0,0,0|1,0,2]=4 593 B19R2.867575 Cc1cc(nn(c1=O)C)SCCc2ccccc2 62a_100000765856_100010988966 [0,1,0,0,0,0|2,0,0]=3 594 B19R2.867575 Cc1cc(nn(c1=O)C)SCCc2ccccc2 62a_100010988966_100011218657 [0,1,0,0,0,0|2,0,0]=3 595 B19R2.867575 Cc1cc(nn(c1=O)C)SCCc2ccccn2 62a_100010988966_100015183660 [0,1,0,0,0,0|3,0,0]=4 596 B19R2.867575 Cc1cc(nn(c1=O)C)SCCc2ccccn2 62a_100015183660_100010988966 [0,1,0,0,0,0|3,0,0]=4 597 B19R2.867575 Cc1cc(nn(c1=O)C)SCCc2cccnc2 62a_100010988966_200011713674 [0,1,0,0,0,0|3,0,0]=4 598 B19R2.867575 Cc1cc(nn(c1=O)C)SCCc2cccnc2 62a_200011713674_100010988966 [0,1,0,0,0,0|3,0,0]=4 599 B19R2.867575 Cc1cc(nn(c1=O)C)SCCc2ccncc2 62a_100000723409_100010988966 [0,1,0,0,0,0|3,0,0]=4 600 B19R2.867575 Cc1cc(nn(c1=O)C)SCCc2ccncc2 62a_100010988966_100000723409 [0,1,0,0,0,0|3,0,0]=4 601 B19R2.867575 Cc1cc(nn(c1=O)C)SCSc2ccccc2 62a_100010988966_100011218342 [0,1,0,0,0,0|3,0,0]=4 602 B19R2.867575 Cc1cc(nn(c1=O)C)SCSc2ccccc2 62a_100011218342_100010988966 [0,1,0,0,0,0|3,0,0]=4 603 B19R2.867575 Cn1cc(cc(c1=O)F)SCCc2ccccc2 62a_100000765856_100010749421 [0,1,0,0,0,0|3,0,0]=4 604 B19R2.867575 Cn1cc(cc(c1=O)F)SCCc2ccccc2 62a_100010749421_100011218657 [0,1,0,0,0,0|3,0,0]=4 605 B19R2.867575 Cn1cc(cc(c1=O)N)SCCc2ccccc2 62a_100000765856_106446545582 [0,1,0,0,0,0|3,0,0]=4 606 B19R2.867575 Cn1cc(cc(c1=O)N)SCCc2ccccc2 62a_106446545582_100011218657 [0,1,0,0,0,0|3,0,0]=4 607 B17R1.4488 C=C(Br)C(=O)NCCCCCc1ccccc1 11a_100000750932_100009813364 [0,0,1,0,0,0|2,0,1]=4 608 B17R1.4488 C=C(Br)C(=O)NCCCCCc1ccccc1 1626a_100000750932_100009813364 [0,0,1,0,0,0|2,0,1]=4 609 B17R1.4488 C=C(C)C(=O)NCCCCCc1ccccc1 11a_100000750932_100000185857 [0,0,1,0,0,0|2,0,1]=4 610 B17R1.4488 C=C(C)C(=O)NCCCCCc1ccccc1 1626a_100000750932_100000185857 [0,0,1,0,0,0|2,0,1]=4 611 B17R1.4488 C=C(Cl)C(=O)NCCCCCc1ccccc1 11a_100000750932_100000039160 [0,0,1,0,0,0|2,0,1]=4 612 B17R1.4488 C=C(Cl)C(=O)NCCCCCc1ccccc1 1626a_100000750932_100000039160 [0,0,1,0,0,0|2,0,1]=4 613 B17R1.4488 C=C(F)C(=O)NCCCCCc1ccccc1 11a_100000750932_100000036797 [0,0,1,0,0,0|2,0,1]=4 614 B17R1.4488 C=C(F)C(=O)NCCCCCc1ccccc1 1626a_100000750932_100000036797 [0,0,1,0,0,0|2,0,1]=4 615 B17R1.4488 CC(C)C(=O)NN=CCCCc1ccccc1 4a_100000184118_100011361547 [0,0,1,0,0,0|1,0,2]=4 616 B17R1.4488 NC(=O)C(=O)NN=CCCCc1ccccc1 4a_100000211141_100011361547 [0,0,1,0,0,0|1,0,1]=3 617 B17R1.4488 NC(=O)C(=O)NN=CCOCc1ccccc1 4a_100000211141_100011215530 [0,0,1,0,0,0|2,0,1]=4 618 B17R1.26833 C=CC(=O)NCC(=O)CCCc1ccccc1 1458a_200011222540_100000211621 [0,0,1,0,0,0|3,0,0]=4 619 B17R1.26833 C=CC(=O)NNC(=O)CCCc1ccccc1 22a_100011246310_100000185746 [0,0,1,0,0,0|2,0,1]=4 620 B17R1.26833 O=C(CO)NNC(=O)CCCc1ccccc1 22a_100011246310_100000210174 [0,0,1,0,0,0|1,0,2]=4 621 B19R3.12823 Cc1cc(n[nH]c1=O)SC2Cc3c2cccc3 62a_100009813401_100012187101 [0,0,0,1,0,0|2,0,0]=3 622 B19R3.12823 Cc1cnc(cc1O)SC2Cc3c2cccc3 62a_100000704368_100009813401 [0,0,0,1,0,0|3,0,0]=4 623 B19R3.12823 Cc1cnc(cc1O)SC2Cc3c2cccc3 62a_100009813401_100000704368 [0,0,0,1,0,0|3,0,0]=4 624 B19R3.12823 Nc1cc(n[nH]c1=O)SC2Cc3c2cccc3 62a_100009813401_100000102183 [0,0,0,1,0,0|2,0,0]=3 625 B19R3.12823 O=c1[nH]cc(cc1Br)SC2Cc3c2cccc3 62a_100009813401_100010125443 [0,0,0,1,0,0|3,0,0]=4 626 B19R3.12823 O=c1[nH]cc(cc1Br)SC2Cc3c2cccc3 62a_100010125443_100009813401 [0,0,0,1,0,0|3,0,0]=4 627 B19R3.12823 O=c1[nH]cc(cc1F)SC2Cc3c2cccc3 62a_100000723523_100009813401 [0,0,0,1,0,0|3,0,0]=4 628 B19R3.12823 O=c1[nH]cc(cc1F)SC2Cc3c2cccc3 62a_100009813401_100000723523 [0,0,0,1,0,0|3,0,0]=4 629 B19R3.12823 O=c1[nH]cc(cc1O)SC2Cc3c2cccc3 62a_100009813401_100009814561 [0,0,0,1,0,0|2,0,0]=3 630 B19R3.12823 Oc1cc(ncc1F)SC2Cc3c2cccc3 62a_100009813401_100009854642 [0,0,0,1,0,0|3,0,0]=4 631 B19R3.12823 Oc1cc(ncc1F)SC2Cc3c2cccc3 62a_100009854642_100009813401 [0,0,0,1,0,0|3,0,0]=4 632 B17R2.193 Cc1cc(n[nH]c1=O)C#Cc2ccccc2 271570a_100000069678_100012187101 [0,0,0,0,1,0|1,0,2]=4 633 B17R2.193 Cc1cc(n[nH]c1=O)C=Cc2ccccc2 271570a_100102527694_100012187101 [0,0,0,0,1,0|1,0,2]=4 634 B17R2.193 Cc1cc(n[nH]c1=O)SCc2ccccc2 62a_100000211182_100012187101 [0,0,0,0,1,0|2,0,0]=3 635 B17R2.193 Cc1cc(n[nH]c1=O)SCc2ccccn2 62a_100000721315_100012187101 [0,0,0,0,1,0|3,0,0]=4 636 B17R2.193 Cc1cc(n[nH]c1=O)SCc2cccnc2 62a_100000741622_100012187101 [0,0,0,0,1,0|3,0,0]=4 637 B17R2.193 Cc1cc(n[nH]c1=O)SCc2ccncc2 62a_100015193705_100012187101 [0,0,0,0,1,0|3,0,0]=4 638 B17R2.193 Cc1cnc(cc1O)SCc2ccccc2 62a_100000211182_100000704368 [0,0,0,0,1,0|3,0,0]=4 639 B17R2.193 Cc1cnc(cc1O)SCc2ccccc2 62a_100000704368_100015291786 [0,0,0,0,1,0|3,0,0]=4 640 B17R2.193 Nc1cc(n[nH]c1=O)C#Cc2ccccc2 271570a_100000069678_100000102183 [0,0,0,0,1,0|1,0,2]=4 641 B17R2.193 Nc1cc(n[nH]c1=O)C=Cc2ccccc2 271570a_100102527694_100000102183 [0,0,0,0,1,0|1,0,2]=4 642 B17R2.193 Nc1cc(n[nH]c1=O)SCc2ccccc2 62a_100000211182_100000102183 [0,0,0,0,1,0|2,0,0]=3 643 B17R2.193 Nc1cc(n[nH]c1=O)SCc2ccccn2 62a_100000721315_100000102183 [0,0,0,0,1,0|3,0,0]=4 644 B17R2.193 Nc1cc(n[nH]c1=O)SCc2cccnc2 62a_100000741622_100000102183 [0,0,0,0,1,0|3,0,0]=4 645 B17R2.193 Nc1cc(n[nH]c1=O)SCc2ccncc2 62a_100015193705_100000102183 [0,0,0,0,1,0|3,0,0]=4 646 B17R2.193 O=c1[nH]cc(cc1Br)SCc2ccccc2 62a_100000211182_100010125443 [0,0,0,0,1,0|3,0,0]=4 647 B17R2.193 O=c1[nH]cc(cc1Br)SCc2ccccc2 62a_100010125443_100015291786 [0,0,0,0,1,0|3,0,0]=4 648 B17R2.193 O=c1[nH]cc(cc1Cl)CNc2ccccc2 207a_100000106764_100000051075 [0,0,0,0,1,0|3,0,0]=4 649 B17R2.193 O=c1[nH]cc(cc1Cl)CNc2ccccc2 270302a_100000106764_100000051075 [0,0,0,0,1,0|3,0,0]=4 650 B17R2.193 O=c1[nH]cc(cc1F)SCc2ccccc2 62a_100000211182_100000723523 [0,0,0,0,1,0|3,0,0]=4 651 B17R2.193 O=c1[nH]cc(cc1F)SCc2ccccc2 62a_100000723523_100015291786 [0,0,0,0,1,0|3,0,0]=4 652 B17R2.193 O=c1[nH]cc(cc1O)C#Cc2ccccc2 271570a_100000069678_100009814561 [0,0,0,0,1,0|1,0,2]=4 653 B17R2.193 O=c1[nH]cc(cc1O)C=Cc2ccccc2 271570a_100102527694_100009814561 [0,0,0,0,1,0|1,0,2]=4 654 B17R2.193 O=c1[nH]cc(cc1O)SCc2ccccc2 62a_100000211182_100009814561 [0,0,0,0,1,0|2,0,0]=3 655 B17R2.193 O=c1[nH]cc(cc1O)SCc2ccccn2 62a_100000721315_100009814561 [0,0,0,0,1,0|3,0,0]=4 656 B17R2.193 O=c1[nH]cc(cc1O)SCc2cccnc2 62a_100000741622_100009814561 [0,0,0,0,1,0|3,0,0]=4 657 B17R2.193 O=c1[nH]cc(cc1O)SCc2ccncc2 62a_100015193705_100009814561 [0,0,0,0,1,0|3,0,0]=4 658 B17R2.193 Oc1cc(ncc1F)SCc2ccccc2 62a_100000211182_100009854642 [0,0,0,0,1,0|3,0,0]=4 659 B17R2.193 Oc1cc(ncc1F)SCc2ccccc2 62a_100009854642_100015291786 [0,0,0,0,1,0|3,0,0]=4 660 B17R2.339 Cc1cc(n[nH]c1=O)SCCc2cccs2 62a_100000748579_100012187101 [0,0,0,0,1,0|3,0,0]=4 661 B17R2.339 Cc1cc(n[nH]c1=O)SCCn2cccc2 62a_200009811947_100012187101 [0,0,0,0,1,0|3,0,0]=4 662 B17R2.339 Nc1cc(n[nH]c1=O)SCCc2cccs2 62a_100000748579_100000102183 [0,0,0,0,1,0|3,0,0]=4 663 B17R2.339 Nc1cc(n[nH]c1=O)SCCn2cccc2 62a_200009811947_100000102183 [0,0,0,0,1,0|3,0,0]=4 664 B17R2.339 O=c1[nH]cc(cc1O)SCCc2cccs2 62a_100000748579_100009814561 [0,0,0,0,1,0|3,0,0]=4 665 B17R2.339 O=c1[nH]cc(cc1O)SCCn2cccc2 62a_200009811947_100009814561 [0,0,0,0,1,0|3,0,0]=4 666 B17R2.19837 Cc1[nH]nc(c1C)SCCc2ccccc2 62a_100000765856_100015309786 [0,0,0,0,1,0|3,0,0]=4 667 B17R2.19837 Cc1[nH]nc(c1C)SCCc2ccccc2 62a_100015309786_100011218657 [0,0,0,0,1,0|3,0,0]=4 668 B17R2.19837 Cn1c(n[nH]c1=O)COCc2ccccc2 7a_100000210790_100010408635 [0,0,0,0,1,0|3,0,0]=4 669 B17R2.19837 Cn1c(n[nH]c1=O)CSCc2ccccc2 62a_100000211182_100010408635 [0,0,0,0,1,0|3,0,0]=4 670 B17R2.19837 Cn1c(n[nH]c1=O)CSCc2ccccc2 62a_100010408635_100015291786 [0,0,0,0,1,0|3,0,0]=4 671 B19R2.11839 Cc1cc(n[nH]c1=O)SC/C=C/c2ccccc2 62a_100016265936_100012187101 [0,0,0,0,0,1|1,0,2]=4 672 B19R2.11839 Cc1cc(n[nH]c1=O)SCCCc2ccccc2 62a_100000211621_100012187101 [0,0,0,0,0,1|1,0,0]=2 673 B19R2.11839 Cc1cc(n[nH]c1=O)SCCOc2ccccc2 62a_100000184471_100012187101 [0,0,0,0,0,1|2,0,0]=3 674 B19R2.11839 Cc1cc(n[nH]c1=O)SCCSc2ccccc2 62a_100000246102_100012187101 [0,0,0,0,0,1|2,0,0]=3 675 B19R2.11839 Cc1cc(n[nH]c1=O)SCOCc2ccccc2 62a_100000763385_100012187101 [0,0,0,0,0,1|2,0,0]=3 676 B19R2.11839 Cc1cc(n[nH]c1=O)SCSCc2ccccc2 62a_200011217039_100012187101 [0,0,0,0,0,1|2,0,0]=3 677 B19R2.11839 Cc1cc(ncc1Br)CNCCc2ccccc2 207a_100000106460_100009814806 [0,0,0,0,0,1|3,0,0]=4 678 B19R2.11839 Cc1cc(ncc1Br)CNCCc2ccccc2 270004a_100000106460_100009814806 [0,0,0,0,0,1|3,0,0]=4 679 B19R2.11839 Cc1cc(ncc1Br)COCCc2ccccc2 34a_200010713146_100000765856 [0,0,0,0,0,1|3,0,0]=4 680 B19R2.11839 Cc1cc(ncc1Br)OCCCc2ccccc2 34a_100000766222_100000211621 [0,0,0,0,0,1|3,0,0]=4 681 B19R2.11839 Cc1cc(ncc1Br)SCCCc2ccccc2 62a_100000211621_100012356354 [0,0,0,0,0,1|3,0,0]=4 682 B19R2.11839 Cc1cc(ncc1Br)SCCCc2ccccc2 62a_100012356354_100000211621 [0,0,0,0,0,1|3,0,0]=4 683 B19R2.11839 Cc1cc(ncc1Cl)OCCCc2ccccc2 34a_200000085746_100000211621 [0,0,0,0,0,1|3,0,0]=4 684 B19R2.11839 Cc1cc(ncc1F)SCCCc2ccccc2 62a_100000211621_100009818257 [0,0,0,0,0,1|3,0,0]=4 685 B19R2.11839 Cc1cc(ncc1F)SCCCc2ccccc2 62a_100009818257_100000211621 [0,0,0,0,0,1|3,0,0]=4 686 B19R2.11839 Cc1cc(ncc1N)SCCCc2ccccc2 62a_100000067204_100000211621 [0,0,0,0,0,1|3,0,0]=4 687 B19R2.11839 Cc1cc(ncc1N)SCCCc2ccccc2 62a_100000211621_100000067204 [0,0,0,0,0,1|3,0,0]=4 688 B19R2.11839 Cc1cc(ncc1O)SCCCc2ccccc2 62a_100000211621_100000692680 [0,0,0,0,0,1|2,0,1]=4 689 B19R2.11839 Cc1cc(nnc1N)SCCCc2ccccc2 62a_100000211621_100153394926 [0,0,0,0,0,1|2,0,1]=4 690 B19R2.11839 Cc1cc(nnc1N)SCCCc2ccccc2 62a_100153394926_100000211621 [0,0,0,0,0,1|2,0,1]=4 691 B19R2.11839 Cc1ccc(cc1O)NCCCc2ccccc2 34a_100000759471_100000211621 [0,0,0,0,0,1|3,0,0]=4 692 B19R2.11839 Cc1ccc(cc1O)NCCCc2ccccc2 7a_100000759471_100000211621 [0,0,0,0,0,1|3,0,0]=4 693 B19R2.11839 Cc1ccc(cc1O)SCCCc2ccccc2 62a_100000211621_100000685420 [0,0,0,0,0,1|3,0,0]=4 694 B19R2.11839 Cc1ccc(cc1O)SCCCc2ccccc2 62a_100000685420_100000211621 [0,0,0,0,0,1|3,0,0]=4 695 B19R2.11839 Cc1cnc(cc1Br)CNCCc2ccccc2 207a_100000106460_100010174032 [0,0,0,0,0,1|3,0,0]=4 696 B19R2.11839 Cc1cnc(cc1Br)CNCCc2ccccc2 270004a_100000106460_100010174032 [0,0,0,0,0,1|3,0,0]=4 697 B19R2.11839 Cc1cnc(cc1Br)COCCc2ccccc2 34a_100010113723_100000765856 [0,0,0,0,0,1|3,0,0]=4 698 B19R2.11839 Cc1cnc(cc1Br)COCCc2ccccc2 7a_100010113723_100000765856 [0,0,0,0,0,1|3,0,0]=4 699 B19R2.11839 Cc1cnc(cc1Br)OCCCc2ccccc2 34a_100009831917_100000211621 [0,0,0,0,0,1|3,0,0]=4 700 B19R2.11839 Cc1cnc(cc1C)SCCCc2ccccc2 62a_100000211621_100009850809 [0,0,0,0,0,1|3,0,0]=4 701 B19R2.11839 Cc1cnc(cc1C)SCCCc2ccccc2 62a_100009850809_100000211621 [0,0,0,0,0,1|3,0,0]=4 702 B19R2.11839 Cc1cnc(cc1Cl)COCCc2ccccc2 34a_200000144627_100000765856 [0,0,0,0,0,1|3,0,0]=4 703 B19R2.11839 Cc1cnc(cc1Cl)COCCc2ccccc2 7a_200000144627_100000765856 [0,0,0,0,0,1|3,0,0]=4 704 B19R2.11839 Cc1cnc(cc1F)NCCCc2ccccc2 27a_100000211184_100009841206 [0,0,0,0,0,1|3,0,0]=4 705 B19R2.11839 Cc1cnc(cc1F)SCCCc2ccccc2 62a_100000211621_100009841206 [0,0,0,0,0,1|3,0,0]=4 706 B19R2.11839 Cc1cnc(cc1F)SCCCc2ccccc2 62a_100009841206_100000211621 [0,0,0,0,0,1|3,0,0]=4 707 B19R2.11839 Cc1cnc(cc1N)SCCCc2ccccc2 62a_100000126663_100000211621 [0,0,0,0,0,1|3,0,0]=4 708 B19R2.11839 Cc1cnc(cc1N)SCCCc2ccccc2 62a_100000211621_100000126663 [0,0,0,0,0,1|3,0,0]=4 709 B19R2.11839 Cc1cnc(cc1O)SCCCc2ccccc2 62a_100000211621_100000704368 [0,0,0,0,0,1|2,0,0]=3 710 B19R2.11839 Cc1cnc(cc1O)SCCCc2ccccc2 62a_100000704368_100000211621 [0,0,0,0,0,1|2,0,0]=3 711 B19R2.11839 Cc1cnc(cc1O)SCCOc2ccccc2 62a_100000184471_100000704368 [0,0,0,0,0,1|3,0,0]=4 712 B19R2.11839 Cc1cnc(cc1O)SCCOc2ccccc2 62a_100000704368_100000184471 [0,0,0,0,0,1|3,0,0]=4 713 B19R2.11839 Cc1cnc(cc1O)SCCSc2ccccc2 62a_100000246102_100000704368 [0,0,0,0,0,1|3,0,0]=4 714 B19R2.11839 Cc1cnc(cc1O)SCCSc2ccccc2 62a_100000704368_100000246102 [0,0,0,0,0,1|3,0,0]=4 715 B19R2.11839 Cc1cnc(cc1O)SCOCc2ccccc2 62a_100000704368_100000763385 [0,0,0,0,0,1|3,0,0]=4 716 B19R2.11839 Cc1cnc(cc1O)SCOCc2ccccc2 62a_100000763385_100000704368 [0,0,0,0,0,1|3,0,0]=4 717 B19R2.11839 Cc1cnc(cc1O)SCSCc2ccccc2 62a_100000704368_200011217039 [0,0,0,0,0,1|3,0,0]=4 718 B19R2.11839 Cc1cnc(cc1O)SCSCc2ccccc2 62a_200011217039_100000704368 [0,0,0,0,0,1|3,0,0]=4 719 B19R2.11839 Cc1nc(c[nH]c1=O)SCCCc2ccccc2 62a_100000211621_100010363809 [0,0,0,0,0,1|3,0,0]=4 720 B19R2.11839 Cc1nc(c[nH]c1=O)SCCCc2ccccc2 62a_100010363809_100000211621 [0,0,0,0,0,1|3,0,0]=4 721 B19R2.11839 Cc1ncc(cc1O)SCCCc2ccccc2 62a_100000211621_100009864810 [0,0,0,0,0,1|2,0,1]=4 722 B19R2.11839 Cc1ncc(cc1O)SCCCc2ccccc2 62a_100009864810_100000211621 [0,0,0,0,0,1|2,0,1]=4 723 B19R2.11839 Clc1cc(ncc1Br)OCCCc2ccccc2 34a_100010369989_100000211621 [0,0,0,0,0,1|3,0,0]=4 724 B19R2.11839 Clc1cnc(cc1Cl)OCCCc2ccccc2 34a_200000099200_100000211621 [0,0,0,0,0,1|3,0,0]=4 725 B19R2.11839 Cn1cc(ncc1=O)SCCCc2ccccc2 62a_100000211621_100009843036 [0,0,0,0,0,1|3,0,0]=4 726 B19R2.11839 Cn1cc(ncc1=O)SCCCc2ccccc2 62a_100009843036_100000211621 [0,0,0,0,0,1|3,0,0]=4 727 B19R2.11839 Nc1cc(n[nH]c1=O)SC/C=C/c2ccccc2 62a_100016265936_100000102183 [0,0,0,0,0,1|1,0,2]=4 728 B19R2.11839 Nc1cc(n[nH]c1=O)SCCCc2ccccc2 62a_100000211621_100000102183 [0,0,0,0,0,1|1,0,0]=2 729 B19R2.11839 Nc1cc(n[nH]c1=O)SCCOc2ccccc2 62a_100000184471_100000102183 [0,0,0,0,0,1|2,0,0]=3 730 B19R2.11839 Nc1cc(n[nH]c1=O)SCCSc2ccccc2 62a_100000246102_100000102183 [0,0,0,0,0,1|2,0,0]=3 731 B19R2.11839 Nc1cc(n[nH]c1=O)SCOCc2ccccc2 62a_100000763385_100000102183 [0,0,0,0,0,1|2,0,0]=3 732 B19R2.11839 Nc1cc(n[nH]c1=O)SCSCc2ccccc2 62a_200011217039_100000102183 [0,0,0,0,0,1|2,0,0]=3 733 B19R2.11839 Nc1cc(ncc1F)SCCCc2ccccc2 62a_100000126464_100000211621 [0,0,0,0,0,1|3,0,0]=4 734 B19R2.11839 Nc1cc(ncc1F)SCCCc2ccccc2 62a_100000211621_100000126464 [0,0,0,0,0,1|3,0,0]=4 735 B19R2.11839 Nc1cc(ncc1O)SCCCc2ccccc2 62a_100000211621_100009819941 [0,0,0,0,0,1|2,0,1]=4 736 B19R2.11839 Nc1cc(ncc1O)SCCCc2ccccc2 62a_100009819941_100000211621 [0,0,0,0,0,1|2,0,1]=4 737 B19R2.11839 Nc1ccc(cc1O)SCCCc2ccccc2 62a_100000211621_100000739049 [0,0,0,0,0,1|3,0,0]=4 738 B19R2.11839 Nc1ccc(cc1O)SCCCc2ccccc2 62a_100000739049_100000211621 [0,0,0,0,0,1|3,0,0]=4 739 B19R2.11839 Nc1cnc(cc1N)SCCCc2ccccc2 62a_100000067514_100000211621 [0,0,0,0,0,1|3,0,0]=4 740 B19R2.11839 Nc1cnc(cc1N)SCCCc2ccccc2 62a_100000211621_100000067514 [0,0,0,0,0,1|3,0,0]=4 741 B19R2.11839 Nc1ncc(cc1O)SCCCc2ccccc2 62a_100000211621_100009819042 [0,0,0,0,0,1|2,0,1]=4 742 B19R2.11839 Nc1ncc(cc1O)SCCCc2ccccc2 62a_100009819042_100000211621 [0,0,0,0,0,1|2,0,1]=4 743 B19R2.11839 O=c1[nH]cc(cc1Br)SCCCc2ccccc2 62a_100000211621_100010125443 [0,0,0,0,0,1|2,0,0]=3 744 B19R2.11839 O=c1[nH]cc(cc1Br)SCCCc2ccccc2 62a_100010125443_100000211621 [0,0,0,0,0,1|2,0,0]=3 745 B19R2.11839 O=c1[nH]cc(cc1Br)SCCOc2ccccc2 62a_100000184471_100010125443 [0,0,0,0,0,1|3,0,0]=4 746 B19R2.11839 O=c1[nH]cc(cc1Br)SCCOc2ccccc2 62a_100010125443_100000184471 [0,0,0,0,0,1|3,0,0]=4 747 B19R2.11839 O=c1[nH]cc(cc1Br)SCCSc2ccccc2 62a_100000246102_100010125443 [0,0,0,0,0,1|3,0,0]=4 748 B19R2.11839 O=c1[nH]cc(cc1Br)SCCSc2ccccc2 62a_100010125443_100000246102 [0,0,0,0,0,1|3,0,0]=4 749 B19R2.11839 O=c1[nH]cc(cc1Br)SCOCc2ccccc2 62a_100000763385_100010125443 [0,0,0,0,0,1|3,0,0]=4 750 B19R2.11839 O=c1[nH]cc(cc1Br)SCOCc2ccccc2 62a_100010125443_100000763385 [0,0,0,0,0,1|3,0,0]=4 751 B19R2.11839 O=c1[nH]cc(cc1Br)SCSCc2ccccc2 62a_100010125443_200011217039 [0,0,0,0,0,1|3,0,0]=4 752 B19R2.11839 O=c1[nH]cc(cc1Br)SCSCc2ccccc2 62a_200011217039_100010125443 [0,0,0,0,0,1|3,0,0]=4 753 B19R2.11839 O=c1[nH]cc(cc1Cl)CNCCc2ccccc2 207a_100000106460_100000051075 [0,0,0,0,0,1|2,0,0]=3 754 B19R2.11839 O=c1[nH]cc(cc1Cl)CNCCc2ccccc2 270004a_100000106460_100000051075 [0,0,0,0,0,1|2,0,0]=3 755 B19R2.11839 O=c1[nH]cc(cc1Cl)CNCCc2ccccn2 207a_100000211156_100000051075 [0,0,0,0,0,1|3,0,0]=4 756 B19R2.11839 O=c1[nH]cc(cc1Cl)CNCCc2ccccn2 270004a_100000211156_100000051075 [0,0,0,0,0,1|3,0,0]=4 757 B19R2.11839 O=c1[nH]cc(cc1Cl)CNCCc2cccnc2 207a_100000736294_100000051075 [0,0,0,0,0,1|3,0,0]=4 758 B19R2.11839 O=c1[nH]cc(cc1Cl)CNCCc2cccnc2 270004a_100000736294_100000051075 [0,0,0,0,0,1|3,0,0]=4 759 B19R2.11839 O=c1[nH]cc(cc1Cl)CNCCc2ccncc2 207a_100000742849_100000051075 [0,0,0,0,0,1|3,0,0]=4 760 B19R2.11839 O=c1[nH]cc(cc1Cl)CNCCc2ccncc2 270004a_100000742849_100000051075 [0,0,0,0,0,1|3,0,0]=4 761 B19R2.11839 O=c1[nH]cc(cc1F)SCCCc2ccccc2 62a_100000211621_100000723523 [0,0,0,0,0,1|2,0,0]=3 762 B19R2.11839 O=c1[nH]cc(cc1F)SCCCc2ccccc2 62a_100000723523_100000211621 [0,0,0,0,0,1|2,0,0]=3 763 B19R2.11839 O=c1[nH]cc(cc1F)SCCOc2ccccc2 62a_100000184471_100000723523 [0,0,0,0,0,1|3,0,0]=4 764 B19R2.11839 O=c1[nH]cc(cc1F)SCCOc2ccccc2 62a_100000723523_100000184471 [0,0,0,0,0,1|3,0,0]=4 765 B19R2.11839 O=c1[nH]cc(cc1F)SCCSc2ccccc2 62a_100000246102_100000723523 [0,0,0,0,0,1|3,0,0]=4 766 B19R2.11839 O=c1[nH]cc(cc1F)SCCSc2ccccc2 62a_100000723523_100000246102 [0,0,0,0,0,1|3,0,0]=4 767 B19R2.11839 O=c1[nH]cc(cc1F)SCOCc2ccccc2 62a_100000723523_100000763385 [0,0,0,0,0,1|3,0,0]=4 768 B19R2.11839 O=c1[nH]cc(cc1F)SCOCc2ccccc2 62a_100000763385_100000723523 [0,0,0,0,0,1|3,0,0]=4 769 B19R2.11839 O=c1[nH]cc(cc1F)SCSCc2ccccc2 62a_100000723523_200011217039 [0,0,0,0,0,1|3,0,0]=4 770 B19R2.11839 O=c1[nH]cc(cc1F)SCSCc2ccccc2 62a_200011217039_100000723523 [0,0,0,0,0,1|3,0,0]=4 771 B19R2.11839 O=c1[nH]cc(cc1O)SC/C=C/c2ccccc2 62a_100016265936_100009814561 [0,0,0,0,0,1|1,0,2]=4 772 B19R2.11839 O=c1[nH]cc(cc1O)SCCCc2ccccc2 62a_100000211621_100009814561 [0,0,0,0,0,1|1,0,0]=2 773 B19R2.11839 O=c1[nH]cc(cc1O)SCCOc2ccccc2 62a_100000184471_100009814561 [0,0,0,0,0,1|2,0,0]=3 774 B19R2.11839 O=c1[nH]cc(cc1O)SCCSc2ccccc2 62a_100000246102_100009814561 [0,0,0,0,0,1|2,0,0]=3 775 B19R2.11839 O=c1[nH]cc(cc1O)SCOCc2ccccc2 62a_100000763385_100009814561 [0,0,0,0,0,1|2,0,0]=3 776 B19R2.11839 O=c1[nH]cc(cc1O)SCSCc2ccccc2 62a_200011217039_100009814561 [0,0,0,0,0,1|2,0,0]=3 777 B19R2.11839 Oc1cc(ccc1Br)SCCCc2ccccc2 62a_100000211621_100012356990 [0,0,0,0,0,1|3,0,0]=4 778 B19R2.11839 Oc1cc(ccc1Br)SCCCc2ccccc2 62a_100012356990_100000211621 [0,0,0,0,0,1|3,0,0]=4 779 B19R2.11839 Oc1cc(ccc1Cl)CNCCc2ccccc2 34a_100020636435_100000765856 [0,0,0,0,0,1|3,0,0]=4 780 B19R2.11839 Oc1cc(ccc1Cl)NCCCc2ccccc2 34a_100011934209_100000211621 [0,0,0,0,0,1|3,0,0]=4 781 B19R2.11839 Oc1cc(ccc1Cl)SCCCc2ccccc2 62a_100000211621_100011356854 [0,0,0,0,0,1|3,0,0]=4 782 B19R2.11839 Oc1cc(ccc1Cl)SCCCc2ccccc2 62a_100011356854_100000211621 [0,0,0,0,0,1|3,0,0]=4 783 B19R2.11839 Oc1cc(ccc1F)CNCCc2ccccc2 34a_100160469508_100000765856 [0,0,0,0,0,1|3,0,0]=4 784 B19R2.11839 Oc1cc(ccc1F)NCCCc2ccccc2 34a_100012017398_100000211621 [0,0,0,0,0,1|3,0,0]=4 785 B19R2.11839 Oc1cc(ccc1F)NCCCc2ccccc2 7a_100012017398_100000211621 [0,0,0,0,0,1|3,0,0]=4 786 B19R2.11839 Oc1cc(ccc1F)SCCCc2ccccc2 62a_100000211621_100000686035 [0,0,0,0,0,1|3,0,0]=4 787 B19R2.11839 Oc1cc(ccc1F)SCCCc2ccccc2 62a_100000686035_100000211621 [0,0,0,0,0,1|3,0,0]=4 788 B19R2.11839 Oc1cc(cnc1F)SCCCc2ccccc2 62a_100000211621_100009819871 [0,0,0,0,0,1|2,0,1]=4 789 B19R2.11839 Oc1cc(cnc1F)SCCCc2ccccc2 62a_100009819871_100000211621 [0,0,0,0,0,1|2,0,1]=4 790 B19R2.11839 Oc1cc(ncc1F)SCCCc2ccccc2 62a_100000211621_100009854642 [0,0,0,0,0,1|2,0,0]=3 791 B19R2.11839 Oc1cc(ncc1F)SCCCc2ccccc2 62a_100009854642_100000211621 [0,0,0,0,0,1|2,0,0]=3 792 B19R2.11839 Oc1cc(ncc1F)SCCOc2ccccc2 62a_100000184471_100009854642 [0,0,0,0,0,1|3,0,0]=4 793 B19R2.11839 Oc1cc(ncc1F)SCCOc2ccccc2 62a_100009854642_100000184471 [0,0,0,0,0,1|3,0,0]=4 794 B19R2.11839 Oc1cc(ncc1F)SCCSc2ccccc2 62a_100000246102_100009854642 [0,0,0,0,0,1|3,0,0]=4 795 B19R2.11839 Oc1cc(ncc1F)SCCSc2ccccc2 62a_100009854642_100000246102 [0,0,0,0,0,1|3,0,0]=4 796 B19R2.11839 Oc1cc(ncc1F)SCOCc2ccccc2 62a_100000763385_100009854642 [0,0,0,0,0,1|3,0,0]=4 797 B19R2.11839 Oc1cc(ncc1F)SCOCc2ccccc2 62a_100009854642_100000763385 [0,0,0,0,0,1|3,0,0]=4 798 B19R2.11839 Oc1cc(ncc1F)SCSCc2ccccc2 62a_100009854642_200011217039 [0,0,0,0,0,1|3,0,0]=4 799 B19R2.11839 Oc1cc(ncc1F)SCSCc2ccccc2 62a_200011217039_100009854642 [0,0,0,0,0,1|3,0,0]=4 800 B19R2.11839 Oc1ccc(cc1O)CCNCc2ccccc2 34a_100000210387_100015291786 [0,0,0,0,0,1|2,0,1]=4 801 B19R2.11839 Oc1ccc(cc1O)CCOCc2ccccc2 7a_100000210790_200010393615 [0,0,0,0,0,1|2,0,1]=4 802 B19R2.11839 Oc1ccc(cc1O)CCSCc2ccccc2 62a_100000211182_200010393615 [0,0,0,0,0,1|2,0,1]=4 803 B19R2.11839 Oc1ccc(cc1O)CNCCc2ccccc2 34a_100000010075_100000765856 [0,0,0,0,0,1|2,0,1]=4 804 B19R2.11839 Oc1ccc(cc1O)NCCCc2ccccc2 34a_100102946323_100000211621 [0,0,0,0,0,1|2,0,1]=4 805 B19R2.11839 Oc1ccc(cc1O)SCCCc2ccccc2 62a_100000211621_100009813601 [0,0,0,0,0,1|2,0,1]=4 806 B19R2.11839 Oc1nc(ncc1F)NCCCc2ccccc2 27a_100000211184_100011995740 [0,0,0,0,0,1|3,0,0]=4 807 B19R2.11839 Oc1nc(ncc1F)SCCCc2ccccc2 62a_100000211621_100011995740 [0,0,0,0,0,1|3,0,0]=4 808 B16R1.1166 C=CC(=O)NCCCCCc1ccccc1 1626a_100000750932_100000185746 [1,0,1,0,0,0|1,0,1]=4 809 B16R1.1166 C=CC(=O)NCCCCCc1ccccc1 240690a_100000750932_200121576911 [1,0,1,0,0,0|1,0,1]=4 810 B16R1.1166 CCC(=O)NN=CCCCc1ccccc1 4a_100000183195_100011361547 [1,0,1,0,0,0|0,0,2]=4 811 B16R2.2256 c1ccc(cc1)CCNc2cccnn2 27a_100000106460_100016991348 [2,0,0,0,0,0|1,0,1]=4 812 B16R2.2256 c1ccc(cc1)CCSc2ccccn2 62a_100000765856_100011216584 [2,0,0,0,0,0|2,0,0]=4 813 B16R2.2256 c1ccc(cc1)CCSc2ccccn2 62a_100011216584_100011218657 [2,0,0,0,0,0|2,0,0]=4 814 B16R2.2256 c1ccc(cc1)CCSc2cccnn2 62a_100000765856_100016991348 [2,0,0,0,0,0|1,0,1]=4 815 B16R2.2256 c1ccc(cc1)CCSc2cccnn2 62a_100016991348_100011218657 [2,0,0,0,0,0|1,0,1]=4 816 B16R2.2256 c1ccc(cc1)CNCc2ccccn2 207a_100015324214_100000209966 [2,0,0,0,0,0|2,0,0]=4 817 B16R2.2256 c1ccc(cc1)CNCc2ccccn2 2230a_100015324214_100000721315 [2,0,0,0,0,0|2,0,0]=4 818 B16R2.2256 c1ccc(cc1)CNCc2ccccn2 270004a_100000210449_100015611070 [2,0,0,0,0,0|2,0,0]=4 819 B16R2.2256 c1ccc(cc1)CNCc2ccccn2 270004a_100015324214_100000209966 [2,0,0,0,0,0|2,0,0]=4 820 B16R2.2256 c1ccc(cc1)CNCc2ccccn2 34a_100015324214_100000721315 [2,0,0,0,0,0|2,0,0]=4 821 B16R2.2256 c1ccc(cc1)CNCc2cccnn2 2230a_100015324214_100016990269 [2,0,0,0,0,0|1,0,1]=4 822 B16R2.2256 c1ccc(cc1)CNCc2cccnn2 2230a_100159270163_100015291786 [2,0,0,0,0,0|1,0,1]=4 823 B16R2.2256 c1ccc(cc1)CNCc2cccnn2 34a_100015324214_100016990269 [2,0,0,0,0,0|1,0,1]=4 824 B16R2.2256 c1ccc(cc1)COCc2ccccn2 34a_100000210790_100000721315 [2,0,0,0,0,0|2,0,0]=4 825 B16R2.2256 c1ccc(cc1)COCc2ccccn2 7a_100000210790_100000721315 [2,0,0,0,0,0|2,0,0]=4 826 B16R2.2256 c1ccc(cc1)COCc2cccnn2 34a_100000210790_100016990269 [2,0,0,0,0,0|1,0,1]=4 827 B16R2.2256 c1ccc(cc1)COCc2cccnn2 7a_100000210790_100016990269 [2,0,0,0,0,0|1,0,1]=4 828 B16R2.2256 c1ccc(cc1)CSCc2ccccn2 62a_100000211182_100000721315 [2,0,0,0,0,0|2,0,0]=4 829 B16R2.2256 c1ccc(cc1)CSCc2ccccn2 62a_100000721315_100015291786 [2,0,0,0,0,0|2,0,0]=4 830 B16R2.2256 c1ccc(cc1)CSCc2cccnn2 62a_100000211182_100016990269 [2,0,0,0,0,0|1,0,1]=4 831 B16R2.2256 c1ccc(cc1)CSCc2cccnn2 62a_100016990269_100015291786 [2,0,0,0,0,0|1,0,1]=4 832 B16R2.2256 c1ccc(cc1)OCCc2ccccn2 7a_100000210340_100015183660 [2,0,0,0,0,0|2,0,0]=4 833 B16R2.2256 c1ccc(cc1)SCCc2ccccn2 62a_100000719477_100015183660 [2,0,0,0,0,0|2,0,0]=4 834 B16R2.2256 c1ccc(cc1)SCCc2ccccn2 62a_100015183660_100000041952 [2,0,0,0,0,0|2,0,0]=4 835 B18R1.1642 COC(C)C(=O)NN=CCCCc1ccccc1 4a_100000243824_100011361547 [0,1,1,0,0,0|0,0,2]=4 836 B18R1.21066 C=C(C)C(=O)NCC(=O)CCCc1ccccc1 1458a_100000076187_100000211621 [0,1,1,0,0,0|2,0,0]=4 837 B18R1.21066 C=C(C)C(=O)NNC(=O)CCCc1ccccc1 22a_100011246310_100000185857 [0,1,1,0,0,0|1,0,1]=4 838 B18R1.21066 C=C(Cl)C(=O)NNC(=O)CCCc1ccccc1 22a_100011246310_100000039160 [0,1,1,0,0,0|1,0,1]=4 839 B18R1.21066 C=C(F)C(=O)NNC(=O)CCCc1ccccc1 22a_100011246310_100000036797 [0,1,1,0,0,0|1,0,1]=4 840 B18R2.61 O=Cc1ccc(nc1)SCCc2ccccc2 62a_100000765856_100000766901 [1,1,0,0,0,0|2,0,0]=4 841 B18R2.61 O=Cc1ccc(nc1)SCCc2ccccc2 62a_100000766901_100011218657 [1,1,0,0,0,0|2,0,0]=4 842 B18R2.61 O=Cc1ccc(nn1)SCCc2ccccc2 62a_100000044651_100011218657 [1,1,0,0,0,0|1,0,1]=4 843 B18R2.61 O=Cc1ccc(nn1)SCCc2ccccc2 62a_100000765856_100000044651 [1,1,0,0,0,0|1,0,1]=4 844 B18R2.257 CC(COc1ccc(=O)[nH]c1)c2ccccc2 34a_100000075641_100000756946 [1,1,0,0,0,0|2,0,0]=4 845 B18R2.257 CC(CSc1ccc(=O)[nH]c1)c2ccccc2 62a_100000212171_100000756946 [1,1,0,0,0,0|2,0,0]=4 846 B18R2.257 CC(CSc1ccc(=O)[nH]c1)c2ccccc2 62a_100000756946_100000212171 [1,1,0,0,0,0|2,0,0]=4 847 B18R2.257 CC(CSc1ccc(=O)[nH]n1)c2ccccc2 62a_100000756946_100009820020 [1,1,0,0,0,0|1,0,0]=3 848 B18R2.257 CC(CSc1ccc(=O)[nH]n1)c2ccccc2 62a_100009820020_100000756946 [1,1,0,0,0,0|1,0,0]=3 849 B18R2.257 CC(NCc1ccc(=O)[nH]n1)c2ccccn2 207a_100000181244_100011361533 [1,1,0,0,0,0|2,0,0]=4 850 B18R2.257 CC(NCc1ccc(=O)[nH]n1)c2ccccn2 270004a_100000181244_100011361533 [1,1,0,0,0,0|2,0,0]=4 851 B18R2.257 CC(NCc1ccc(=O)[nH]n1)c2cccnc2 207a_100000195435_100011361533 [1,1,0,0,0,0|2,0,0]=4 852 B18R2.257 CC(NCc1ccc(=O)[nH]n1)c2cccnc2 270004a_100000195435_100011361533 [1,1,0,0,0,0|2,0,0]=4 853 B18R2.257 CC(NCc1ccc(=O)[nH]n1)c2ccncc2 207a_100000181269_100011361533 [1,1,0,0,0,0|2,0,0]=4 854 B18R2.257 CC(NCc1ccc(=O)[nH]n1)c2ccncc2 270004a_100000181269_100011361533 [1,1,0,0,0,0|2,0,0]=4 855 B18R2.257 CC(OCc1ccc(=O)[nH]c1)c2ccccc2 34a_100011999846_100000211855 [1,1,0,0,0,0|2,0,0]=4 856 B18R2.257 C[C@@H](NCc1ccc(=O)[nH]n1)c2ccccc2 207a_100000751104_100011361533 [1,1,0,0,0,0|1,0,0]=3 857 B18R2.257 C[C@@H](NCc1ccc(=O)[nH]n1)c2ccccc2 270004a_100000751104_100011361533 [1,1,0,0,0,0|1,0,0]=3 858 B18R2.257 O=C(CSc1ccc(=O)[nH]n1)c2ccccc2 62a_100000211460_100009820020 [1,1,0,0,0,0|1,0,1]=4 859 B18R2.257 O=C(CSc1ccc(=O)[nH]n1)c2ccccc2 62a_100009820020_100000211460 [1,1,0,0,0,0|1,0,1]=4 860 B18R2.257 O=c1ccc(c[nH]1)OCC(O)c2ccccc2 34a_100000075641_100000185958 [1,1,0,0,0,0|2,0,0]=4 861 B18R2.257 O=c1ccc(c[nH]1)OC[C@@H](O)c2ccccc2 34a_100000075641_100011933945 [1,1,0,0,0,0|2,0,0]=4 862 B18R2.257 O=c1ccc(c[nH]1)SCC(O)c2ccccc2 62a_100000185958_100000212171 [1,1,0,0,0,0|2,0,0]=4 863 B18R2.257 O=c1ccc(c[nH]1)SCC(O)c2ccccc2 62a_100000212171_100000185958 [1,1,0,0,0,0|2,0,0]=4 864 B18R2.257 O=c1ccc(c[nH]1)SC[C@@H](O)c2ccccc2 62a_100000212171_100011933945 [1,1,0,0,0,0|2,0,0]=4 865 B18R2.257 O=c1ccc(c[nH]1)SC[C@@H](O)c2ccccc2 62a_100011933945_100000212171 [1,1,0,0,0,0|2,0,0]=4 866 B18R2.257 O=c1ccc(n[nH]1)SCC(O)c2ccccc2 62a_100000185958_100009820020 [1,1,0,0,0,0|1,0,0]=3 867 B18R2.257 O=c1ccc(n[nH]1)SCC(O)c2ccccc2 62a_100009820020_100000185958 [1,1,0,0,0,0|1,0,0]=3 868 B18R2.257 O=c1ccc(n[nH]1)SCS(=O)c2ccccc2 62a_100009820020_100000031784 [1,1,0,0,0,0|2,0,0]=4 869 B18R2.257 O=c1ccc(n[nH]1)SC[C@@H](O)c2ccccc2 62a_100009820020_100011933945 [1,1,0,0,0,0|1,0,0]=3 870 B18R2.257 O=c1ccc(n[nH]1)SC[C@@H](O)c2ccccc2 62a_100011933945_100009820020 [1,1,0,0,0,0|1,0,0]=3 871 B18R2.266 CC(Cc1ccccc1)Oc2ccc(=O)[nH]c2 34a_100000075641_200011218536 [1,1,0,0,0,0|2,0,0]=4 872 B18R2.266 CC(Cc1ccccc1)Sc2ccc(=O)[nH]c2 62a_100000212171_200011218536 [1,1,0,0,0,0|2,0,0]=4 873 B18R2.266 CC(Cc1ccccc1)Sc2ccc(=O)[nH]c2 62a_200011218536_100000212171 [1,1,0,0,0,0|2,0,0]=4 874 B18R2.266 CC(Cc1ccccc1)Sc2ccc(=O)[nH]n2 62a_100009820020_200011218536 [1,1,0,0,0,0|1,0,0]=3 875 B18R2.266 CC(Cc1ccccc1)Sc2ccc(=O)[nH]n2 62a_200011218536_100009820020 [1,1,0,0,0,0|1,0,0]=3 876 B18R2.266 CN(Cc1ccccc1)Cc2ccc(=O)[nH]n2 270004a_100000186898_100011361533 [1,1,0,0,0,0|1,0,0]=3 877 B18R2.266 CN(Cc1ccccn1)Cc2ccc(=O)[nH]n2 270004a_100000207498_100011361533 [1,1,0,0,0,0|2,0,0]=4 878 B18R2.266 CN(Cc1cccnc1)Cc2ccc(=O)[nH]n2 270004a_100000184577_100011361533 [1,1,0,0,0,0|2,0,0]=4 879 B18R2.266 CN(Cc1ccncc1)Cc2ccc(=O)[nH]n2 270004a_100000187231_100011361533 [1,1,0,0,0,0|2,0,0]=4 880 B18R2.269 Cc1cc(ccn1)CNCc2ccc(=O)[nH]n2 207a_100011934566_100011361533 [1,1,0,0,0,0|2,0,0]=4 881 B18R2.269 Cc1cc(ccn1)CNCc2ccc(=O)[nH]n2 270004a_100011934566_100011361533 [1,1,0,0,0,0|2,0,0]=4 882 B18R2.269 Cc1cccc(c1)CCOc2ccc(=O)[nH]c2 34a_100000075641_100011713685 [1,1,0,0,0,0|2,0,0]=4 883 B18R2.269 Cc1cccc(c1)CCSc2ccc(=O)[nH]c2 62a_100000212171_100011713685 [1,1,0,0,0,0|2,0,0]=4 884 B18R2.269 Cc1cccc(c1)CCSc2ccc(=O)[nH]c2 62a_100011713685_100000212171 [1,1,0,0,0,0|2,0,0]=4 885 B18R2.269 Cc1cccc(c1)CCSc2ccc(=O)[nH]n2 62a_100009820020_100011713685 [1,1,0,0,0,0|1,0,0]=3 886 B18R2.269 Cc1cccc(c1)CCSc2ccc(=O)[nH]n2 62a_100011713685_100009820020 [1,1,0,0,0,0|1,0,0]=3 887 B18R2.269 Cc1cccc(c1)CNCc2ccc(=O)[nH]n2 207a_100000185548_100011361533 [1,1,0,0,0,0|1,0,0]=3 888 B18R2.269 Cc1cccc(c1)CNCc2ccc(=O)[nH]n2 270004a_100000185548_100011361533 [1,1,0,0,0,0|1,0,0]=3 889 B18R2.269 Cc1cccc(c1)COCc2ccc(=O)[nH]c2 34a_100011999846_100000211840 [1,1,0,0,0,0|2,0,0]=4 890 B18R2.269 Cc1cncc(c1)CNCc2ccc(=O)[nH]n2 207a_100000692839_100011361533 [1,1,0,0,0,0|2,0,0]=4 891 B18R2.269 Cc1cncc(c1)CNCc2ccc(=O)[nH]n2 270004a_100000692839_100011361533 [1,1,0,0,0,0|2,0,0]=4 892 B18R2.269 O=c1ccc(c[nH]1)COCc2cccc(c2)Br 34a_100011999846_100000698116 [1,1,0,0,0,0|2,0,0]=4 893 B18R2.269 O=c1ccc(c[nH]1)COCc2cccc(c2)Cl 34a_100011999846_100000187163 [1,1,0,0,0,0|2,0,0]=4 894 B18R2.269 O=c1ccc(c[nH]1)COCc2cccc(c2)F 34a_100011999846_100000187166 [1,1,0,0,0,0|2,0,0]=4 895 B18R2.269 O=c1ccc(c[nH]1)COCc2cccc(c2)I 34a_100011999846_100011218688 [1,1,0,0,0,0|2,0,0]=4 896 B18R2.269 O=c1ccc(c[nH]1)COCc2cccc(c2)O 34a_100011999846_100011660834 [1,1,0,0,0,0|2,0,0]=4 897 B18R2.269 O=c1ccc(c[nH]1)OCCc2cccc(c2)Br 34a_100000075641_100011740638 [1,1,0,0,0,0|2,0,0]=4 898 B18R2.269 O=c1ccc(c[nH]1)OCCc2cccc(c2)Cl 34a_100000075641_100011713710 [1,1,0,0,0,0|2,0,0]=4 899 B18R2.269 O=c1ccc(c[nH]1)OCCc2cccc(c2)F 34a_100000075641_100011217235 [1,1,0,0,0,0|2,0,0]=4 900 B18R2.269 O=c1ccc(c[nH]1)SCCc2cccc(c2)Br 62a_100000212171_100011740638 [1,1,0,0,0,0|2,0,0]=4 901 B18R2.269 O=c1ccc(c[nH]1)SCCc2cccc(c2)Br 62a_100011740638_100000212171 [1,1,0,0,0,0|2,0,0]=4 902 B18R2.269 O=c1ccc(c[nH]1)SCCc2cccc(c2)Cl 62a_100000212171_100011713710 [1,1,0,0,0,0|2,0,0]=4 903 B18R2.269 O=c1ccc(c[nH]1)SCCc2cccc(c2)Cl 62a_100011713710_100000212171 [1,1,0,0,0,0|2,0,0]=4 904 B18R2.269 O=c1ccc(c[nH]1)SCCc2cccc(c2)F 62a_100000212171_100011217235 [1,1,0,0,0,0|2,0,0]=4 905 B18R2.269 O=c1ccc(c[nH]1)SCCc2cccc(c2)F 62a_100011217235_100000212171 [1,1,0,0,0,0|2,0,0]=4 906 B18R2.269 O=c1ccc(n[nH]1)CNCc2cccc(c2)Br 207a_100000174977_100011361533 [1,1,0,0,0,0|1,0,0]=3 907 B18R2.269 O=c1ccc(n[nH]1)CNCc2cccc(c2)Br 270004a_100000174977_100011361533 [1,1,0,0,0,0|1,0,0]=3 908 B18R2.269 O=c1ccc(n[nH]1)CNCc2cccc(c2)Cl 207a_100000174878_100011361533 [1,1,0,0,0,0|1,0,0]=3 909 B18R2.269 O=c1ccc(n[nH]1)CNCc2cccc(c2)Cl 270004a_100000174878_100011361533 [1,1,0,0,0,0|1,0,0]=3 910 B18R2.269 O=c1ccc(n[nH]1)CNCc2cccc(c2)F 207a_100000174948_100011361533 [1,1,0,0,0,0|1,0,0]=3 911 B18R2.269 O=c1ccc(n[nH]1)CNCc2cccc(c2)F 270004a_100000174948_100011361533 [1,1,0,0,0,0|1,0,0]=3 912 B18R2.269 O=c1ccc(n[nH]1)CNCc2cccc(c2)I 207a_100000106179_100011361533 [1,1,0,0,0,0|1,0,0]=3 913 B18R2.269 O=c1ccc(n[nH]1)CNCc2cccc(c2)I 270004a_100000106179_100011361533 [1,1,0,0,0,0|1,0,0]=3 914 B18R2.269 O=c1ccc(n[nH]1)CNCc2cccc(c2)O 207a_100000743036_100011361533 [1,1,0,0,0,0|1,0,0]=3 915 B18R2.269 O=c1ccc(n[nH]1)CNCc2cccc(c2)O 270004a_100000743036_100011361533 [1,1,0,0,0,0|1,0,0]=3 916 B18R2.269 O=c1ccc(n[nH]1)CNCc2ccnc(c2)Br 270004a_100025757509_100011361533 [1,1,0,0,0,0|2,0,0]=4 917 B18R2.269 O=c1ccc(n[nH]1)CNCc2ccnc(c2)Cl 270004a_100015205668_100011361533 [1,1,0,0,0,0|2,0,0]=4 918 B18R2.269 O=c1ccc(n[nH]1)CNCc2ccnc(c2)F 270004a_100015188774_100011361533 [1,1,0,0,0,0|2,0,0]=4 919 B18R2.269 O=c1ccc(n[nH]1)CNCc2cncc(c2)Br 207a_100011249555_100011361533 [1,1,0,0,0,0|2,0,0]=4 920 B18R2.269 O=c1ccc(n[nH]1)CNCc2cncc(c2)Br 270004a_100011249555_100011361533 [1,1,0,0,0,0|2,0,0]=4 921 B18R2.269 O=c1ccc(n[nH]1)CNCc2cncc(c2)Cl 207a_200020614424_100011361533 [1,1,0,0,0,0|2,0,0]=4 922 B18R2.269 O=c1ccc(n[nH]1)CNCc2cncc(c2)Cl 270004a_200020614424_100011361533 [1,1,0,0,0,0|2,0,0]=4 923 B18R2.269 O=c1ccc(n[nH]1)CNCc2cncc(c2)F 207a_100011962886_100011361533 [1,1,0,0,0,0|2,0,0]=4 924 B18R2.269 O=c1ccc(n[nH]1)CNCc2cncc(c2)F 270004a_100011962886_100011361533 [1,1,0,0,0,0|2,0,0]=4 925 B18R2.269 O=c1ccc(n[nH]1)SCCc2cccc(c2)Br 62a_100009820020_100011740638 [1,1,0,0,0,0|1,0,0]=3 926 B18R2.269 O=c1ccc(n[nH]1)SCCc2cccc(c2)Br 62a_100011740638_100009820020 [1,1,0,0,0,0|1,0,0]=3 927 B18R2.269 O=c1ccc(n[nH]1)SCCc2cccc(c2)Cl 62a_100009820020_100011713710 [1,1,0,0,0,0|1,0,0]=3 928 B18R2.269 O=c1ccc(n[nH]1)SCCc2cccc(c2)Cl 62a_100011713710_100009820020 [1,1,0,0,0,0|1,0,0]=3 929 B18R2.269 O=c1ccc(n[nH]1)SCCc2cccc(c2)F 62a_100009820020_100011217235 [1,1,0,0,0,0|1,0,0]=3 930 B18R2.269 O=c1ccc(n[nH]1)SCCc2cccc(c2)F 62a_100011217235_100009820020 [1,1,0,0,0,0|1,0,0]=3 931 B18R2.274 Cc1ccc(cc1)CCOc2ccc(=O)[nH]c2 34a_100000075641_100011713686 [1,1,0,0,0,0|2,0,0]=4 932 B18R2.274 Cc1ccc(cc1)CCSc2ccc(=O)[nH]c2 62a_100000212171_100011713686 [1,1,0,0,0,0|2,0,0]=4 933 B18R2.274 Cc1ccc(cc1)CCSc2ccc(=O)[nH]c2 62a_100011713686_100000212171 [1,1,0,0,0,0|2,0,0]=4 934 B18R2.274 Cc1ccc(cc1)CCSc2ccc(=O)[nH]n2 62a_100009820020_100011713686 [1,1,0,0,0,0|1,0,0]=3 935 B18R2.274 Cc1ccc(cc1)CCSc2ccc(=O)[nH]n2 62a_100011713686_100009820020 [1,1,0,0,0,0|1,0,0]=3 936 B18R2.274 Cc1ccc(cc1)CNCc2ccc(=O)[nH]n2 207a_100000174908_100011361533 [1,1,0,0,0,0|1,0,0]=3 937 B18R2.274 Cc1ccc(cc1)CNCc2ccc(=O)[nH]n2 270004a_100000174908_100011361533 [1,1,0,0,0,0|1,0,0]=3 938 B18R2.274 Cc1ccc(cc1)COCc2ccc(=O)[nH]c2 34a_100011999846_100000210814 [1,1,0,0,0,0|2,0,0]=4 939 B18R2.274 Cc1ccc(cn1)CNCc2ccc(=O)[nH]n2 207a_100000740942_100011361533 [1,1,0,0,0,0|2,0,0]=4 940 B18R2.274 Cc1ccc(cn1)CNCc2ccc(=O)[nH]n2 270004a_100000740942_100011361533 [1,1,0,0,0,0|2,0,0]=4 941 B18R2.274 O=c1ccc(c[nH]1)COCc2ccc(cc2)Br 34a_100011999846_100000189115 [1,1,0,0,0,0|2,0,0]=4 942 B18R2.274 O=c1ccc(c[nH]1)COCc2ccc(cc2)Cl 34a_100011999846_100000694040 [1,1,0,0,0,0|2,0,0]=4 943 B18R2.274 O=c1ccc(c[nH]1)COCc2ccc(cc2)F 34a_100011999846_100000198546 [1,1,0,0,0,0|2,0,0]=4 944 B18R2.274 O=c1ccc(c[nH]1)COCc2ccc(cc2)I 34a_100011999846_100000189116 [1,1,0,0,0,0|2,0,0]=4 945 B18R2.274 O=c1ccc(c[nH]1)OCCc2ccc(cc2)Br 34a_100000075641_100011740612 [1,1,0,0,0,0|2,0,0]=4 946 B18R2.274 O=c1ccc(c[nH]1)OCCc2ccc(cc2)Cl 34a_100000075641_100011713675 [1,1,0,0,0,0|2,0,0]=4 947 B18R2.274 O=c1ccc(c[nH]1)OCCc2ccc(cc2)F 34a_100000075641_100011217392 [1,1,0,0,0,0|2,0,0]=4 948 B18R2.274 O=c1ccc(c[nH]1)SCCc2ccc(cc2)Br 62a_100000212171_100011740612 [1,1,0,0,0,0|2,0,0]=4 949 B18R2.274 O=c1ccc(c[nH]1)SCCc2ccc(cc2)Br 62a_100011740612_100000212171 [1,1,0,0,0,0|2,0,0]=4 950 B18R2.274 O=c1ccc(c[nH]1)SCCc2ccc(cc2)Cl 62a_100000212171_100011713675 [1,1,0,0,0,0|2,0,0]=4 951 B18R2.274 O=c1ccc(c[nH]1)SCCc2ccc(cc2)Cl 62a_100011713675_100000212171 [1,1,0,0,0,0|2,0,0]=4 952 B18R2.274 O=c1ccc(c[nH]1)SCCc2ccc(cc2)F 62a_100000212171_100011217392 [1,1,0,0,0,0|2,0,0]=4 953 B18R2.274 O=c1ccc(c[nH]1)SCCc2ccc(cc2)F 62a_100011217392_100000212171 [1,1,0,0,0,0|2,0,0]=4 954 B18R2.274 O=c1ccc(c[nH]1)SCCc2ccc(cc2)O 62a_100000212171_100009816426 [1,1,0,0,0,0|2,0,0]=4 955 B18R2.274 O=c1ccc(c[nH]1)SCCc2ccc(cc2)O 62a_100009816426_100000212171 [1,1,0,0,0,0|2,0,0]=4 956 B18R2.274 O=c1ccc(n[nH]1)CNCc2ccc(cc2)Br 207a_100000174875_100011361533 [1,1,0,0,0,0|1,0,0]=3 957 B18R2.274 O=c1ccc(n[nH]1)CNCc2ccc(cc2)Br 270004a_100000174875_100011361533 [1,1,0,0,0,0|1,0,0]=3 958 B18R2.274 O=c1ccc(n[nH]1)CNCc2ccc(cc2)Cl 207a_100000174871_100011361533 [1,1,0,0,0,0|1,0,0]=3 959 B18R2.274 O=c1ccc(n[nH]1)CNCc2ccc(cc2)Cl 270004a_100000174871_100011361533 [1,1,0,0,0,0|1,0,0]=3 960 B18R2.274 O=c1ccc(n[nH]1)CNCc2ccc(cc2)F 207a_100000174882_100011361533 [1,1,0,0,0,0|1,0,0]=3 961 B18R2.274 O=c1ccc(n[nH]1)CNCc2ccc(cc2)F 270004a_100000174882_100011361533 [1,1,0,0,0,0|1,0,0]=3 962 B18R2.274 O=c1ccc(n[nH]1)CNCc2ccc(cc2)I 207a_100016989417_100011361533 [1,1,0,0,0,0|1,0,0]=3 963 B18R2.274 O=c1ccc(n[nH]1)CNCc2ccc(cc2)I 270004a_100016989417_100011361533 [1,1,0,0,0,0|1,0,0]=3 964 B18R2.274 O=c1ccc(n[nH]1)CNCc2ccc(cn2)Cl 270004a_100000697193_100011361533 [1,1,0,0,0,0|2,0,0]=4 965 B18R2.274 O=c1ccc(n[nH]1)CNCc2ccc(nc2)Br 207a_100009817727_100011361533 [1,1,0,0,0,0|2,0,0]=4 966 B18R2.274 O=c1ccc(n[nH]1)CNCc2ccc(nc2)Br 270004a_100009817727_100011361533 [1,1,0,0,0,0|2,0,0]=4 967 B18R2.274 O=c1ccc(n[nH]1)CNCc2ccc(nc2)Cl 207a_100000735879_100011361533 [1,1,0,0,0,0|2,0,0]=4 968 B18R2.274 O=c1ccc(n[nH]1)CNCc2ccc(nc2)Cl 270004a_100000735879_100011361533 [1,1,0,0,0,0|2,0,0]=4 969 B18R2.274 O=c1ccc(n[nH]1)CNCc2ccc(nc2)F 270004a_100000101913_100011361533 [1,1,0,0,0,0|2,0,0]=4 970 B18R2.274 O=c1ccc(n[nH]1)SCCc2ccc(cc2)Br 62a_100009820020_100011740612 [1,1,0,0,0,0|1,0,0]=3 971 B18R2.274 O=c1ccc(n[nH]1)SCCc2ccc(cc2)Br 62a_100011740612_100009820020 [1,1,0,0,0,0|1,0,0]=3 972 B18R2.274 O=c1ccc(n[nH]1)SCCc2ccc(cc2)Cl 62a_100009820020_100011713675 [1,1,0,0,0,0|1,0,0]=3 973 B18R2.274 O=c1ccc(n[nH]1)SCCc2ccc(cc2)Cl 62a_100011713675_100009820020 [1,1,0,0,0,0|1,0,0]=3 974 B18R2.274 O=c1ccc(n[nH]1)SCCc2ccc(cc2)F 62a_100009820020_100011217392 [1,1,0,0,0,0|1,0,0]=3 975 B18R2.274 O=c1ccc(n[nH]1)SCCc2ccc(cc2)F 62a_100011217392_100009820020 [1,1,0,0,0,0|1,0,0]=3 976 B18R2.274 O=c1ccc(n[nH]1)SCCc2ccc(cc2)O 62a_100009816426_100009820020 [1,1,0,0,0,0|1,0,0]=3 977 B18R2.274 O=c1ccc(n[nH]1)SCCc2ccc(cc2)O 62a_100009820020_100009816426 [1,1,0,0,0,0|1,0,0]=3 978 B18R2.4060 Cc1cc(=O)[nH]nc1C=CCc2ccccc2 271570a_200016263579_100000081757 [1,1,0,0,0,0|0,0,2]=4 979 B18R2.4060 Cc1cc(=O)[nH]nc1SCCc2ccccc2 62a_100000765856_100000081757 [1,1,0,0,0,0|1,0,0]=3 980 B18R2.4060 Cc1cc(=O)[nH]nc1SCCc2ccccn2 62a_100015183660_100000081757 [1,1,0,0,0,0|2,0,0]=4 981 B18R2.4060 Cc1cc(=O)[nH]nc1SCCc2cccnc2 62a_200011713674_100000081757 [1,1,0,0,0,0|2,0,0]=4 982 B18R2.4060 Cc1cc(=O)[nH]nc1SCCc2ccncc2 62a_100000723409_100000081757 [1,1,0,0,0,0|2,0,0]=4 983 B18R2.4060 Cc1cc(=O)[nH]nc1SCSc2ccccc2 62a_100011218342_100000081757 [1,1,0,0,0,0|2,0,0]=4 984 B18R2.4060 Nc1[nH]c(=O)ccc1SCCc2ccccc2 62a_100009884077_100011218657 [1,1,0,0,0,0|2,0,0]=4 985 B18R2.4060 O=c1[nH]nc(c(=O)[nH]1)NCCc2ccccc2 27a_100000106460_100000181694 [1,1,0,0,0,0|2,0,0]=4 986 B18R2.4060 O=c1[nH]nc(c(=O)[nH]1)SCCc2ccccc2 62a_100000765856_100000181694 [1,1,0,0,0,0|2,0,0]=4 987 B18R2.4060 O=c1cc(c(c[nH]1)SCCc2ccccc2)F 62a_100000765856_100015631685 [1,1,0,0,0,0|2,0,0]=4 988 B18R2.4060 O=c1cc(c(c[nH]1)SCCc2ccccc2)F 62a_100015631685_100011218657 [1,1,0,0,0,0|2,0,0]=4 989 B18R2.9237 Cc1ccccc1CCOc2ccc(=O)[nH]c2 34a_100000075641_100011713688 [1,1,0,0,0,0|2,0,0]=4 990 B18R2.9237 Cc1ccccc1CCSc2ccc(=O)[nH]c2 62a_100000212171_100011713688 [1,1,0,0,0,0|2,0,0]=4 991 B18R2.9237 Cc1ccccc1CCSc2ccc(=O)[nH]c2 62a_100011713688_100000212171 [1,1,0,0,0,0|2,0,0]=4 992 B18R2.9237 Cc1ccccc1CCSc2ccc(=O)[nH]n2 62a_100009820020_100011713688 [1,1,0,0,0,0|1,0,0]=3 993 B18R2.9237 Cc1ccccc1CCSc2ccc(=O)[nH]n2 62a_100011713688_100009820020 [1,1,0,0,0,0|1,0,0]=3 994 B18R2.9237 Cc1ccccc1CNCc2ccc(=O)[nH]n2 207a_100000174972_100011361533 [1,1,0,0,0,0|1,0,0]=3 995 B18R2.9237 Cc1ccccc1CNCc2ccc(=O)[nH]n2 270004a_100000174972_100011361533 [1,1,0,0,0,0|1,0,0]=3 996 B18R2.9237 Cc1ccccc1COCc2ccc(=O)[nH]c2 34a_100011999846_100000211839 [1,1,0,0,0,0|2,0,0]=4 997 B18R2.9237 Cc1ccncc1CNCc2ccc(=O)[nH]n2 207a_100011997553_100011361533 [1,1,0,0,0,0|2,0,0]=4 998 B18R2.9237 Cc1ccncc1CNCc2ccc(=O)[nH]n2 270004a_100011997553_100011361533 [1,1,0,0,0,0|2,0,0]=4 999 B18R2.9237 Cc1cnccc1CNCc2ccc(=O)[nH]n2 207a_100000708811_100011361533 [1,1,0,0,0,0|2,0,0]=4 1000 B18R2.9237 Cc1cnccc1CNCc2ccc(=O)[nH]n2 270004a_100000708811_100011361533 [1,1,0,0,0,0|2,0,0]=4 1001 B18R2.9237 O=c1ccc(c[nH]1)COCc2ccccc2Br 34a_100011999846_100000184730 [1,1,0,0,0,0|2,0,0]=4 1002 B18R2.9237 O=c1ccc(c[nH]1)COCc2ccccc2Cl 34a_100011999846_100000187162 [1,1,0,0,0,0|2,0,0]=4 1003 B18R2.9237 O=c1ccc(c[nH]1)COCc2ccccc2F 34a_100011999846_100000211605 [1,1,0,0,0,0|2,0,0]=4 1004 B18R2.9237 O=c1ccc(c[nH]1)COCc2ccccc2I 34a_100011999846_100011215278 [1,1,0,0,0,0|2,0,0]=4 1005 B18R2.9237 O=c1ccc(c[nH]1)OCCc2ccccc2Br 34a_100000075641_100012161201 [1,1,0,0,0,0|2,0,0]=4 1006 B18R2.9237 O=c1ccc(c[nH]1)OCCc2ccccc2Cl 34a_100000075641_100011713703 [1,1,0,0,0,0|2,0,0]=4 1007 B18R2.9237 O=c1ccc(c[nH]1)OCCc2ccccc2F 34a_100000075641_100000720011 [1,1,0,0,0,0|2,0,0]=4 1008 B18R2.9237 O=c1ccc(c[nH]1)OCCc2ccccc2O 34a_100000075641_100000722297 [1,1,0,0,0,0|2,0,0]=4 1009 B18R2.9237 O=c1ccc(c[nH]1)SCCc2ccccc2Br 62a_100000212171_100012161201 [1,1,0,0,0,0|2,0,0]=4 1010 B18R2.9237 O=c1ccc(c[nH]1)SCCc2ccccc2Br 62a_100012161201_100000212171 [1,1,0,0,0,0|2,0,0]=4 1011 B18R2.9237 O=c1ccc(c[nH]1)SCCc2ccccc2Cl 62a_100000212171_100011713703 [1,1,0,0,0,0|2,0,0]=4 1012 B18R2.9237 O=c1ccc(c[nH]1)SCCc2ccccc2Cl 62a_100011713703_100000212171 [1,1,0,0,0,0|2,0,0]=4 1013 B18R2.9237 O=c1ccc(c[nH]1)SCCc2ccccc2F 62a_100000212171_100011713696 [1,1,0,0,0,0|2,0,0]=4 1014 B18R2.9237 O=c1ccc(c[nH]1)SCCc2ccccc2F 62a_100011713696_100000212171 [1,1,0,0,0,0|2,0,0]=4 1015 B18R2.9237 O=c1ccc(c[nH]1)SCCc2ccccc2O 62a_100000212171_100000722297 [1,1,0,0,0,0|2,0,0]=4 1016 B18R2.9237 O=c1ccc(c[nH]1)SCCc2ccccc2O 62a_100000722297_100000212171 [1,1,0,0,0,0|2,0,0]=4 1017 B18R2.9237 O=c1ccc(n[nH]1)CNCc2ccccc2Br 207a_100000689332_100011361533 [1,1,0,0,0,0|1,0,0]=3 1018 B18R2.9237 O=c1ccc(n[nH]1)CNCc2ccccc2Br 270004a_100000689332_100011361533 [1,1,0,0,0,0|1,0,0]=3 1019 B18R2.9237 O=c1ccc(n[nH]1)CNCc2ccccc2Cl 207a_100000174879_100011361533 [1,1,0,0,0,0|1,0,0]=3 1020 B18R2.9237 O=c1ccc(n[nH]1)CNCc2ccccc2Cl 270004a_100000174879_100011361533 [1,1,0,0,0,0|1,0,0]=3 1021 B18R2.9237 O=c1ccc(n[nH]1)CNCc2ccccc2F 207a_100000174869_100011361533 [1,1,0,0,0,0|1,0,0]=3 1022 B18R2.9237 O=c1ccc(n[nH]1)CNCc2ccccc2F 270004a_100000174869_100011361533 [1,1,0,0,0,0|1,0,0]=3 1023 B18R2.9237 O=c1ccc(n[nH]1)CNCc2ccccc2I 207a_100015347259_100011361533 [1,1,0,0,0,0|1,0,0]=3 1024 B18R2.9237 O=c1ccc(n[nH]1)CNCc2ccccc2I 270004a_100015347259_100011361533 [1,1,0,0,0,0|1,0,0]=3 1025 B18R2.9237 O=c1ccc(n[nH]1)CNCc2ccccc2O 207a_100000185550_100011361533 [1,1,0,0,0,0|1,0,0]=3 1026 B18R2.9237 O=c1ccc(n[nH]1)CNCc2ccccc2O 270004a_100000185550_100011361533 [1,1,0,0,0,0|1,0,0]=3 1027 B18R2.9237 O=c1ccc(n[nH]1)CNCc2cccnc2Br 270004a_100009818023_100011361533 [1,1,0,0,0,0|2,0,0]=4 1028 B18R2.9237 O=c1ccc(n[nH]1)CNCc2cccnc2Cl 207a_100015189234_100011361533 [1,1,0,0,0,0|2,0,0]=4 1029 B18R2.9237 O=c1ccc(n[nH]1)CNCc2cccnc2F 270004a_100000724633_100011361533 [1,1,0,0,0,0|2,0,0]=4 1030 B18R2.9237 O=c1ccc(n[nH]1)CNCc2ccncc2Br 207a_100020640021_100011361533 [1,1,0,0,0,0|2,0,0]=4 1031 B18R2.9237 O=c1ccc(n[nH]1)CNCc2ccncc2Br 270004a_100020640021_100011361533 [1,1,0,0,0,0|2,0,0]=4 1032 B18R2.9237 O=c1ccc(n[nH]1)CNCc2ccncc2F 207a_100011935246_100011361533 [1,1,0,0,0,0|2,0,0]=4 1033 B18R2.9237 O=c1ccc(n[nH]1)CNCc2ccncc2F 270004a_100011935246_100011361533 [1,1,0,0,0,0|2,0,0]=4 1034 B18R2.9237 O=c1ccc(n[nH]1)CNCc2ncccc2Br 270004a_100020591323_100011361533 [1,1,0,0,0,0|2,0,0]=4 1035 B18R2.9237 O=c1ccc(n[nH]1)CNCc2ncccc2Cl 270004a_100015189233_100011361533 [1,1,0,0,0,0|2,0,0]=4 1036 B18R2.9237 O=c1ccc(n[nH]1)CNCc2ncccc2F 270004a_100000690088_100011361533 [1,1,0,0,0,0|2,0,0]=4 1037 B18R2.9237 O=c1ccc(n[nH]1)SCCc2ccccc2Br 62a_100009820020_100012161201 [1,1,0,0,0,0|1,0,0]=3 1038 B18R2.9237 O=c1ccc(n[nH]1)SCCc2ccccc2Br 62a_100012161201_100009820020 [1,1,0,0,0,0|1,0,0]=3 1039 B18R2.9237 O=c1ccc(n[nH]1)SCCc2ccccc2Cl 62a_100009820020_100011713703 [1,1,0,0,0,0|1,0,0]=3 1040 B18R2.9237 O=c1ccc(n[nH]1)SCCc2ccccc2Cl 62a_100011713703_100009820020 [1,1,0,0,0,0|1,0,0]=3 1041 B18R2.9237 O=c1ccc(n[nH]1)SCCc2ccccc2F 62a_100009820020_100011713696 [1,1,0,0,0,0|1,0,0]=3 1042 B18R2.9237 O=c1ccc(n[nH]1)SCCc2ccccc2F 62a_100011713696_100009820020 [1,1,0,0,0,0|1,0,0]=3 1043 B18R2.9237 O=c1ccc(n[nH]1)SCCc2ccccc2O 62a_100000722297_100009820020 [1,1,0,0,0,0|1,0,0]=3 1044 B18R2.9237 O=c1ccc(n[nH]1)SCCc2ccccc2O 62a_100009820020_100000722297 [1,1,0,0,0,0|1,0,0]=3 1045 B18R2.1508 COc1ccnc(c1)CNCc2ccccc2 207a_100015324214_100000087537 [1,1,0,0,0,0|2,0,0]=4 1046 B18R2.1508 COc1ccnc(c1)CNCc2ccccc2 2230a_100015324214_100000752681 [1,1,0,0,0,0|2,0,0]=4 1047 B18R2.1508 COc1ccnc(c1)CNCc2ccccc2 270004a_100015324214_100000087537 [1,1,0,0,0,0|2,0,0]=4 1048 B18R2.1508 COc1ccnc(c1)CNCc2ccccc2 34a_100015324214_100000752681 [1,1,0,0,0,0|2,0,0]=4 1049 B18R2.1508 COc1ccnc(c1)COCc2ccccc2 34a_100000210790_100000752681 [1,1,0,0,0,0|2,0,0]=4 1050 B18R2.1508 COc1ccnc(c1)COCc2ccccc2 34a_100000749536_100015291786 [1,1,0,0,0,0|2,0,0]=4 1051 B18R2.1508 COc1ccnc(c1)COCc2ccccc2 7a_100000210790_100000752681 [1,1,0,0,0,0|2,0,0]=4 1052 B18R2.1508 COc1ccnc(c1)CSCc2ccccc2 62a_100000211182_100000752681 [1,1,0,0,0,0|2,0,0]=4 1053 B18R2.1508 COc1ccnc(c1)CSCc2ccccc2 62a_100000752681_100015291786 [1,1,0,0,0,0|2,0,0]=4 1054 B18R2.1508 COc1ccnc(c1)SCCc2ccccc2 62a_100000765856_100011216251 [1,1,0,0,0,0|2,0,0]=4 1055 B18R2.1508 COc1ccnc(c1)SCCc2ccccc2 62a_100009817693_100011218657 [1,1,0,0,0,0|2,0,0]=4 1056 B18R2.1508 COc1cnnc(c1)SCCc2ccccc2 62a_100000765856_100000087634 [1,1,0,0,0,0|1,0,1]=4 1057 B18R2.1508 OCc1ccnc(c1)SCCc2ccccc2 62a_100000765856_100009814636 [1,1,0,0,0,0|2,0,0]=4 1058 B18R2.1508 OCc1ccnc(c1)SCCc2ccccc2 62a_100009814636_100011218657 [1,1,0,0,0,0|2,0,0]=4 1059 B18R2.3922 Oc1ccnc(c1F)SCCc2ccccc2 62a_100000765856_100009876375 [1,1,0,0,0,0|2,0,0]=4 1060 B18R2.3922 Oc1ccnc(c1F)SCCc2ccccc2 62a_100009876375_100011218657 [1,1,0,0,0,0|2,0,0]=4 1061 B18R2.6467 CC(CSc1cc(ccn1)O)c2ccccc2 62a_100000756946_100000762945 [1,1,0,0,0,0|2,0,0]=4 1062 B18R2.6467 CC(CSc1cc(cnn1)O)c2ccccc2 62a_100000756946_200010734679 [1,1,0,0,0,0|1,0,1]=4 1063 B18R2.6467 Oc1ccnc(c1)SCC(O)c2ccccc2 62a_100000185958_100000762945 [1,1,0,0,0,0|2,0,0]=4 1064 B18R2.6467 Oc1ccnc(c1)SC[C@@H](O)c2ccccc2 62a_100011933945_100000762945 [1,1,0,0,0,0|2,0,0]=4 1065 B18R2.6467 Oc1cnnc(c1)SCC(O)c2ccccc2 62a_100000185958_200010734679 [1,1,0,0,0,0|1,0,1]=4 1066 B18R2.6467 Oc1cnnc(c1)SC[C@@H](O)c2ccccc2 62a_100011933945_200010734679 [1,1,0,0,0,0|1,0,1]=4 1067 B18R2.6478 CC(Cc1ccccc1)Sc2cc(ccn2)O 62a_200011218536_100000762945 [1,1,0,0,0,0|2,0,0]=4 1068 B18R2.6478 CC(Cc1ccccc1)Sc2cc(cnn2)O 62a_200011218536_200010734679 [1,1,0,0,0,0|1,0,1]=4 1069 B18R2.6482 Cc1cccc(c1)CCSc2cc(ccn2)O 62a_100011713685_100000762945 [1,1,0,0,0,0|2,0,0]=4 1070 B18R2.6482 Cc1cccc(c1)CCSc2cc(cnn2)O 62a_100011713685_200010734679 [1,1,0,0,0,0|1,0,1]=4 1071 B18R2.6482 Oc1ccnc(c1)SCCc2cccc(c2)Br 62a_100011740638_100000762945 [1,1,0,0,0,0|2,0,0]=4 1072 B18R2.6482 Oc1ccnc(c1)SCCc2cccc(c2)Cl 62a_100011713710_100000762945 [1,1,0,0,0,0|2,0,0]=4 1073 B18R2.6482 Oc1ccnc(c1)SCCc2cccc(c2)F 62a_100011217235_100000762945 [1,1,0,0,0,0|2,0,0]=4 1074 B18R2.6482 Oc1cnnc(c1)SCCc2cccc(c2)Br 62a_100011740638_200010734679 [1,1,0,0,0,0|1,0,1]=4 1075 B18R2.6482 Oc1cnnc(c1)SCCc2cccc(c2)Cl 62a_100011713710_200010734679 [1,1,0,0,0,0|1,0,1]=4 1076 B18R2.6482 Oc1cnnc(c1)SCCc2cccc(c2)F 62a_100011217235_200010734679 [1,1,0,0,0,0|1,0,1]=4 1077 B18R2.65882 Cc1ccccc1CCSc2cc(ccn2)O 62a_100011713688_100000762945 [1,1,0,0,0,0|2,0,0]=4 1078 B18R2.65882 Cc1ccccc1CCSc2cc(cnn2)O 62a_100011713688_200010734679 [1,1,0,0,0,0|1,0,1]=4 1079 B18R2.65882 Oc1ccnc(c1)SCCc2ccccc2Br 62a_100012161201_100000762945 [1,1,0,0,0,0|2,0,0]=4 1080 B18R2.65882 Oc1ccnc(c1)SCCc2ccccc2Cl 62a_100011713703_100000762945 [1,1,0,0,0,0|2,0,0]=4 1081 B18R2.65882 Oc1ccnc(c1)SCCc2ccccc2F 62a_100011713696_100000762945 [1,1,0,0,0,0|2,0,0]=4 1082 B18R2.65882 Oc1ccnc(c1)SCCc2ccccc2O 62a_100000722297_100000762945 [1,1,0,0,0,0|2,0,0]=4 1083 B18R2.65882 Oc1cnnc(c1)SCCc2ccccc2Br 62a_100012161201_200010734679 [1,1,0,0,0,0|1,0,1]=4 1084 B18R2.65882 Oc1cnnc(c1)SCCc2ccccc2Cl 62a_100011713703_200010734679 [1,1,0,0,0,0|1,0,1]=4 1085 B18R2.65882 Oc1cnnc(c1)SCCc2ccccc2F 62a_100011713696_200010734679 [1,1,0,0,0,0|1,0,1]=4 1086 B18R2.65882 Oc1cnnc(c1)SCCc2ccccc2O 62a_100000722297_200010734679 [1,1,0,0,0,0|1,0,1]=4 1087 B18R2.249 CC(Cc1c[nH]c(=O)c(c1)Br)c2ccccc2 271570a_100000062452_100010125443 [0,1,0,0,1,0|2,0,0]=4 1088 B18R2.249 CC(Cc1c[nH]c(=O)c(c1)F)c2ccccc2 271570a_100000062452_100000723523 [0,1,0,0,1,0|2,0,0]=4 1089 B18R2.249 CC(Cc1c[nH]c(=O)c(c1)O)c2ccccc2 271570a_100000062452_100009814561 [0,1,0,0,1,0|1,0,0]=3 1090 B18R2.249 CC(Cc1cc(c(=O)[nH]n1)N)c2ccccc2 271570a_100000062452_100000102183 [0,1,0,0,1,0|1,0,0]=3 1091 B18R2.249 CC(Cc1cc(c(cn1)F)O)c2ccccc2 271570a_100000062452_100009854642 [0,1,0,0,1,0|2,0,0]=4 1092 B18R2.249 CC(Sc1c[nH]c(=O)c(c1)O)c2ccccc2 62a_100000230085_100009814561 [0,1,0,0,1,0|2,0,0]=4 1093 B18R2.249 CC(Sc1cc(c(=O)[nH]n1)N)c2ccccc2 62a_100000230085_100000102183 [0,1,0,0,1,0|2,0,0]=4 1094 B18R2.249 Cc1cc(n[nH]c1=O)CC(C)c2ccccc2 271570a_100000062452_100012187101 [0,1,0,0,1,0|1,0,0]=3 1095 B18R2.249 Cc1cc(n[nH]c1=O)SC(C)c2ccccc2 62a_100000230085_100012187101 [0,1,0,0,1,0|2,0,0]=4 1096 B18R2.249 Cc1cnc(cc1O)CC(C)c2ccccc2 271570a_100000062452_100000704368 [0,1,0,0,1,0|2,0,0]=4 1097 B18R2.2686 COc1cc(c[nH]c1=O)SCc2ccccc2 62a_100000211182_100010125397 [0,1,0,0,1,0|2,0,0]=4 1098 B18R2.9259 Cc1cc(n[nH]c1=O)SCc2ccc(cc2)Br 62a_100000189115_100012187101 [0,1,0,0,1,0|2,0,0]=4 1099 B18R2.9259 Cc1cc(n[nH]c1=O)SCc2ccc(cc2)Cl 62a_100000187161_100012187101 [0,1,0,0,1,0|2,0,0]=4 1100 B18R2.9259 Cc1cc(n[nH]c1=O)SCc2ccc(cc2)F 62a_100000198546_100012187101 [0,1,0,0,1,0|2,0,0]=4 1101 B18R2.9259 Cc1cc(n[nH]c1=O)SCc2ccc(cc2)I 62a_100000189116_100012187101 [0,1,0,0,1,0|2,0,0]=4 1102 B18R2.9259 Cc1ccc(cc1)CSc2c[nH]c(=O)c(c2)O 62a_100000210814_100009814561 [0,1,0,0,1,0|2,0,0]=4 1103 B18R2.9259 Cc1ccc(cc1)CSc2cc(c(=O)[nH]n2)C 62a_100000210814_100012187101 [0,1,0,0,1,0|2,0,0]=4 1104 B18R2.9259 Cc1ccc(cc1)CSc2cc(c(=O)[nH]n2)N 62a_100000210814_100000102183 [0,1,0,0,1,0|2,0,0]=4 1105 B18R2.9259 Nc1cc(n[nH]c1=O)SCc2ccc(cc2)Br 62a_100000189115_100000102183 [0,1,0,0,1,0|2,0,0]=4 1106 B18R2.9259 Nc1cc(n[nH]c1=O)SCc2ccc(cc2)Cl 62a_100000187161_100000102183 [0,1,0,0,1,0|2,0,0]=4 1107 B18R2.9259 Nc1cc(n[nH]c1=O)SCc2ccc(cc2)F 62a_100000198546_100000102183 [0,1,0,0,1,0|2,0,0]=4 1108 B18R2.9259 Nc1cc(n[nH]c1=O)SCc2ccc(cc2)I 62a_100000189116_100000102183 [0,1,0,0,1,0|2,0,0]=4 1109 B18R2.9259 O=c1[nH]cc(cc1O)SCc2ccc(cc2)Br 62a_100000189115_100009814561 [0,1,0,0,1,0|2,0,0]=4 1110 B18R2.9259 O=c1[nH]cc(cc1O)SCc2ccc(cc2)Cl 62a_100000187161_100009814561 [0,1,0,0,1,0|2,0,0]=4 1111 B18R2.9259 O=c1[nH]cc(cc1O)SCc2ccc(cc2)F 62a_100000198546_100009814561 [0,1,0,0,1,0|2,0,0]=4 1112 B18R2.9259 O=c1[nH]cc(cc1O)SCc2ccc(cc2)I 62a_100000189116_100009814561 [0,1,0,0,1,0|2,0,0]=4 1113 B18R2.38706 Cc1cc(nn(c1=O)C)SCc2ccccc2 62a_100000211182_100010988966 [0,1,0,0,1,0|2,0,0]=4 1114 B18R2.38706 Cc1cc(nn(c1=O)C)SCc2ccccc2 62a_100010988966_100015291786 [0,1,0,0,1,0|2,0,0]=4 1115 B18R2.39765 Cc1cc(n[nH]c1=O)SCc2ccccc2Br 62a_100000184730_100012187101 [0,1,0,0,1,0|2,0,0]=4 1116 B18R2.39765 Cc1cc(n[nH]c1=O)SCc2ccccc2Cl 62a_100000187162_100012187101 [0,1,0,0,1,0|2,0,0]=4 1117 B18R2.39765 Cc1cc(n[nH]c1=O)SCc2ccccc2F 62a_100000211605_100012187101 [0,1,0,0,1,0|2,0,0]=4 1118 B18R2.39765 Cc1cc(n[nH]c1=O)SCc2ccccc2I 62a_100011216222_100012187101 [0,1,0,0,1,0|2,0,0]=4 1119 B18R2.39765 Cc1ccccc1CSc2c[nH]c(=O)c(c2)O 62a_100000211839_100009814561 [0,1,0,0,1,0|2,0,0]=4 1120 B18R2.39765 Cc1ccccc1CSc2cc(c(=O)[nH]n2)C 62a_100000211839_100012187101 [0,1,0,0,1,0|2,0,0]=4 1121 B18R2.39765 Cc1ccccc1CSc2cc(c(=O)[nH]n2)N 62a_100000211839_100000102183 [0,1,0,0,1,0|2,0,0]=4 1122 B18R2.39765 Nc1cc(n[nH]c1=O)SCc2ccccc2Br 62a_100000184730_100000102183 [0,1,0,0,1,0|2,0,0]=4 1123 B18R2.39765 Nc1cc(n[nH]c1=O)SCc2ccccc2Cl 62a_100000187162_100000102183 [0,1,0,0,1,0|2,0,0]=4 1124 B18R2.39765 Nc1cc(n[nH]c1=O)SCc2ccccc2F 62a_100000211605_100000102183 [0,1,0,0,1,0|2,0,0]=4 1125 B18R2.39765 Nc1cc(n[nH]c1=O)SCc2ccccc2I 62a_100011216222_100000102183 [0,1,0,0,1,0|2,0,0]=4 1126 B18R2.39765 O=c1[nH]cc(cc1O)SCc2ccccc2Br 62a_100000184730_100009814561 [0,1,0,0,1,0|2,0,0]=4 1127 B18R2.39765 O=c1[nH]cc(cc1O)SCc2ccccc2Cl 62a_100000187162_100009814561 [0,1,0,0,1,0|2,0,0]=4 1128 B18R2.39765 O=c1[nH]cc(cc1O)SCc2ccccc2F 62a_100000211605_100009814561 [0,1,0,0,1,0|2,0,0]=4 1129 B18R2.39765 O=c1[nH]cc(cc1O)SCc2ccccc2I 62a_100011216222_100009814561 [0,1,0,0,1,0|2,0,0]=4 1130 B18R2.65908 Cc1cc(n[nH]c1=O)SCc2cccc(c2)Br 62a_100000211773_100012187101 [0,1,0,0,1,0|2,0,0]=4 1131 B18R2.65908 Cc1cc(n[nH]c1=O)SCc2cccc(c2)Cl 62a_100000187163_100012187101 [0,1,0,0,1,0|2,0,0]=4 1132 B18R2.65908 Cc1cc(n[nH]c1=O)SCc2cccc(c2)F 62a_100000230114_100012187101 [0,1,0,0,1,0|2,0,0]=4 1133 B18R2.65908 Cc1cc(n[nH]c1=O)SCc2cccc(c2)I 62a_100011218688_100012187101 [0,1,0,0,1,0|2,0,0]=4 1134 B18R2.65908 Cc1cc(n[nH]c1=O)SCc2cccc(c2)O 62a_100011660834_100012187101 [0,1,0,0,1,0|2,0,0]=4 1135 B18R2.65908 Cc1cccc(c1)CSc2c[nH]c(=O)c(c2)O 62a_100000211840_100009814561 [0,1,0,0,1,0|2,0,0]=4 1136 B18R2.65908 Cc1cccc(c1)CSc2cc(c(=O)[nH]n2)C 62a_100000211840_100012187101 [0,1,0,0,1,0|2,0,0]=4 1137 B18R2.65908 Cc1cccc(c1)CSc2cc(c(=O)[nH]n2)N 62a_100000211840_100000102183 [0,1,0,0,1,0|2,0,0]=4 1138 B18R2.65908 Nc1cc(n[nH]c1=O)SCc2cccc(c2)Br 62a_100000211773_100000102183 [0,1,0,0,1,0|2,0,0]=4 1139 B18R2.65908 Nc1cc(n[nH]c1=O)SCc2cccc(c2)Cl 62a_100000187163_100000102183 [0,1,0,0,1,0|2,0,0]=4 1140 B18R2.65908 Nc1cc(n[nH]c1=O)SCc2cccc(c2)F 62a_100000230114_100000102183 [0,1,0,0,1,0|2,0,0]=4 1141 B18R2.65908 Nc1cc(n[nH]c1=O)SCc2cccc(c2)I 62a_100011218688_100000102183 [0,1,0,0,1,0|2,0,0]=4 1142 B18R2.65908 Nc1cc(n[nH]c1=O)SCc2cccc(c2)O 62a_100011660834_100000102183 [0,1,0,0,1,0|2,0,0]=4 1143 B18R2.65908 O=c1[nH]cc(cc1O)SCc2cccc(c2)Br 62a_100000211773_100009814561 [0,1,0,0,1,0|2,0,0]=4 1144 B18R2.65908 O=c1[nH]cc(cc1O)SCc2cccc(c2)Cl 62a_100000187163_100009814561 [0,1,0,0,1,0|2,0,0]=4 1145 B18R2.65908 O=c1[nH]cc(cc1O)SCc2cccc(c2)F 62a_100000230114_100009814561 [0,1,0,0,1,0|2,0,0]=4 1146 B18R2.65908 O=c1[nH]cc(cc1O)SCc2cccc(c2)I 62a_100011218688_100009814561 [0,1,0,0,1,0|2,0,0]=4 1147 B18R2.65908 O=c1[nH]cc(cc1O)SCc2cccc(c2)O 62a_100011660834_100009814561 [0,1,0,0,1,0|2,0,0]=4 1148 B20R2.2967 COc1cc(c[nH]c1=O)SCCCc2ccccc2 62a_100000211621_100010125397 [0,1,0,0,0,1|1,0,0]=3 1149 B20R2.2967 COc1cc(c[nH]c1=O)SCCOc2ccccc2 62a_100000184471_100010125397 [0,1,0,0,0,1|2,0,0]=4 1150 B20R2.2967 COc1cc(c[nH]c1=O)SCCSc2ccccc2 62a_100000246102_100010125397 [0,1,0,0,0,1|2,0,0]=4 1151 B20R2.2967 COc1cc(c[nH]c1=O)SCOCc2ccccc2 62a_100000763385_100010125397 [0,1,0,0,0,1|2,0,0]=4 1152 B20R2.2967 COc1cc(c[nH]c1=O)SCSCc2ccccc2 62a_200011217039_100010125397 [0,1,0,0,0,1|2,0,0]=4 1153 B20R2.2967 COc1cc(ncc1Br)COCCc2ccccc2 34a_100010999569_100000765856 [0,1,0,0,0,1|2,0,0]=4 1154 B20R2.2967 COc1cc(ncc1C)SCCCc2ccccc2 62a_100000211621_100010067687 [0,1,0,0,0,1|2,0,0]=4 1155 B20R2.2967 COc1cc(ncc1C)SCCCc2ccccc2 62a_100010067687_100000211621 [0,1,0,0,0,1|2,0,0]=4 1156 B20R2.2967 COc1cc(ncc1F)SCCCc2ccccc2 62a_100000211621_200010136270 [0,1,0,0,0,1|2,0,0]=4 1157 B20R2.2967 COc1cc(ncc1F)SCCCc2ccccc2 62a_200010136270_100000211621 [0,1,0,0,0,1|2,0,0]=4 1158 B20R2.2967 COc1cc(ncc1N)SCCCc2ccccc2 62a_100000211621_100009887741 [0,1,0,0,0,1|2,0,0]=4 1159 B20R2.2967 COc1cc(ncc1N)SCCCc2ccccc2 62a_100009887741_100000211621 [0,1,0,0,0,1|2,0,0]=4 1160 B20R2.2967 COc1cc(nnc1N)SCCCc2ccccc2 62a_100000211621_100000688033 [0,1,0,0,0,1|1,0,1]=4 1161 B20R2.2967 COc1cc(nnc1N)SCCCc2ccccc2 62a_100000688033_100000211621 [0,1,0,0,0,1|1,0,1]=4 1162 B20R2.2967 OCc1cc(ncc1F)SCCCc2ccccc2 62a_100000081974_100000211621 [0,1,0,0,0,1|2,0,0]=4 1163 B20R2.2967 OCc1cc(ncc1F)SCCCc2ccccc2 62a_100000211621_100000081974 [0,1,0,0,0,1|2,0,0]=4 1164 B20R2.15211 Cc1cc(n[nH]c1=O)SCC(=O)Cc2ccccc2 62a_100000233483_100012187101 [0,1,0,0,0,1|1,0,1]=4 1165 B20R2.15211 Cc1cc(n[nH]c1=O)SC[C@@H](O)Cc2ccccc2 62a_100000729385_100012187101 [0,1,0,0,0,1|1,0,0]=3 1166 B20R2.15211 Cc1cnc(cc1O)SC[C@@H](O)Cc2ccccc2 62a_100000704368_100000729385 [0,1,0,0,0,1|2,0,0]=4 1167 B20R2.15211 Cc1cnc(cc1O)SC[C@@H](O)Cc2ccccc2 62a_100000729385_100000704368 [0,1,0,0,0,1|2,0,0]=4 1168 B20R2.15211 Nc1cc(n[nH]c1=O)SCC(=O)Cc2ccccc2 62a_100000233483_100000102183 [0,1,0,0,0,1|1,0,1]=4 1169 B20R2.15211 Nc1cc(n[nH]c1=O)SC[C@@H](O)Cc2ccccc2 62a_100000729385_100000102183 [0,1,0,0,0,1|1,0,0]=3 1170 B20R2.15211 O=C(CSc1c[nH]c(=O)c(c1)O)Cc2ccccc2 62a_100000233483_100009814561 [0,1,0,0,0,1|1,0,1]=4 1171 B20R2.15211 O=c1[nH]cc(cc1Br)SC[C@@H](O)Cc2ccccc2 62a_100000729385_100010125443 [0,1,0,0,0,1|2,0,0]=4 1172 B20R2.15211 O=c1[nH]cc(cc1Br)SC[C@@H](O)Cc2ccccc2 62a_100010125443_100000729385 [0,1,0,0,0,1|2,0,0]=4 1173 B20R2.15211 O=c1[nH]cc(cc1F)SC[C@@H](O)Cc2ccccc2 62a_100000723523_100000729385 [0,1,0,0,0,1|2,0,0]=4 1174 B20R2.15211 O=c1[nH]cc(cc1F)SC[C@@H](O)Cc2ccccc2 62a_100000729385_100000723523 [0,1,0,0,0,1|2,0,0]=4 1175 B20R2.15211 O=c1[nH]cc(cc1O)SC[C@@H](O)Cc2ccccc2 62a_100000729385_100009814561 [0,1,0,0,0,1|1,0,0]=3 1176 B20R2.15211 Oc1cc(ncc1F)SC[C@@H](O)Cc2ccccc2 62a_100000729385_100009854642 [0,1,0,0,0,1|2,0,0]=4 1177 B20R2.15211 Oc1cc(ncc1F)SC[C@@H](O)Cc2ccccc2 62a_100009854642_100000729385 [0,1,0,0,0,1|2,0,0]=4 1178 B20R2.15507 CC(CNCc1c[nH]c(=O)c(c1)Cl)c2ccccc2 207a_100000701038_100000051075 [0,1,0,0,0,1|2,0,0]=4 1179 B20R2.15507 CC(CNCc1c[nH]c(=O)c(c1)Cl)c2ccccc2 270004a_100000701038_100000051075 [0,1,0,0,0,1|2,0,0]=4 1180 B20R2.15507 Cc1cc(n[nH]c1=O)SCCC(=O)c2ccccc2 62a_100000750707_100012187101 [0,1,0,0,0,1|1,0,1]=4 1181 B20R2.15507 Cc1cc(n[nH]c1=O)SCC[C@@H](O)c2ccccc2 62a_100000729684_100012187101 [0,1,0,0,0,1|1,0,0]=3 1182 B20R2.15507 Cc1cnc(cc1O)SCC[C@@H](O)c2ccccc2 62a_100000704368_100000729684 [0,1,0,0,0,1|2,0,0]=4 1183 B20R2.15507 Cc1cnc(cc1O)SCC[C@@H](O)c2ccccc2 62a_100000729684_100000704368 [0,1,0,0,0,1|2,0,0]=4 1184 B20R2.15507 Nc1cc(n[nH]c1=O)SCCC(=O)c2ccccc2 62a_100000750707_100000102183 [0,1,0,0,0,1|1,0,1]=4 1185 B20R2.15507 Nc1cc(n[nH]c1=O)SCC[C@@H](O)c2ccccc2 62a_100000729684_100000102183 [0,1,0,0,0,1|1,0,0]=3 1186 B20R2.15507 O=C(CCSc1c[nH]c(=O)c(c1)O)c2ccccc2 62a_100000750707_100009814561 [0,1,0,0,0,1|1,0,1]=4 1187 B20R2.15507 O=c1[nH]cc(cc1Br)SCC[C@@H](O)c2ccccc2 62a_100000729684_100010125443 [0,1,0,0,0,1|2,0,0]=4 1188 B20R2.15507 O=c1[nH]cc(cc1Br)SCC[C@@H](O)c2ccccc2 62a_100010125443_100000729684 [0,1,0,0,0,1|2,0,0]=4 1189 B20R2.15507 O=c1[nH]cc(cc1Cl)CNCC(O)c2ccccc2 207a_100000210709_100000051075 [0,1,0,0,0,1|2,0,0]=4 1190 B20R2.15507 O=c1[nH]cc(cc1Cl)CNCC(O)c2ccccc2 270004a_100000210709_100000051075 [0,1,0,0,0,1|2,0,0]=4 1191 B20R2.15507 O=c1[nH]cc(cc1F)SCC[C@@H](O)c2ccccc2 62a_100000723523_100000729684 [0,1,0,0,0,1|2,0,0]=4 1192 B20R2.15507 O=c1[nH]cc(cc1F)SCC[C@@H](O)c2ccccc2 62a_100000729684_100000723523 [0,1,0,0,0,1|2,0,0]=4 1193 B20R2.15507 O=c1[nH]cc(cc1O)SCC[C@@H](O)c2ccccc2 62a_100000729684_100009814561 [0,1,0,0,0,1|1,0,0]=3 1194 B20R2.15507 Oc1cc(ncc1F)SCC[C@@H](O)c2ccccc2 62a_100000729684_100009854642 [0,1,0,0,0,1|2,0,0]=4 1195 B20R2.15507 Oc1cc(ncc1F)SCC[C@@H](O)c2ccccc2 62a_100009854642_100000729684 [0,1,0,0,0,1|2,0,0]=4 1196 B20R2.15517 CN(CCc1ccccc1)Cc2c[nH]c(=O)c(c2)Cl 270004a_100000207497_100000051075 [0,1,0,0,0,1|2,0,0]=4 1197 B20R2.41159 COc1cnc(cc1O)SCCCc2ccccc2 62a_100000211621_100010264082 [0,1,0,0,0,1|1,0,1]=4 1198 B20R2.41159 Cc1cc(ncc1C=O)SCCCc2ccccc2 62a_100000085382_100000211621 [0,1,0,0,0,1|2,0,0]=4 1199 B20R2.41159 Cc1cc(ncc1C=O)SCCCc2ccccc2 62a_100000211621_100000085382 [0,1,0,0,0,1|2,0,0]=4 1200 B20R2.41159 Nc1cc(ncc1C=O)SCCCc2ccccc2 62a_100000050503_100000211621 [0,1,0,0,0,1|2,0,0]=4 1201 B20R2.41159 Nc1cc(ncc1C=O)SCCCc2ccccc2 62a_100000211621_100000050503 [0,1,0,0,0,1|2,0,0]=4 1202 B20R2.41159 O=Cc1ccc(cc1O)SCCCc2ccccc2 62a_100000211621_100011277552 [0,1,0,0,0,1|2,0,0]=4 1203 B20R2.41159 O=Cc1ccc(cc1O)SCCCc2ccccc2 62a_100011277552_100000211621 [0,1,0,0,0,1|2,0,0]=4 1204 B20R2.71918 Cc1cc(n[nH]c1=O)SCCCc2cccc(c2)Br 62a_100011713683_100012187101 [0,1,0,0,0,1|1,0,0]=3 1205 B20R2.71918 Cc1cc(n[nH]c1=O)SCCCc2cccc(c2)F 62a_200000698031_100012187101 [0,1,0,0,0,1|1,0,0]=3 1206 B20R2.71918 Cc1cc(n[nH]c1=O)SCCOc2cccc(c2)Br 62a_100000183150_100012187101 [0,1,0,0,0,1|2,0,0]=4 1207 B20R2.71918 Cc1cc(n[nH]c1=O)SCCOc2cccc(c2)Cl 62a_100000181161_100012187101 [0,1,0,0,0,1|2,0,0]=4 1208 B20R2.71918 Cc1cc(n[nH]c1=O)SCCOc2cccc(c2)F 62a_100000739188_100012187101 [0,1,0,0,0,1|2,0,0]=4 1209 B20R2.71918 Cc1cccc(c1)CCNCc2c[nH]c(=O)c(c2)Cl 207a_100000749837_100000051075 [0,1,0,0,0,1|2,0,0]=4 1210 B20R2.71918 Cc1cccc(c1)CCNCc2c[nH]c(=O)c(c2)Cl 270004a_100000749837_100000051075 [0,1,0,0,0,1|2,0,0]=4 1211 B20R2.71918 Cc1cnc(cc1O)SCCCc2cccc(c2)Br 62a_100000704368_100011713683 [0,1,0,0,0,1|2,0,0]=4 1212 B20R2.71918 Cc1cnc(cc1O)SCCCc2cccc(c2)Br 62a_100011713683_100000704368 [0,1,0,0,0,1|2,0,0]=4 1213 B20R2.71918 Cc1cnc(cc1O)SCCCc2cccc(c2)F 62a_100000704368_200000698031 [0,1,0,0,0,1|2,0,0]=4 1214 B20R2.71918 Cc1cnc(cc1O)SCCCc2cccc(c2)F 62a_200000698031_100000704368 [0,1,0,0,0,1|2,0,0]=4 1215 B20R2.71918 Nc1cc(n[nH]c1=O)SCCCc2cccc(c2)Br 62a_100011713683_100000102183 [0,1,0,0,0,1|1,0,0]=3 1216 B20R2.71918 Nc1cc(n[nH]c1=O)SCCCc2cccc(c2)F 62a_200000698031_100000102183 [0,1,0,0,0,1|1,0,0]=3 1217 B20R2.71918 Nc1cc(n[nH]c1=O)SCCOc2cccc(c2)Br 62a_100000183150_100000102183 [0,1,0,0,0,1|2,0,0]=4 1218 B20R2.71918 Nc1cc(n[nH]c1=O)SCCOc2cccc(c2)Cl 62a_100000181161_100000102183 [0,1,0,0,0,1|2,0,0]=4 1219 B20R2.71918 Nc1cc(n[nH]c1=O)SCCOc2cccc(c2)F 62a_100000739188_100000102183 [0,1,0,0,0,1|2,0,0]=4 1220 B20R2.71918 O=c1[nH]cc(cc1Br)SCCCc2cccc(c2)Br 62a_100010125443_100011713683 [0,1,0,0,0,1|2,0,0]=4 1221 B20R2.71918 O=c1[nH]cc(cc1Br)SCCCc2cccc(c2)Br 62a_100011713683_100010125443 [0,1,0,0,0,1|2,0,0]=4 1222 B20R2.71918 O=c1[nH]cc(cc1Br)SCCCc2cccc(c2)F 62a_100010125443_200000698031 [0,1,0,0,0,1|2,0,0]=4 1223 B20R2.71918 O=c1[nH]cc(cc1Br)SCCCc2cccc(c2)F 62a_200000698031_100010125443 [0,1,0,0,0,1|2,0,0]=4 1224 B20R2.71918 O=c1[nH]cc(cc1Cl)CNCCc2cccc(c2)Br 207a_100011207229_100000051075 [0,1,0,0,0,1|2,0,0]=4 1225 B20R2.71918 O=c1[nH]cc(cc1Cl)CNCCc2cccc(c2)Br 270004a_100011207229_100000051075 [0,1,0,0,0,1|2,0,0]=4 1226 B20R2.71918 O=c1[nH]cc(cc1Cl)CNCCc2cccc(c2)Cl 207a_100000185263_100000051075 [0,1,0,0,0,1|2,0,0]=4 1227 B20R2.71918 O=c1[nH]cc(cc1Cl)CNCCc2cccc(c2)Cl 270004a_100000185263_100000051075 [0,1,0,0,0,1|2,0,0]=4 1228 B20R2.71918 O=c1[nH]cc(cc1Cl)CNCCc2cccc(c2)F 207a_100000205154_100000051075 [0,1,0,0,0,1|2,0,0]=4 1229 B20R2.71918 O=c1[nH]cc(cc1Cl)CNCCc2cccc(c2)F 270004a_100000205154_100000051075 [0,1,0,0,0,1|2,0,0]=4 1230 B20R2.71918 O=c1[nH]cc(cc1F)SCCCc2cccc(c2)Br 62a_100000723523_100011713683 [0,1,0,0,0,1|2,0,0]=4 1231 B20R2.71918 O=c1[nH]cc(cc1F)SCCCc2cccc(c2)Br 62a_100011713683_100000723523 [0,1,0,0,0,1|2,0,0]=4 1232 B20R2.71918 O=c1[nH]cc(cc1F)SCCCc2cccc(c2)F 62a_100000723523_200000698031 [0,1,0,0,0,1|2,0,0]=4 1233 B20R2.71918 O=c1[nH]cc(cc1F)SCCCc2cccc(c2)F 62a_200000698031_100000723523 [0,1,0,0,0,1|2,0,0]=4 1234 B20R2.71918 O=c1[nH]cc(cc1O)SCCCc2cccc(c2)Br 62a_100011713683_100009814561 [0,1,0,0,0,1|1,0,0]=3 1235 B20R2.71918 O=c1[nH]cc(cc1O)SCCCc2cccc(c2)F 62a_200000698031_100009814561 [0,1,0,0,0,1|1,0,0]=3 1236 B20R2.71918 O=c1[nH]cc(cc1O)SCCOc2cccc(c2)Br 62a_100000183150_100009814561 [0,1,0,0,0,1|2,0,0]=4 1237 B20R2.71918 O=c1[nH]cc(cc1O)SCCOc2cccc(c2)Cl 62a_100000181161_100009814561 [0,1,0,0,0,1|2,0,0]=4 1238 B20R2.71918 O=c1[nH]cc(cc1O)SCCOc2cccc(c2)F 62a_100000739188_100009814561 [0,1,0,0,0,1|2,0,0]=4 1239 B20R2.71918 Oc1cc(ncc1F)SCCCc2cccc(c2)Br 62a_100009854642_100011713683 [0,1,0,0,0,1|2,0,0]=4 1240 B20R2.71918 Oc1cc(ncc1F)SCCCc2cccc(c2)Br 62a_100011713683_100009854642 [0,1,0,0,0,1|2,0,0]=4 1241 B20R2.71918 Oc1cc(ncc1F)SCCCc2cccc(c2)F 62a_100009854642_200000698031 [0,1,0,0,0,1|2,0,0]=4 1242 B20R2.71918 Oc1cc(ncc1F)SCCCc2cccc(c2)F 62a_200000698031_100009854642 [0,1,0,0,0,1|2,0,0]=4 1243 B20R2.74858 Cc1cc(n[nH]c1=O)SCCCc2ccccc2Br 62a_200011713681_100012187101 [0,1,0,0,0,1|1,0,0]=3 1244 B20R2.74858 Cc1cc(n[nH]c1=O)SCCOc2ccccc2Br 62a_100000695877_100012187101 [0,1,0,0,0,1|2,0,0]=4 1245 B20R2.74858 Cc1cc(n[nH]c1=O)SCCOc2ccccc2F 62a_100000183290_100012187101 [0,1,0,0,0,1|2,0,0]=4 1246 B20R2.74858 Cc1ccccc1CCNCc2c[nH]c(=O)c(c2)Cl 207a_100000685071_100000051075 [0,1,0,0,0,1|2,0,0]=4 1247 B20R2.74858 Cc1ccccc1CCNCc2c[nH]c(=O)c(c2)Cl 270004a_100000685071_100000051075 [0,1,0,0,0,1|2,0,0]=4 1248 B20R2.74858 Cc1ccccc1OCCSc2c[nH]c(=O)c(c2)O 62a_100000184434_100009814561 [0,1,0,0,0,1|2,0,0]=4 1249 B20R2.74858 Cc1ccccc1OCCSc2cc(c(=O)[nH]n2)C 62a_100000184434_100012187101 [0,1,0,0,0,1|2,0,0]=4 1250 B20R2.74858 Cc1ccccc1OCCSc2cc(c(=O)[nH]n2)N 62a_100000184434_100000102183 [0,1,0,0,0,1|2,0,0]=4 1251 B20R2.74858 Cc1cnc(cc1O)SCCCc2ccccc2Br 62a_100000704368_200011713681 [0,1,0,0,0,1|2,0,0]=4 1252 B20R2.74858 Cc1cnc(cc1O)SCCCc2ccccc2Br 62a_200011713681_100000704368 [0,1,0,0,0,1|2,0,0]=4 1253 B20R2.74858 Nc1cc(n[nH]c1=O)SCCCc2ccccc2Br 62a_200011713681_100000102183 [0,1,0,0,0,1|1,0,0]=3 1254 B20R2.74858 Nc1cc(n[nH]c1=O)SCCOc2ccccc2Br 62a_100000695877_100000102183 [0,1,0,0,0,1|2,0,0]=4 1255 B20R2.74858 Nc1cc(n[nH]c1=O)SCCOc2ccccc2F 62a_100000183290_100000102183 [0,1,0,0,0,1|2,0,0]=4 1256 B20R2.74858 O=c1[nH]cc(cc1Br)SCCCc2ccccc2Br 62a_100010125443_200011713681 [0,1,0,0,0,1|2,0,0]=4 1257 B20R2.74858 O=c1[nH]cc(cc1Br)SCCCc2ccccc2Br 62a_200011713681_100010125443 [0,1,0,0,0,1|2,0,0]=4 1258 B20R2.74858 O=c1[nH]cc(cc1Cl)CNCCc2ccccc2Br 207a_100000747383_100000051075 [0,1,0,0,0,1|2,0,0]=4 1259 B20R2.74858 O=c1[nH]cc(cc1Cl)CNCCc2ccccc2Br 270004a_100000747383_100000051075 [0,1,0,0,0,1|2,0,0]=4 1260 B20R2.74858 O=c1[nH]cc(cc1Cl)CNCCc2ccccc2Cl 207a_100011207228_100000051075 [0,1,0,0,0,1|2,0,0]=4 1261 B20R2.74858 O=c1[nH]cc(cc1Cl)CNCCc2ccccc2Cl 270004a_100011207228_100000051075 [0,1,0,0,0,1|2,0,0]=4 1262 B20R2.74858 O=c1[nH]cc(cc1Cl)CNCCc2ccccc2F 207a_100000185272_100000051075 [0,1,0,0,0,1|2,0,0]=4 1263 B20R2.74858 O=c1[nH]cc(cc1Cl)CNCCc2ccccc2F 270004a_100000185272_100000051075 [0,1,0,0,0,1|2,0,0]=4 1264 B20R2.74858 O=c1[nH]cc(cc1Cl)CNCCc2ccccc2O 207a_100011207237_100000051075 [0,1,0,0,0,1|2,0,0]=4 1265 B20R2.74858 O=c1[nH]cc(cc1Cl)CNCCc2ccccc2O 270004a_100011207237_100000051075 [0,1,0,0,0,1|2,0,0]=4 1266 B20R2.74858 O=c1[nH]cc(cc1F)SCCCc2ccccc2Br 62a_100000723523_200011713681 [0,1,0,0,0,1|2,0,0]=4 1267 B20R2.74858 O=c1[nH]cc(cc1F)SCCCc2ccccc2Br 62a_200011713681_100000723523 [0,1,0,0,0,1|2,0,0]=4 1268 B20R2.74858 O=c1[nH]cc(cc1O)SCCCc2ccccc2Br 62a_200011713681_100009814561 [0,1,0,0,0,1|1,0,0]=3 1269 B20R2.74858 O=c1[nH]cc(cc1O)SCCOc2ccccc2Br 62a_100000695877_100009814561 [0,1,0,0,0,1|2,0,0]=4 1270 B20R2.74858 O=c1[nH]cc(cc1O)SCCOc2ccccc2F 62a_100000183290_100009814561 [0,1,0,0,0,1|2,0,0]=4 1271 B20R2.74858 Oc1cc(ncc1F)SCCCc2ccccc2Br 62a_100009854642_200011713681 [0,1,0,0,0,1|2,0,0]=4 1272 B20R2.74858 Oc1cc(ncc1F)SCCCc2ccccc2Br 62a_200011713681_100009854642 [0,1,0,0,0,1|2,0,0]=4 1273 B20R2.155548 Cc1[nH]c(=O)c(cc1SCCCc2ccccc2)N 62a_100000211621_100010126670 [0,1,0,0,0,1|2,0,0]=4 1274 B20R2.155548 Cc1[nH]c(=O)c(cc1SCCCc2ccccc2)N 62a_100010126670_100000211621 [0,1,0,0,0,1|2,0,0]=4 1275 B20R2.156103 Cc1c(c[nH]c(=O)c1N)SCCCc2ccccc2 62a_100000211621_100010163742 [0,1,0,0,0,1|2,0,0]=4 1276 B20R2.156103 Cc1c(c[nH]c(=O)c1N)SCCCc2ccccc2 62a_100010163742_100000211621 [0,1,0,0,0,1|2,0,0]=4 1277 B20R2.235928 Cc1cc(n[nH]c1=O)SCCCc2ccc(cc2)Br 62a_100011713682_100012187101 [0,1,0,0,0,1|1,0,0]=3 1278 B20R2.235928 Cc1cc(n[nH]c1=O)SCCCc2ccc(cc2)Cl 62a_100000759440_100012187101 [0,1,0,0,0,1|1,0,0]=3 1279 B20R2.235928 Cc1cc(n[nH]c1=O)SCCCc2ccc(cc2)F 62a_200011713563_100012187101 [0,1,0,0,0,1|1,0,0]=3 1280 B20R2.235928 Cc1cc(n[nH]c1=O)SCCOc2ccc(cc2)Br 62a_100000183278_100012187101 [0,1,0,0,0,1|2,0,0]=4 1281 B20R2.235928 Cc1cc(n[nH]c1=O)SCCOc2ccc(cc2)Cl 62a_100000184122_100012187101 [0,1,0,0,0,1|2,0,0]=4 1282 B20R2.235928 Cc1cc(n[nH]c1=O)SCCOc2ccc(cc2)F 62a_100000184936_100012187101 [0,1,0,0,0,1|2,0,0]=4 1283 B20R2.235928 Cc1ccc(cc1)CCNCc2c[nH]c(=O)c(c2)Cl 207a_100000705350_100000051075 [0,1,0,0,0,1|2,0,0]=4 1284 B20R2.235928 Cc1ccc(cc1)CCNCc2c[nH]c(=O)c(c2)Cl 270004a_100000705350_100000051075 [0,1,0,0,0,1|2,0,0]=4 1285 B20R2.235928 Cc1ccc(cc1)OCCSc2c[nH]c(=O)c(c2)O 62a_100000183172_100009814561 [0,1,0,0,0,1|2,0,0]=4 1286 B20R2.235928 Cc1ccc(cc1)OCCSc2cc(c(=O)[nH]n2)C 62a_100000183172_100012187101 [0,1,0,0,0,1|2,0,0]=4 1287 B20R2.235928 Cc1ccc(cc1)OCCSc2cc(c(=O)[nH]n2)N 62a_100000183172_100000102183 [0,1,0,0,0,1|2,0,0]=4 1288 B20R2.235928 Cc1cnc(cc1O)SCCCc2ccc(cc2)Br 62a_100000704368_100011713682 [0,1,0,0,0,1|2,0,0]=4 1289 B20R2.235928 Cc1cnc(cc1O)SCCCc2ccc(cc2)Br 62a_100011713682_100000704368 [0,1,0,0,0,1|2,0,0]=4 1290 B20R2.235928 Cc1cnc(cc1O)SCCCc2ccc(cc2)Cl 62a_100000704368_100000759440 [0,1,0,0,0,1|2,0,0]=4 1291 B20R2.235928 Cc1cnc(cc1O)SCCCc2ccc(cc2)Cl 62a_100000759440_100000704368 [0,1,0,0,0,1|2,0,0]=4 1292 B20R2.235928 Cc1cnc(cc1O)SCCCc2ccc(cc2)F 62a_100000704368_200011713563 [0,1,0,0,0,1|2,0,0]=4 1293 B20R2.235928 Cc1cnc(cc1O)SCCCc2ccc(cc2)F 62a_200011713563_100000704368 [0,1,0,0,0,1|2,0,0]=4 1294 B20R2.235928 Nc1cc(n[nH]c1=O)SCCCc2ccc(cc2)Br 62a_100011713682_100000102183 [0,1,0,0,0,1|1,0,0]=3 1295 B20R2.235928 Nc1cc(n[nH]c1=O)SCCCc2ccc(cc2)Cl 62a_100000759440_100000102183 [0,1,0,0,0,1|1,0,0]=3 1296 B20R2.235928 Nc1cc(n[nH]c1=O)SCCCc2ccc(cc2)F 62a_200011713563_100000102183 [0,1,0,0,0,1|1,0,0]=3 1297 B20R2.235928 Nc1cc(n[nH]c1=O)SCCOc2ccc(cc2)Br 62a_100000183278_100000102183 [0,1,0,0,0,1|2,0,0]=4 1298 B20R2.235928 Nc1cc(n[nH]c1=O)SCCOc2ccc(cc2)Cl 62a_100000184122_100000102183 [0,1,0,0,0,1|2,0,0]=4 1299 B20R2.235928 Nc1cc(n[nH]c1=O)SCCOc2ccc(cc2)F 62a_100000184936_100000102183 [0,1,0,0,0,1|2,0,0]=4 1300 B20R2.235928 O=c1[nH]cc(cc1Br)SCCCc2ccc(cc2)Br 62a_100010125443_100011713682 [0,1,0,0,0,1|2,0,0]=4 1301 B20R2.235928 O=c1[nH]cc(cc1Br)SCCCc2ccc(cc2)Br 62a_100011713682_100010125443 [0,1,0,0,0,1|2,0,0]=4 1302 B20R2.235928 O=c1[nH]cc(cc1Br)SCCCc2ccc(cc2)Cl 62a_100000759440_100010125443 [0,1,0,0,0,1|2,0,0]=4 1303 B20R2.235928 O=c1[nH]cc(cc1Br)SCCCc2ccc(cc2)Cl 62a_100010125443_100000759440 [0,1,0,0,0,1|2,0,0]=4 1304 B20R2.235928 O=c1[nH]cc(cc1Br)SCCCc2ccc(cc2)F 62a_100010125443_200011713563 [0,1,0,0,0,1|2,0,0]=4 1305 B20R2.235928 O=c1[nH]cc(cc1Br)SCCCc2ccc(cc2)F 62a_200011713563_100010125443 [0,1,0,0,0,1|2,0,0]=4 1306 B20R2.235928 O=c1[nH]cc(cc1Cl)CNCCc2ccc(cc2)Br 207a_100000755846_100000051075 [0,1,0,0,0,1|2,0,0]=4 1307 B20R2.235928 O=c1[nH]cc(cc1Cl)CNCCc2ccc(cc2)Br 270004a_100000755846_100000051075 [0,1,0,0,0,1|2,0,0]=4 1308 B20R2.235928 O=c1[nH]cc(cc1Cl)CNCCc2ccc(cc2)Cl 207a_100000185265_100000051075 [0,1,0,0,0,1|2,0,0]=4 1309 B20R2.235928 O=c1[nH]cc(cc1Cl)CNCCc2ccc(cc2)Cl 270004a_100000185265_100000051075 [0,1,0,0,0,1|2,0,0]=4 1310 B20R2.235928 O=c1[nH]cc(cc1Cl)CNCCc2ccc(cc2)F 207a_100000199005_100000051075 [0,1,0,0,0,1|2,0,0]=4 1311 B20R2.235928 O=c1[nH]cc(cc1Cl)CNCCc2ccc(cc2)F 270004a_100000199005_100000051075 [0,1,0,0,0,1|2,0,0]=4 1312 B20R2.235928 O=c1[nH]cc(cc1Cl)CNCCc2ccc(cc2)O 207a_100000743037_100000051075 [0,1,0,0,0,1|2,0,0]=4 1313 B20R2.235928 O=c1[nH]cc(cc1Cl)CNCCc2ccc(cc2)O 270004a_100000743037_100000051075 [0,1,0,0,0,1|2,0,0]=4 1314 B20R2.235928 O=c1[nH]cc(cc1F)SCCCc2ccc(cc2)Br 62a_100000723523_100011713682 [0,1,0,0,0,1|2,0,0]=4 1315 B20R2.235928 O=c1[nH]cc(cc1F)SCCCc2ccc(cc2)Br 62a_100011713682_100000723523 [0,1,0,0,0,1|2,0,0]=4 1316 B20R2.235928 O=c1[nH]cc(cc1F)SCCCc2ccc(cc2)Cl 62a_100000723523_100000759440 [0,1,0,0,0,1|2,0,0]=4 1317 B20R2.235928 O=c1[nH]cc(cc1F)SCCCc2ccc(cc2)Cl 62a_100000759440_100000723523 [0,1,0,0,0,1|2,0,0]=4 1318 B20R2.235928 O=c1[nH]cc(cc1F)SCCCc2ccc(cc2)F 62a_100000723523_200011713563 [0,1,0,0,0,1|2,0,0]=4 1319 B20R2.235928 O=c1[nH]cc(cc1F)SCCCc2ccc(cc2)F 62a_200011713563_100000723523 [0,1,0,0,0,1|2,0,0]=4 1320 B20R2.235928 O=c1[nH]cc(cc1O)SCCCc2ccc(cc2)Br 62a_100011713682_100009814561 [0,1,0,0,0,1|1,0,0]=3 1321 B20R2.235928 O=c1[nH]cc(cc1O)SCCCc2ccc(cc2)Cl 62a_100000759440_100009814561 [0,1,0,0,0,1|1,0,0]=3 1322 B20R2.235928 O=c1[nH]cc(cc1O)SCCCc2ccc(cc2)F 62a_200011713563_100009814561 [0,1,0,0,0,1|1,0,0]=3 1323 B20R2.235928 O=c1[nH]cc(cc1O)SCCOc2ccc(cc2)Br 62a_100000183278_100009814561 [0,1,0,0,0,1|2,0,0]=4 1324 B20R2.235928 O=c1[nH]cc(cc1O)SCCOc2ccc(cc2)Cl 62a_100000184122_100009814561 [0,1,0,0,0,1|2,0,0]=4 1325 B20R2.235928 O=c1[nH]cc(cc1O)SCCOc2ccc(cc2)F 62a_100000184936_100009814561 [0,1,0,0,0,1|2,0,0]=4 1326 B20R2.235928 Oc1cc(ncc1F)SCCCc2ccc(cc2)Br 62a_100009854642_100011713682 [0,1,0,0,0,1|2,0,0]=4 1327 B20R2.235928 Oc1cc(ncc1F)SCCCc2ccc(cc2)Br 62a_100011713682_100009854642 [0,1,0,0,0,1|2,0,0]=4 1328 B20R2.235928 Oc1cc(ncc1F)SCCCc2ccc(cc2)Cl 62a_100000759440_100009854642 [0,1,0,0,0,1|2,0,0]=4 1329 B20R2.235928 Oc1cc(ncc1F)SCCCc2ccc(cc2)Cl 62a_100009854642_100000759440 [0,1,0,0,0,1|2,0,0]=4 1330 B20R2.235928 Oc1cc(ncc1F)SCCCc2ccc(cc2)F 62a_100009854642_200011713563 [0,1,0,0,0,1|2,0,0]=4 1331 B20R2.235928 Oc1cc(ncc1F)SCCCc2ccc(cc2)F 62a_200011713563_100009854642 [0,1,0,0,0,1|2,0,0]=4 1332 B20R2.493325 Cc1cc(cn(c1=O)C)SCCCc2ccccc2 62a_100000211621_100011830242 [0,1,0,0,0,1|2,0,0]=4 1333 B20R2.493325 Cc1cc(cn(c1=O)C)SCCCc2ccccc2 62a_100011830242_100000211621 [0,1,0,0,0,1|2,0,0]=4 1334 B20R2.493325 Cc1cc(nn(c1=O)C)SCCCc2ccccc2 62a_100000211621_100010988966 [0,1,0,0,0,1|1,0,0]=3 1335 B20R2.493325 Cc1cc(nn(c1=O)C)SCCCc2ccccc2 62a_100010988966_100000211621 [0,1,0,0,0,1|1,0,0]=3 1336 B20R2.493325 Cc1cc(nn(c1=O)C)SCCOc2ccccc2 62a_100000184471_100010988966 [0,1,0,0,0,1|2,0,0]=4 1337 B20R2.493325 Cc1cc(nn(c1=O)C)SCCOc2ccccc2 62a_100010988966_100000184471 [0,1,0,0,0,1|2,0,0]=4 1338 B20R2.493325 Cc1cc(nn(c1=O)C)SCCSc2ccccc2 62a_100000246102_100010988966 [0,1,0,0,0,1|2,0,0]=4 1339 B20R2.493325 Cc1cc(nn(c1=O)C)SCCSc2ccccc2 62a_100010988966_100000246102 [0,1,0,0,0,1|2,0,0]=4 1340 B20R2.493325 Cc1cc(nn(c1=O)C)SCOCc2ccccc2 62a_100000763385_100010988966 [0,1,0,0,0,1|2,0,0]=4 1341 B20R2.493325 Cc1cc(nn(c1=O)C)SCOCc2ccccc2 62a_100010988966_100000763385 [0,1,0,0,0,1|2,0,0]=4 1342 B20R2.493325 Cc1cc(nn(c1=O)C)SCSCc2ccccc2 62a_100010988966_200011217039 [0,1,0,0,0,1|2,0,0]=4 1343 B20R2.493325 Cc1cc(nn(c1=O)C)SCSCc2ccccc2 62a_200011217039_100010988966 [0,1,0,0,0,1|2,0,0]=4 1344 B20R2.493325 Cn1cc(cc(c1=O)F)SCCCc2ccccc2 62a_100000211621_100010749421 [0,1,0,0,0,1|2,0,0]=4 1345 B20R2.493325 Cn1cc(cc(c1=O)F)SCCCc2ccccc2 62a_100010749421_100000211621 [0,1,0,0,0,1|2,0,0]=4 1346 B20R2.493325 Cn1cc(cc(c1=O)N)SCCCc2ccccc2 62a_100000211621_106446545582 [0,1,0,0,0,1|2,0,0]=4 1347 B20R2.493325 Cn1cc(cc(c1=O)N)SCCCc2ccccc2 62a_106446545582_100000211621 [0,1,0,0,0,1|2,0,0]=4 1348 B20R2.2960 COc1cc(c[nH]c1=O)SC(C)Cc2ccccc2 62a_200011218536_100010125397 [0,2,0,0,0,0|2,0,0]=4 1349 B20R2.94668 Cc1cc(nn(c1=O)C)SC(C)Cc2ccccc2 62a_100010988966_200011218536 [0,2,0,0,0,0|2,0,0]=4 1350 B20R2.94668 Cc1cc(nn(c1=O)C)SC(C)Cc2ccccc2 62a_200011218536_100010988966 [0,2,0,0,0,0|2,0,0]=4 1351 B20R2.196020 Cc1cc(n[nH]c1=O)SC(C#N)Cc2ccccc2 62a_100000183401_100012187101 [0,2,0,0,0,0|2,0,0]=4 1352 B20R2.196020 N#CC(Cc1ccccc1)Sc2c[nH]c(=O)c(c2)O 62a_100000183401_100009814561 [0,2,0,0,0,0|2,0,0]=4 1353 B20R2.196020 N#CC(Cc1ccccc1)Sc2cc(c(=O)[nH]n2)N 62a_100000183401_100000102183 [0,2,0,0,0,0|2,0,0]=4 1354 B20R2.2946 COc1cc(c[nH]c1=O)SCC(C)c2ccccc2 62a_100000756946_100010125397 [0,2,0,0,0,0|2,0,0]=4 1355 B20R2.2946 COc1cc(c[nH]c1=O)SCC(O)c2ccccc2 62a_100000185958_100010125397 [0,2,0,0,0,0|2,0,0]=4 1356 B20R2.2946 COc1cc(c[nH]c1=O)SC[C@@H](O)c2ccccc2 62a_100011933945_100010125397 [0,2,0,0,0,0|2,0,0]=4 1357 B20R2.2966 COc1cc(c[nH]c1=O)SCCc2cccc(c2)Br 62a_100011740638_100010125397 [0,2,0,0,0,0|2,0,0]=4 1358 B20R2.2966 COc1cc(c[nH]c1=O)SCCc2cccc(c2)C 62a_100011713685_100010125397 [0,2,0,0,0,0|2,0,0]=4 1359 B20R2.2966 COc1cc(c[nH]c1=O)SCCc2cccc(c2)Cl 62a_100011713710_100010125397 [0,2,0,0,0,0|2,0,0]=4 1360 B20R2.2966 COc1cc(c[nH]c1=O)SCCc2cccc(c2)F 62a_100011217235_100010125397 [0,2,0,0,0,0|2,0,0]=4 1361 B20R2.2978 COc1cc(c[nH]c1=O)SCCc2ccc(cc2)Br 62a_100011740612_100010125397 [0,2,0,0,0,0|2,0,0]=4 1362 B20R2.2978 COc1cc(c[nH]c1=O)SCCc2ccc(cc2)C 62a_100011713686_100010125397 [0,2,0,0,0,0|2,0,0]=4 1363 B20R2.2978 COc1cc(c[nH]c1=O)SCCc2ccc(cc2)Cl 62a_100011713675_100010125397 [0,2,0,0,0,0|2,0,0]=4 1364 B20R2.2978 COc1cc(c[nH]c1=O)SCCc2ccc(cc2)F 62a_100011217392_100010125397 [0,2,0,0,0,0|2,0,0]=4 1365 B20R2.2978 COc1cc(c[nH]c1=O)SCCc2ccc(cc2)O 62a_100009816426_100010125397 [0,2,0,0,0,0|2,0,0]=4 1366 B20R2.31004 COc1cc(c[nH]c1=O)SCCc2ccccc2Br 62a_100012161201_100010125397 [0,2,0,0,0,0|2,0,0]=4 1367 B20R2.31004 COc1cc(c[nH]c1=O)SCCc2ccccc2C 62a_100011713688_100010125397 [0,2,0,0,0,0|2,0,0]=4 1368 B20R2.31004 COc1cc(c[nH]c1=O)SCCc2ccccc2Cl 62a_100011713703_100010125397 [0,2,0,0,0,0|2,0,0]=4 1369 B20R2.31004 COc1cc(c[nH]c1=O)SCCc2ccccc2F 62a_100011713696_100010125397 [0,2,0,0,0,0|2,0,0]=4 1370 B20R2.31004 COc1cc(c[nH]c1=O)SCCc2ccccc2O 62a_100000722297_100010125397 [0,2,0,0,0,0|2,0,0]=4 1371 B20R2.284516 COc1cc(ncc1C=O)SCCc2ccccc2 62a_100000765856_100009846838 [0,2,0,0,0,0|2,0,0]=4 1372 B20R2.284516 COc1cc(ncc1C=O)SCCc2ccccc2 62a_100009846838_100011218657 [0,2,0,0,0,0|2,0,0]=4 1373 B20R2.15394 CC(C)(CSc1c[nH]c(=O)c(c1)O)c2ccccc2 62a_100000703224_100009814561 [0,2,0,0,0,0|2,0,0]=4 1374 B20R2.15394 CC(C)(CSc1cc(c(=O)[nH]n1)N)c2ccccc2 62a_100000703224_100000102183 [0,2,0,0,0,0|2,0,0]=4 1375 B20R2.15394 Cc1cc(n[nH]c1=O)SCC(C)(C)c2ccccc2 62a_100000703224_100012187101 [0,2,0,0,0,0|2,0,0]=4 1376 B20R2.15394 Cc1cc(n[nH]c1=O)SCC(F)(F)c2ccccc2 62a_100009875531_100012187101 [0,2,0,0,0,0|2,0,0]=4 1377 B20R2.15394 Nc1cc(n[nH]c1=O)SCC(F)(F)c2ccccc2 62a_100009875531_100000102183 [0,2,0,0,0,0|2,0,0]=4 1378 B20R2.15394 O=c1[nH]cc(cc1O)SCC(F)(F)c2ccccc2 62a_100009875531_100009814561 [0,2,0,0,0,0|2,0,0]=4 1379 B20R2.68287 Cc1cc(n[nH]c1=O)SCC(O)c2ccc(cc2)Cl 62a_200011996143_100012187101 [0,2,0,0,0,0|2,0,0]=4 1380 B20R2.68287 Cc1cc(n[nH]c1=O)SC[C@H](O)c2ccc(cc2)F 62a_100000720402_100012187101 [0,2,0,0,0,0|2,0,0]=4 1381 B20R2.68287 Nc1cc(n[nH]c1=O)SCC(O)c2ccc(cc2)Cl 62a_200011996143_100000102183 [0,2,0,0,0,0|2,0,0]=4 1382 B20R2.68287 Nc1cc(n[nH]c1=O)SC[C@H](O)c2ccc(cc2)F 62a_100000720402_100000102183 [0,2,0,0,0,0|2,0,0]=4 1383 B20R2.68287 O=c1[nH]cc(cc1O)SCC(O)c2ccc(cc2)Cl 62a_200011996143_100009814561 [0,2,0,0,0,0|2,0,0]=4 1384 B20R2.68287 O=c1[nH]cc(cc1O)SC[C@H](O)c2ccc(cc2)F 62a_100000720402_100009814561 [0,2,0,0,0,0|2,0,0]=4 1385 B20R2.493320 Cc1cc(nn(c1=O)C)SCC(C)c2ccccc2 62a_100000756946_100010988966 [0,2,0,0,0,0|2,0,0]=4 1386 B20R2.493320 Cc1cc(nn(c1=O)C)SCC(C)c2ccccc2 62a_100010988966_100000756946 [0,2,0,0,0,0|2,0,0]=4 1387 B20R2.493320 Cc1cc(nn(c1=O)C)SCC(O)c2ccccc2 62a_100000185958_100010988966 [0,2,0,0,0,0|2,0,0]=4 1388 B20R2.493320 Cc1cc(nn(c1=O)C)SCC(O)c2ccccc2 62a_100010988966_100000185958 [0,2,0,0,0,0|2,0,0]=4 1389 B20R2.493320 Cc1cc(nn(c1=O)C)SC[C@@H](O)c2ccccc2 62a_100010988966_100011933945 [0,2,0,0,0,0|2,0,0]=4 1390 B20R2.493320 Cc1cc(nn(c1=O)C)SC[C@@H](O)c2ccccc2 62a_100011933945_100010988966 [0,2,0,0,0,0|2,0,0]=4 1391 B20R2.5532 C=Cc1ccc(cc1)CCSc2c[nH]c(=O)c(c2)O 62a_100000142037_100009814561 [0,2,0,0,0,0|2,0,0]=4 1392 B20R2.5532 C=Cc1ccc(cc1)CCSc2cc(c(=O)[nH]n2)C 62a_100000142037_100012187101 [0,2,0,0,0,0|2,0,0]=4 1393 B20R2.5532 C=Cc1ccc(cc1)CCSc2cc(c(=O)[nH]n2)N 62a_100000142037_100000102183 [0,2,0,0,0,0|2,0,0]=4 1394 B20R2.5532 COc1ccc(cc1)CCSc2c[nH]c(=O)c(c2)O 62a_100011713689_100009814561 [0,2,0,0,0,0|2,0,0]=4 1395 B20R2.5532 COc1ccc(cc1)CCSc2cc(c(=O)[nH]n2)C 62a_100011713689_100012187101 [0,2,0,0,0,0|2,0,0]=4 1396 B20R2.5532 COc1ccc(cc1)CCSc2cc(c(=O)[nH]n2)N 62a_100011713689_100000102183 [0,2,0,0,0,0|2,0,0]=4 1397 B20R2.76143 Cc1cc(n[nH]c1=O)SCCc2ccc(cc2Br)Cl 62a_200012945151_100012187101 [0,2,0,0,0,0|2,0,0]=4 1398 B20R2.76143 Cc1cc(n[nH]c1=O)SCCc2ccc(cc2Cl)Cl 62a_200012161198_100012187101 [0,2,0,0,0,0|2,0,0]=4 1399 B20R2.76143 Nc1cc(n[nH]c1=O)SCCc2ccc(cc2Br)Cl 62a_200012945151_100000102183 [0,2,0,0,0,0|2,0,0]=4 1400 B20R2.76143 Nc1cc(n[nH]c1=O)SCCc2ccc(cc2Cl)Cl 62a_200012161198_100000102183 [0,2,0,0,0,0|2,0,0]=4 1401 B20R2.76143 O=c1[nH]cc(cc1O)SCCc2ccc(cc2Br)Cl 62a_200012945151_100009814561 [0,2,0,0,0,0|2,0,0]=4 1402 B20R2.76143 O=c1[nH]cc(cc1O)SCCc2ccc(cc2Cl)Cl 62a_200012161198_100009814561 [0,2,0,0,0,0|2,0,0]=4 1403 B20R2.235686 Cc1cc(n[nH]c1=O)SCCc2ccc(c(c2)Cl)Cl 62a_100011713676_100012187101 [0,2,0,0,0,0|2,0,0]=4 1404 B20R2.235686 Cc1cc(n[nH]c1=O)SCCc2ccc(c(c2)Cl)F 62a_100012361305_100012187101 [0,2,0,0,0,0|2,0,0]=4 1405 B20R2.235686 Cc1cc(n[nH]c1=O)SCCc2ccc(c(c2)F)F 62a_100000690553_100012187101 [0,2,0,0,0,0|2,0,0]=4 1406 B20R2.235686 Nc1cc(n[nH]c1=O)SCCc2ccc(c(c2)Cl)Cl 62a_100011713676_100000102183 [0,2,0,0,0,0|2,0,0]=4 1407 B20R2.235686 Nc1cc(n[nH]c1=O)SCCc2ccc(c(c2)Cl)F 62a_100012361305_100000102183 [0,2,0,0,0,0|2,0,0]=4 1408 B20R2.235686 Nc1cc(n[nH]c1=O)SCCc2ccc(c(c2)F)F 62a_100000690553_100000102183 [0,2,0,0,0,0|2,0,0]=4 1409 B20R2.235686 O=c1[nH]cc(cc1O)SCCc2ccc(c(c2)Cl)Cl 62a_100011713676_100009814561 [0,2,0,0,0,0|2,0,0]=4 1410 B20R2.235686 O=c1[nH]cc(cc1O)SCCc2ccc(c(c2)Cl)F 62a_100012361305_100009814561 [0,2,0,0,0,0|2,0,0]=4 1411 B20R2.235686 O=c1[nH]cc(cc1O)SCCc2ccc(c(c2)F)F 62a_100000690553_100009814561 [0,2,0,0,0,0|2,0,0]=4 1412 B20R2.1302962 Cc1cc(nn(c1=O)C)SCCc2ccc(cc2)Br 62a_100010988966_100011740612 [0,2,0,0,0,0|2,0,0]=4 1413 B20R2.1302962 Cc1cc(nn(c1=O)C)SCCc2ccc(cc2)Br 62a_100011740612_100010988966 [0,2,0,0,0,0|2,0,0]=4 1414 B20R2.1302962 Cc1cc(nn(c1=O)C)SCCc2ccc(cc2)Cl 62a_100010988966_100011713675 [0,2,0,0,0,0|2,0,0]=4 1415 B20R2.1302962 Cc1cc(nn(c1=O)C)SCCc2ccc(cc2)Cl 62a_100011713675_100010988966 [0,2,0,0,0,0|2,0,0]=4 1416 B20R2.1302962 Cc1cc(nn(c1=O)C)SCCc2ccc(cc2)F 62a_100010988966_100011217392 [0,2,0,0,0,0|2,0,0]=4 1417 B20R2.1302962 Cc1cc(nn(c1=O)C)SCCc2ccc(cc2)F 62a_100011217392_100010988966 [0,2,0,0,0,0|2,0,0]=4 1418 B20R2.1302962 Cc1cc(nn(c1=O)C)SCCc2ccc(cc2)O 62a_100009816426_100010988966 [0,2,0,0,0,0|2,0,0]=4 1419 B20R2.1302962 Cc1cc(nn(c1=O)C)SCCc2ccc(cc2)O 62a_100010988966_100009816426 [0,2,0,0,0,0|2,0,0]=4 1420 B20R2.1302962 Cc1ccc(cc1)CCSc2cc(c(=O)n(n2)C)C 62a_100010988966_100011713686 [0,2,0,0,0,0|2,0,0]=4 1421 B20R2.1302962 Cc1ccc(cc1)CCSc2cc(c(=O)n(n2)C)C 62a_100011713686_100010988966 [0,2,0,0,0,0|2,0,0]=4 1422 B20R2.42316 COc1ccccc1CCSc2c[nH]c(=O)c(c2)O 62a_100011713687_100009814561 [0,2,0,0,0,0|2,0,0]=4 1423 B20R2.42316 COc1ccccc1CCSc2cc(c(=O)[nH]n2)C 62a_100011713687_100012187101 [0,2,0,0,0,0|2,0,0]=4 1424 B20R2.42316 COc1ccccc1CCSc2cc(c(=O)[nH]n2)N 62a_100011713687_100000102183 [0,2,0,0,0,0|2,0,0]=4 1425 B20R2.42316 Cc1cc(n[nH]c1=O)SCCc2ccccc2C=O 62a_100010186698_100012187101 [0,2,0,0,0,0|2,0,0]=4 1426 B20R2.42316 Nc1cc(n[nH]c1=O)SCCc2ccccc2C=O 62a_100010186698_100000102183 [0,2,0,0,0,0|2,0,0]=4 1427 B20R2.42316 O=Cc1ccccc1CCSc2c[nH]c(=O)c(c2)O 62a_100010186698_100009814561 [0,2,0,0,0,0|2,0,0]=4 1428 B20R2.72303 Cc1cc(n[nH]c1=O)SCCc2cccc(c2Cl)Cl 62a_100000723033_100012187101 [0,2,0,0,0,0|2,0,0]=4 1429 B20R2.72303 Nc1cc(n[nH]c1=O)SCCc2cccc(c2Cl)Cl 62a_100000723033_100000102183 [0,2,0,0,0,0|2,0,0]=4 1430 B20R2.72303 O=c1[nH]cc(cc1O)SCCc2cccc(c2Cl)Cl 62a_100000723033_100009814561 [0,2,0,0,0,0|2,0,0]=4 1431 B20R2.153497 Cc1cc(n[nH]c1=O)SCCc2c(cccc2Cl)Cl 62a_100012161200_100012187101 [0,2,0,0,0,0|2,0,0]=4 1432 B20R2.153497 Nc1cc(n[nH]c1=O)SCCc2c(cccc2Cl)Cl 62a_100012161200_100000102183 [0,2,0,0,0,0|2,0,0]=4 1433 B20R2.153497 O=c1[nH]cc(cc1O)SCCc2c(cccc2Cl)Cl 62a_100012161200_100009814561 [0,2,0,0,0,0|2,0,0]=4 1434 B20R2.156458 Cc1cc(n[nH]c1=O)SCCc2cc(ccc2F)F 62a_100011755056_100012187101 [0,2,0,0,0,0|2,0,0]=4 1435 B20R2.156458 Nc1cc(n[nH]c1=O)SCCc2cc(ccc2F)F 62a_100011755056_100000102183 [0,2,0,0,0,0|2,0,0]=4 1436 B20R2.156458 O=c1[nH]cc(cc1O)SCCc2cc(ccc2F)F 62a_100011755056_100009814561 [0,2,0,0,0,0|2,0,0]=4 1437 B20R2.2890168 Cc1cc(nn(c1=O)C)SCCc2ccccc2Br 62a_100010988966_100012161201 [0,2,0,0,0,0|2,0,0]=4 1438 B20R2.2890168 Cc1cc(nn(c1=O)C)SCCc2ccccc2Br 62a_100012161201_100010988966 [0,2,0,0,0,0|2,0,0]=4 1439 B20R2.2890168 Cc1cc(nn(c1=O)C)SCCc2ccccc2Cl 62a_100010988966_100011713703 [0,2,0,0,0,0|2,0,0]=4 1440 B20R2.2890168 Cc1cc(nn(c1=O)C)SCCc2ccccc2Cl 62a_100011713703_100010988966 [0,2,0,0,0,0|2,0,0]=4 1441 B20R2.2890168 Cc1cc(nn(c1=O)C)SCCc2ccccc2F 62a_100010988966_100011713696 [0,2,0,0,0,0|2,0,0]=4 1442 B20R2.2890168 Cc1cc(nn(c1=O)C)SCCc2ccccc2F 62a_100011713696_100010988966 [0,2,0,0,0,0|2,0,0]=4 1443 B20R2.2890168 Cc1cc(nn(c1=O)C)SCCc2ccccc2O 62a_100000722297_100010988966 [0,2,0,0,0,0|2,0,0]=4 1444 B20R2.2890168 Cc1cc(nn(c1=O)C)SCCc2ccccc2O 62a_100010988966_100000722297 [0,2,0,0,0,0|2,0,0]=4 1445 B20R2.2890168 Cc1ccccc1CCSc2cc(c(=O)n(n2)C)C 62a_100010988966_100011713688 [0,2,0,0,0,0|2,0,0]=4 1446 B20R2.2890168 Cc1ccccc1CCSc2cc(c(=O)n(n2)C)C 62a_100011713688_100010988966 [0,2,0,0,0,0|2,0,0]=4 1447 B20R2.303028 COc1cccc(c1)CCSc2c[nH]c(=O)c(c2)O 62a_100011713679_100009814561 [0,2,0,0,0,0|2,0,0]=4 1448 B20R2.303028 COc1cccc(c1)CCSc2cc(c(=O)[nH]n2)C 62a_100011713679_100012187101 [0,2,0,0,0,0|2,0,0]=4 1449 B20R2.303028 COc1cccc(c1)CCSc2cc(c(=O)[nH]n2)N 62a_100011713679_100000102183 [0,2,0,0,0,0|2,0,0]=4 1450 B20R2.1296508 Cc1cc(n[nH]c1=O)SCCc2cc(cc(c2)Cl)Cl 62a_100000691793_100012187101 [0,2,0,0,0,0|2,0,0]=4 1451 B20R2.1296508 Cc1cc(n[nH]c1=O)SCCc2cc(cc(c2)F)F 62a_100011754442_100012187101 [0,2,0,0,0,0|2,0,0]=4 1452 B20R2.1296508 Nc1cc(n[nH]c1=O)SCCc2cc(cc(c2)Cl)Cl 62a_100000691793_100000102183 [0,2,0,0,0,0|2,0,0]=4 1453 B20R2.1296508 Nc1cc(n[nH]c1=O)SCCc2cc(cc(c2)F)F 62a_100011754442_100000102183 [0,2,0,0,0,0|2,0,0]=4 1454 B20R2.1296508 O=c1[nH]cc(cc1O)SCCc2cc(cc(c2)Cl)Cl 62a_100000691793_100009814561 [0,2,0,0,0,0|2,0,0]=4 1455 B20R2.1296508 O=c1[nH]cc(cc1O)SCCc2cc(cc(c2)F)F 62a_100011754442_100009814561 [0,2,0,0,0,0|2,0,0]=4 1456 B20R2.2693862 Cc1cc(nn(c1=O)C)SCCc2cccc(c2)Br 62a_100010988966_100011740638 [0,2,0,0,0,0|2,0,0]=4 1457 B20R2.2693862 Cc1cc(nn(c1=O)C)SCCc2cccc(c2)Br 62a_100011740638_100010988966 [0,2,0,0,0,0|2,0,0]=4 1458 B20R2.2693862 Cc1cc(nn(c1=O)C)SCCc2cccc(c2)Cl 62a_100010988966_100011713710 [0,2,0,0,0,0|2,0,0]=4 1459 B20R2.2693862 Cc1cc(nn(c1=O)C)SCCc2cccc(c2)Cl 62a_100011713710_100010988966 [0,2,0,0,0,0|2,0,0]=4 1460 B20R2.2693862 Cc1cc(nn(c1=O)C)SCCc2cccc(c2)F 62a_100010988966_100011217235 [0,2,0,0,0,0|2,0,0]=4 1461 B20R2.2693862 Cc1cc(nn(c1=O)C)SCCc2cccc(c2)F 62a_100011217235_100010988966 [0,2,0,0,0,0|2,0,0]=4 1462 B20R2.2693862 Cc1cccc(c1)CCSc2cc(c(=O)n(n2)C)C 62a_100010988966_100011713685 [0,2,0,0,0,0|2,0,0]=4 1463 B20R2.2693862 Cc1cccc(c1)CCSc2cc(c(=O)n(n2)C)C 62a_100011713685_100010988966 [0,2,0,0,0,0|2,0,0]=4 1464 B18R2.2417296 NC(=O)C(=O)NN=C1CCCc2c1cccc2 4a_100000211141_100000210882 [0,0,1,1,0,0|1,0,1]=4 1465 B18R3.8952 O=c1ccc(c[nH]1)SC2Cc3c2cccc3 62a_100000212171_100009813401 [1,0,0,1,0,0|2,0,0]=4 1466 B18R3.8952 O=c1ccc(c[nH]1)SC2Cc3c2cccc3 62a_100009813401_100000212171 [1,0,0,1,0,0|2,0,0]=4 1467 B18R3.8952 O=c1ccc(n[nH]1)SC2Cc3c2cccc3 62a_100009813401_100009820020 [1,0,0,1,0,0|1,0,0]=3 1468 B18R3.8952 O=c1ccc(n[nH]1)SC2Cc3c2cccc3 62a_100009820020_100009813401 [1,0,0,1,0,0|1,0,0]=3 1469 B18R3.3023 Oc1ccnc(c1)SC2Cc3c2cccc3 62a_100009813401_100000762945 [1,0,0,1,0,0|2,0,0]=4 1470 B18R3.3023 Oc1cnnc(c1)SC2Cc3c2cccc3 62a_100009813401_200010734679 [1,0,0,1,0,0|1,0,1]=4 1471 B20R3.615 Cc1cnc(cc1O)SC2CCc3c2cccc3 62a_100000704368_200000721974 [0,0,0,1,0,1|2,0,0]=4 1472 B20R3.615 O=c1[nH]cc(cc1Br)SC2CCc3c2cccc3 62a_100010125443_200000721974 [0,0,0,1,0,1|2,0,0]=4 1473 B20R3.615 O=c1[nH]cc(cc1F)SC2CCc3c2cccc3 62a_100000723523_200000721974 [0,0,0,1,0,1|2,0,0]=4 1474 B20R3.615 Oc1cc(ncc1F)SC2CCc3c2cccc3 62a_100009854642_200000721974 [0,0,0,1,0,1|2,0,0]=4 1475 B20R3.36147 COc1cc(c[nH]c1=O)SC2Cc3c2cccc3 62a_100009813401_100010125397 [0,1,0,1,0,0|2,0,0]=4 1476 B20R3.3128479 Cc1cc(nn(c1=O)C)SC2Cc3c2cccc3 62a_100009813401_100010988966 [0,1,0,1,0,0|2,0,0]=4 1477 B20R3.3128479 Cc1cc(nn(c1=O)C)SC2Cc3c2cccc3 62a_100010988966_100009813401 [0,1,0,1,0,0|2,0,0]=4 1478 B16R2.132 O=c1ccc(c[nH]1)OCc2ccccc2 34a_100000075641_100015291786 [1,0,0,0,1,0|2,0,0]=4 1479 B16R2.132 O=c1ccc(c[nH]1)SCc2ccccc2 62a_100000211182_100000212171 [1,0,0,0,1,0|2,0,0]=4 1480 B16R2.132 O=c1ccc(c[nH]1)SCc2ccccc2 62a_100000212171_100015291786 [1,0,0,0,1,0|2,0,0]=4 1481 B16R2.132 O=c1ccc(n[nH]1)C#Cc2ccccc2 271570a_100000069678_100009820020 [1,0,0,0,1,0|0,0,2]=4 1482 B16R2.132 O=c1ccc(n[nH]1)C=Cc2ccccc2 271570a_100102527694_100009820020 [1,0,0,0,1,0|0,0,2]=4 1483 B16R2.132 O=c1ccc(n[nH]1)CNc2ccccc2 207a_100000106764_100011361533 [1,0,0,0,1,0|1,0,0]=3 1484 B16R2.132 O=c1ccc(n[nH]1)SCc2ccccc2 62a_100000211182_100009820020 [1,0,0,0,1,0|1,0,0]=3 1485 B16R2.132 O=c1ccc(n[nH]1)SCc2ccccc2 62a_100009820020_100015291786 [1,0,0,0,1,0|1,0,0]=3 1486 B16R2.132 O=c1ccc(n[nH]1)SCc2ccccn2 62a_100000721315_100009820020 [1,0,0,0,1,0|2,0,0]=4 1487 B16R2.132 O=c1ccc(n[nH]1)SCc2ccccn2 62a_100009820020_100000721315 [1,0,0,0,1,0|2,0,0]=4 1488 B16R2.132 O=c1ccc(n[nH]1)SCc2cccnc2 62a_100000741622_100009820020 [1,0,0,0,1,0|2,0,0]=4 1489 B16R2.132 O=c1ccc(n[nH]1)SCc2cccnc2 62a_100009820020_100000741622 [1,0,0,0,1,0|2,0,0]=4 1490 B16R2.132 O=c1ccc(n[nH]1)SCc2ccncc2 62a_100009820020_100015193705 [1,0,0,0,1,0|2,0,0]=4 1491 B16R2.132 O=c1ccc(n[nH]1)SCc2ccncc2 62a_100015193705_100009820020 [1,0,0,0,1,0|2,0,0]=4 1492 B16R2.135 O=c1ccc(n[nH]1)CNCc2ccco2 207a_100000185738_100011361533 [1,0,0,0,1,0|2,0,0]=4 1493 B16R2.135 O=c1ccc(n[nH]1)CNCc2ccco2 270004a_100000185738_100011361533 [1,0,0,0,1,0|2,0,0]=4 1494 B16R2.135 O=c1ccc(n[nH]1)CNCc2cccs2 207a_100000211653_100011361533 [1,0,0,0,1,0|2,0,0]=4 1495 B16R2.135 O=c1ccc(n[nH]1)CNCc2cccs2 270004a_100000211653_100011361533 [1,0,0,0,1,0|2,0,0]=4 1496 B16R2.135 O=c1ccc(n[nH]1)CNCc2ccoc2 207a_100015206860_100011361533 [1,0,0,0,1,0|2,0,0]=4 1497 B16R2.135 O=c1ccc(n[nH]1)CNCc2ccoc2 270004a_100015206860_100011361533 [1,0,0,0,1,0|2,0,0]=4 1498 B16R2.135 O=c1ccc(n[nH]1)CNCc2ccsc2 207a_100000186416_100011361533 [1,0,0,0,1,0|2,0,0]=4 1499 B16R2.135 O=c1ccc(n[nH]1)CNCc2ccsc2 270004a_100000186416_100011361533 [1,0,0,0,1,0|2,0,0]=4 1500 B16R2.135 O=c1ccc(n[nH]1)SCCc2cccs2 62a_100000748579_100009820020 [1,0,0,0,1,0|2,0,0]=4 1501 B16R2.135 O=c1ccc(n[nH]1)SCCc2cccs2 62a_100009820020_100000748579 [1,0,0,0,1,0|2,0,0]=4 1502 B16R2.135 O=c1ccc(n[nH]1)SCCn2cccc2 62a_100009820020_200000035178 [1,0,0,0,1,0|2,0,0]=4 1503 B16R2.135 O=c1ccc(n[nH]1)SCCn2cccc2 62a_200009811947_100009820020 [1,0,0,0,1,0|2,0,0]=4 1504 B16R2.2832 Cc1cc(n[nH]1)SCCc2ccccc2 62a_100000765856_100009819999 [1,0,0,0,1,0|2,0,0]=4 1505 B16R2.2832 Cc1cc(n[nH]1)SCCc2ccccc2 62a_100009819999_100011218657 [1,0,0,0,1,0|2,0,0]=4 1506 B16R2.2832 Nc1cc(n[nH]1)SCCc2ccccc2 62a_100000765856_100009822546 [1,0,0,0,1,0|2,0,0]=4 1507 B16R2.2832 Nc1cc(n[nH]1)SCCc2ccccc2 62a_100009822546_100011218657 [1,0,0,0,1,0|2,0,0]=4 1508 B16R2.2832 O=c1[nH]nc([nH]1)CNCc2ccccc2 2230a_100000766346_100015291786 [1,0,0,0,1,0|2,0,0]=4 1509 B16R2.2832 O=c1[nH]nc([nH]1)CNCc2ccccc2 2230a_100015324214_100000754189 [1,0,0,0,1,0|2,0,0]=4 1510 B16R2.2832 O=c1[nH]nc([nH]1)COCc2ccccc2 7a_100000210790_100000754189 [1,0,0,0,1,0|2,0,0]=4 1511 B16R2.2832 O=c1[nH]nc([nH]1)CSCc2ccccc2 62a_100000211182_100000754189 [1,0,0,0,1,0|2,0,0]=4 1512 B16R2.252 Oc1ccnc(c1)OCc2ccccc2 271570a_203496583355_200010986176 [1,0,0,0,1,0|2,0,0]=4 1513 B16R2.252 Oc1ccnc(c1)SCc2ccccc2 271570a_203496583355_100042452854 [1,0,0,0,1,0|2,0,0]=4 1514 B16R2.252 Oc1ccnc(c1)SCc2ccccc2 62a_100000211182_100000762945 [1,0,0,0,1,0|2,0,0]=4 1515 B16R2.252 Oc1cnnc(c1)SCc2ccccc2 62a_100000211182_200010734679 [1,0,0,0,1,0|1,0,1]=4 1516 B16R2.3250 Brc1c[nH]nc1SCCc2ccccc2 62a_100000765856_100015839836 [1,0,0,0,1,0|2,0,0]=4 1517 B16R2.3250 Brc1c[nH]nc1SCCc2ccccc2 62a_100015839836_100011218657 [1,0,0,0,1,0|2,0,0]=4 1518 B16R2.3250 Cc1c[nH]nc1SCCc2ccccc2 62a_100000765856_100009871783 [1,0,0,0,1,0|2,0,0]=4 1519 B16R2.3250 Cc1c[nH]nc1SCCc2ccccc2 62a_100009871783_100011218657 [1,0,0,0,1,0|2,0,0]=4 1520 B16R2.3250 Clc1c[nH]nc1CNCc2ccccc2 207a_100015324214_100000040271 [1,0,0,0,1,0|2,0,0]=4 1521 B16R2.3250 Clc1c[nH]nc1CNCc2ccccc2 270004a_100015324214_100000040271 [1,0,0,0,1,0|2,0,0]=4 1522 B16R2.3250 Nc1c[nH]nc1SCCc2ccccc2 62a_100000765856_100010894806 [1,0,0,0,1,0|2,0,0]=4 1523 B16R2.3250 Nc1c[nH]nc1SCCc2ccccc2 62a_100010894806_100011218657 [1,0,0,0,1,0|2,0,0]=4 1524 B16R2.124 Cc1cc(n[nH]c1=O)Sc2ccccc2 62a_100000719477_100012187101 [0,0,0,0,2,0|2,0,0]=4 1525 B16R2.124 Nc1cc(n[nH]c1=O)Sc2ccccc2 62a_100000719477_100000102183 [0,0,0,0,2,0|2,0,0]=4 1526 B16R2.124 O=c1[nH]cc(cc1O)Sc2ccccc2 62a_100000719477_100009814561 [0,0,0,0,2,0|2,0,0]=4 1527 B18R1.4475 NC(=O)C(=O)NN=CCCOCc1ccccc1 4a_100000211141_100011797962 [0,0,1,0,0,1|1,0,1]=4 1528 B18R2.270 Brc1ccc(nc1)CCOCc2ccccc2 34a_100012357577_100015291786 [1,0,0,0,0,1|2,0,0]=4 1529 B18R2.270 Brc1ccc(nc1)CNCCc2ccccc2 207a_100000106460_100000754260 [1,0,0,0,0,1|2,0,0]=4 1530 B18R2.270 Brc1ccc(nc1)CNCCc2ccccc2 2230a_100000106460_100000702658 [1,0,0,0,0,1|2,0,0]=4 1531 B18R2.270 Brc1ccc(nc1)CNCCc2ccccc2 270004a_100000106460_100000754260 [1,0,0,0,0,1|2,0,0]=4 1532 B18R2.270 Brc1ccc(nc1)CNCCc2ccccc2 34a_100000106460_100000702658 [1,0,0,0,0,1|2,0,0]=4 1533 B18R2.270 Brc1ccc(nc1)CNCCc2ccccc2 34a_100015188789_100000765856 [1,0,0,0,0,1|2,0,0]=4 1534 B18R2.270 Brc1ccc(nc1)COCCc2ccccc2 34a_100000210268_100000702658 [1,0,0,0,0,1|2,0,0]=4 1535 B18R2.270 Brc1ccc(nc1)COCCc2ccccc2 34a_100000754261_100000765856 [1,0,0,0,0,1|2,0,0]=4 1536 B18R2.270 Brc1ccc(nc1)COCCc2ccccc2 7a_100000210268_100000702658 [1,0,0,0,0,1|2,0,0]=4 1537 B18R2.270 Brc1ccc(nc1)CSCCc2ccccc2 62a_100000702658_100011218657 [1,0,0,0,0,1|2,0,0]=4 1538 B18R2.270 Brc1ccc(nc1)CSCCc2ccccc2 62a_100000765856_100000702658 [1,0,0,0,0,1|2,0,0]=4 1539 B18R2.270 Brc1ccc(nc1)NCCCc2ccccc2 27a_100000211184_100000686858 [1,0,0,0,0,1|2,0,0]=4 1540 B18R2.270 Brc1ccc(nc1)SCCCc2ccccc2 62a_100000211621_100000686858 [1,0,0,0,0,1|2,0,0]=4 1541 B18R2.270 Brc1ccc(nc1)SCCCc2ccccc2 62a_100000686858_100000211621 [1,0,0,0,0,1|2,0,0]=4 1542 B18R2.270 Cc1ccc(nc1)CNCCc2ccccc2 207a_100000106460_100000050478 [1,0,0,0,0,1|2,0,0]=4 1543 B18R2.270 Cc1ccc(nc1)CNCCc2ccccc2 2230a_100000106460_100000691093 [1,0,0,0,0,1|2,0,0]=4 1544 B18R2.270 Cc1ccc(nc1)CNCCc2ccccc2 270004a_100000106460_100000050478 [1,0,0,0,0,1|2,0,0]=4 1545 B18R2.270 Cc1ccc(nc1)CNCCc2ccccc2 34a_100000106460_100000691093 [1,0,0,0,0,1|2,0,0]=4 1546 B18R2.270 Cc1ccc(nc1)CNCCc2ccccc2 34a_100015187455_100000765856 [1,0,0,0,0,1|2,0,0]=4 1547 B18R2.270 Cc1ccc(nc1)COCCc2ccccc2 34a_100000210268_100000691093 [1,0,0,0,0,1|2,0,0]=4 1548 B18R2.270 Cc1ccc(nc1)COCCc2ccccc2 34a_100012001401_100000765856 [1,0,0,0,0,1|2,0,0]=4 1549 B18R2.270 Cc1ccc(nc1)COCCc2ccccc2 7a_100000210268_100000691093 [1,0,0,0,0,1|2,0,0]=4 1550 B18R2.270 Cc1ccc(nc1)CSCCc2ccccc2 62a_100000691093_100011218657 [1,0,0,0,0,1|2,0,0]=4 1551 B18R2.270 Cc1ccc(nc1)CSCCc2ccccc2 62a_100000765856_100000691093 [1,0,0,0,0,1|2,0,0]=4 1552 B18R2.270 Cc1ccc(nc1)OCCCc2ccccc2 34a_100000759353_100000211621 [1,0,0,0,0,1|2,0,0]=4 1553 B18R2.270 Cc1ccc(nc1)SCCCc2ccccc2 62a_100000211621_100000754016 [1,0,0,0,0,1|2,0,0]=4 1554 B18R2.270 Cc1ccc(nc1)SCCCc2ccccc2 62a_100011192072_100000211621 [1,0,0,0,0,1|2,0,0]=4 1555 B18R2.270 Cc1ccc(nn1)NCCCc2ccccc2 27a_100000211184_100000744512 [1,0,0,0,0,1|1,0,1]=4 1556 B18R2.270 Cc1ccc(nn1)SCCCc2ccccc2 62a_100000211621_100000744512 [1,0,0,0,0,1|1,0,1]=4 1557 B18R2.270 Cc1ccc(nn1)SCCCc2ccccc2 62a_100000744512_100000211621 [1,0,0,0,0,1|1,0,1]=4 1558 B18R2.270 Clc1ccc(nc1)CNCCc2ccccc2 207a_100000106460_100011361569 [1,0,0,0,0,1|2,0,0]=4 1559 B18R2.270 Clc1ccc(nc1)CNCCc2ccccc2 2230a_100000106460_100012066911 [1,0,0,0,0,1|2,0,0]=4 1560 B18R2.270 Clc1ccc(nc1)CNCCc2ccccc2 270004a_100000106460_100011361569 [1,0,0,0,0,1|2,0,0]=4 1561 B18R2.270 Clc1ccc(nc1)CNCCc2ccccc2 34a_100000106460_100012066911 [1,0,0,0,0,1|2,0,0]=4 1562 B18R2.270 Clc1ccc(nc1)CNCCc2ccccc2 34a_100000697193_100000765856 [1,0,0,0,0,1|2,0,0]=4 1563 B18R2.270 Clc1ccc(nc1)COCCc2ccccc2 34a_100000210268_100012066911 [1,0,0,0,0,1|2,0,0]=4 1564 B18R2.270 Clc1ccc(nc1)COCCc2ccccc2 34a_100000703999_100000765856 [1,0,0,0,0,1|2,0,0]=4 1565 B18R2.270 Clc1ccc(nc1)COCCc2ccccc2 7a_100000210268_100012066911 [1,0,0,0,0,1|2,0,0]=4 1566 B18R2.270 Clc1ccc(nc1)CSCCc2ccccc2 62a_100000765856_100000697101 [1,0,0,0,0,1|2,0,0]=4 1567 B18R2.270 Clc1ccc(nc1)CSCCc2ccccc2 62a_100012066911_100011218657 [1,0,0,0,0,1|2,0,0]=4 1568 B18R2.270 Clc1ccc(nc1)OCCCc2ccccc2 34a_100011215309_100000211621 [1,0,0,0,0,1|2,0,0]=4 1569 B18R2.270 Clc1ccc(nc1)SCCCc2ccccc2 62a_100000211621_100011356976 [1,0,0,0,0,1|2,0,0]=4 1570 B18R2.270 Clc1ccc(nc1)SCCCc2ccccc2 62a_100011356976_100000211621 [1,0,0,0,0,1|2,0,0]=4 1571 B18R2.270 Clc1ccc(nn1)CNCCc2ccccc2 2230a_100000106460_100016992710 [1,0,0,0,0,1|1,0,1]=4 1572 B18R2.270 Clc1ccc(nn1)CNCCc2ccccc2 270004a_100000106460_100000044651 [1,0,0,0,0,1|1,0,1]=4 1573 B18R2.270 Clc1ccc(nn1)CNCCc2ccccc2 34a_100000106460_100016992710 [1,0,0,0,0,1|1,0,1]=4 1574 B18R2.270 Clc1ccc(nn1)COCCc2ccccc2 34a_100000210268_100016992710 [1,0,0,0,0,1|1,0,1]=4 1575 B18R2.270 Clc1ccc(nn1)COCCc2ccccc2 7a_100000210268_100016992710 [1,0,0,0,0,1|1,0,1]=4 1576 B18R2.270 Clc1ccc(nn1)CSCCc2ccccc2 62a_100000765856_100016992710 [1,0,0,0,0,1|1,0,1]=4 1577 B18R2.270 Clc1ccc(nn1)CSCCc2ccccc2 62a_100016992710_100011218657 [1,0,0,0,0,1|1,0,1]=4 1578 B18R2.270 Clc1ccc(nn1)SCCCc2ccccc2 62a_100000068654_100000211621 [1,0,0,0,0,1|1,0,1]=4 1579 B18R2.270 Clc1ccc(nn1)SCCCc2ccccc2 62a_100000211621_100000068654 [1,0,0,0,0,1|1,0,1]=4 1580 B18R2.270 Fc1ccc(nc1)CNCCc2ccccc2 207a_100000106460_100011934744 [1,0,0,0,0,1|2,0,0]=4 1581 B18R2.270 Fc1ccc(nc1)CNCCc2ccccc2 2230a_100000106460_100000703193 [1,0,0,0,0,1|2,0,0]=4 1582 B18R2.270 Fc1ccc(nc1)CNCCc2ccccc2 270004a_100000106460_100011934744 [1,0,0,0,0,1|2,0,0]=4 1583 B18R2.270 Fc1ccc(nc1)CNCCc2ccccc2 34a_100000106460_100000703193 [1,0,0,0,0,1|2,0,0]=4 1584 B18R2.270 Fc1ccc(nc1)CNCCc2ccccc2 34a_100020620131_100000765856 [1,0,0,0,0,1|2,0,0]=4 1585 B18R2.270 Fc1ccc(nc1)COCCc2ccccc2 34a_100000210268_100000703193 [1,0,0,0,0,1|2,0,0]=4 1586 B18R2.270 Fc1ccc(nc1)COCCc2ccccc2 34a_100011999454_100000765856 [1,0,0,0,0,1|2,0,0]=4 1587 B18R2.270 Fc1ccc(nc1)COCCc2ccccc2 7a_100000210268_100000703193 [1,0,0,0,0,1|2,0,0]=4 1588 B18R2.270 Fc1ccc(nc1)CSCCc2ccccc2 62a_100000703193_100011218657 [1,0,0,0,0,1|2,0,0]=4 1589 B18R2.270 Fc1ccc(nc1)CSCCc2ccccc2 62a_100000765856_100000703193 [1,0,0,0,0,1|2,0,0]=4 1590 B18R2.270 Fc1ccc(nc1)OCCCc2ccccc2 34a_100000742473_100000211621 [1,0,0,0,0,1|2,0,0]=4 1591 B18R2.270 Fc1ccc(nc1)SCCCc2ccccc2 62a_100000211621_100000744514 [1,0,0,0,0,1|2,0,0]=4 1592 B18R2.270 Fc1ccc(nc1)SCCCc2ccccc2 62a_100000744514_100000211621 [1,0,0,0,0,1|2,0,0]=4 1593 B18R2.270 Nc1ccc(nc1)COCCc2ccccc2 34a_100011998161_100000765856 [1,0,0,0,0,1|2,0,0]=4 1594 B18R2.270 Nc1ccc(nc1)OCCCc2ccccc2 34a_100000729260_100000211621 [1,0,0,0,0,1|2,0,0]=4 1595 B18R2.270 Nc1ccc(nc1)SCCCc2ccccc2 62a_100000211621_100000737798 [1,0,0,0,0,1|2,0,0]=4 1596 B18R2.270 Nc1ccc(nc1)SCCCc2ccccc2 62a_100000737798_100000211621 [1,0,0,0,0,1|2,0,0]=4 1597 B18R2.270 Nc1ccc(nn1)SCCCc2ccccc2 62a_100000211621_100010219413 [1,0,0,0,0,1|1,0,1]=4 1598 B18R2.270 Nc1ccc(nn1)SCCCc2ccccc2 62a_100010219413_100000211621 [1,0,0,0,0,1|1,0,1]=4 1599 B18R2.270 O=c1ccc(c[nH]1)COCCc2ccccc2 34a_100011999846_100000765856 [1,0,0,0,0,1|1,0,0]=3 1600 B18R2.270 O=c1ccc(c[nH]1)OCCCc2ccccc2 34a_100000075641_100000211621 [1,0,0,0,0,1|1,0,0]=3 1601 B18R2.270 O=c1ccc(c[nH]1)OCCOc2ccccc2 34a_100000075641_100000184471 [1,0,0,0,0,1|2,0,0]=4 1602 B18R2.270 O=c1ccc(c[nH]1)OCCSc2ccccc2 34a_100000075641_100000246102 [1,0,0,0,0,1|2,0,0]=4 1603 B18R2.270 O=c1ccc(c[nH]1)OCOCc2ccccc2 34a_100000075641_100000763385 [1,0,0,0,0,1|2,0,0]=4 1604 B18R2.270 O=c1ccc(c[nH]1)OCSCc2ccccc2 34a_100000075641_200011217039 [1,0,0,0,0,1|2,0,0]=4 1605 B18R2.270 O=c1ccc(c[nH]1)SCCCc2ccccc2 62a_100000211621_100000212171 [1,0,0,0,0,1|1,0,0]=3 1606 B18R2.270 O=c1ccc(c[nH]1)SCCCc2ccccc2 62a_100000212171_100000211621 [1,0,0,0,0,1|1,0,0]=3 1607 B18R2.270 O=c1ccc(c[nH]1)SCCOc2ccccc2 62a_100000184471_100000212171 [1,0,0,0,0,1|2,0,0]=4 1608 B18R2.270 O=c1ccc(c[nH]1)SCCOc2ccccc2 62a_100000212171_100000184471 [1,0,0,0,0,1|2,0,0]=4 1609 B18R2.270 O=c1ccc(c[nH]1)SCCSc2ccccc2 62a_100000212171_100000246102 [1,0,0,0,0,1|2,0,0]=4 1610 B18R2.270 O=c1ccc(c[nH]1)SCCSc2ccccc2 62a_100000246102_100000212171 [1,0,0,0,0,1|2,0,0]=4 1611 B18R2.270 O=c1ccc(c[nH]1)SCOCc2ccccc2 62a_100000212171_100000763385 [1,0,0,0,0,1|2,0,0]=4 1612 B18R2.270 O=c1ccc(c[nH]1)SCOCc2ccccc2 62a_100000763385_100000212171 [1,0,0,0,0,1|2,0,0]=4 1613 B18R2.270 O=c1ccc(c[nH]1)SCSCc2ccccc2 62a_100000212171_200011217039 [1,0,0,0,0,1|2,0,0]=4 1614 B18R2.270 O=c1ccc(c[nH]1)SCSCc2ccccc2 62a_200011217039_100000212171 [1,0,0,0,0,1|2,0,0]=4 1615 B18R2.270 O=c1ccc(n[nH]1)C=NNCc2ccccc2 4a_100000007032_100011361533 [1,0,0,0,0,1|1,0,1]=4 1616 B18R2.270 O=c1ccc(n[nH]1)CNCCc2ccccc2 207a_100000106460_100011361533 [1,0,0,0,0,1|0,0,0]=2 1617 B18R2.270 O=c1ccc(n[nH]1)CNCCc2ccccc2 270004a_100000106460_100011361533 [1,0,0,0,0,1|0,0,0]=2 1618 B18R2.270 O=c1ccc(n[nH]1)CNCCc2ccccn2 207a_100000211156_100011361533 [1,0,0,0,0,1|1,0,0]=3 1619 B18R2.270 O=c1ccc(n[nH]1)CNCCc2ccccn2 270004a_100000211156_100011361533 [1,0,0,0,0,1|1,0,0]=3 1620 B18R2.270 O=c1ccc(n[nH]1)CNCCc2cccnc2 207a_100000736294_100011361533 [1,0,0,0,0,1|1,0,0]=3 1621 B18R2.270 O=c1ccc(n[nH]1)CNCCc2cccnc2 270004a_100000736294_100011361533 [1,0,0,0,0,1|1,0,0]=3 1622 B18R2.270 O=c1ccc(n[nH]1)CNCCc2ccncc2 207a_100000742849_100011361533 [1,0,0,0,0,1|1,0,0]=3 1623 B18R2.270 O=c1ccc(n[nH]1)CNCCc2ccncc2 270004a_100000742849_100011361533 [1,0,0,0,0,1|1,0,0]=3 1624 B18R2.270 O=c1ccc(n[nH]1)CNCCc2cnccn2 207a_100000723456_100011361533 [1,0,0,0,0,1|2,0,0]=4 1625 B18R2.270 O=c1ccc(n[nH]1)CNCCc2cnccn2 270004a_100000723456_100011361533 [1,0,0,0,0,1|2,0,0]=4 1626 B18R2.270 O=c1ccc(n[nH]1)SC/C=C/c2ccccc2 62a_100009820020_100016265936 [1,0,0,0,0,1|0,0,2]=4 1627 B18R2.270 O=c1ccc(n[nH]1)SC/C=C/c2ccccc2 62a_100016265936_100009820020 [1,0,0,0,0,1|0,0,2]=4 1628 B18R2.270 O=c1ccc(n[nH]1)SCC#Cc2ccccc2 62a_100009820020_100011352542 [1,0,0,0,0,1|0,0,2]=4 1629 B18R2.270 O=c1ccc(n[nH]1)SCCCc2ccccc2 62a_100000211621_100009820020 [1,0,0,0,0,1|0,0,0]=2 1630 B18R2.270 O=c1ccc(n[nH]1)SCCCc2ccccc2 62a_100009820020_100000211621 [1,0,0,0,0,1|0,0,0]=2 1631 B18R2.270 O=c1ccc(n[nH]1)SCCOc2ccccc2 62a_100000184471_100009820020 [1,0,0,0,0,1|1,0,0]=3 1632 B18R2.270 O=c1ccc(n[nH]1)SCCOc2ccccc2 62a_100009820020_100000184471 [1,0,0,0,0,1|1,0,0]=3 1633 B18R2.270 O=c1ccc(n[nH]1)SCCSc2ccccc2 62a_100000246102_100009820020 [1,0,0,0,0,1|1,0,0]=3 1634 B18R2.270 O=c1ccc(n[nH]1)SCCSc2ccccc2 62a_100009820020_100000246102 [1,0,0,0,0,1|1,0,0]=3 1635 B18R2.270 O=c1ccc(n[nH]1)SCOCc2ccccc2 62a_100000763385_100009820020 [1,0,0,0,0,1|1,0,0]=3 1636 B18R2.270 O=c1ccc(n[nH]1)SCOCc2ccccc2 62a_100009820020_100000763385 [1,0,0,0,0,1|1,0,0]=3 1637 B18R2.270 O=c1ccc(n[nH]1)SCSCc2ccccc2 62a_100009820020_200011217039 [1,0,0,0,0,1|1,0,0]=3 1638 B18R2.270 O=c1ccc(n[nH]1)SCSCc2ccccc2 62a_200011217039_100009820020 [1,0,0,0,0,1|1,0,0]=3 1639 B18R2.270 O=c1ncc(c[nH]1)SCCCc2ccccc2 62a_100000211621_102495366499 [1,0,0,0,0,1|2,0,0]=4 1640 B18R2.270 O=c1ncc(c[nH]1)SCCCc2ccccc2 62a_102495366499_100000211621 [1,0,0,0,0,1|2,0,0]=4 1641 B18R2.270 Oc1ccc(nc1)SCCCc2ccccc2 62a_100000211621_100000744096 [1,0,0,0,0,1|1,0,1]=4 1642 B18R2.270 Oc1ccc(nc1)SCCCc2ccccc2 62a_100000685995_100000211621 [1,0,0,0,0,1|1,0,1]=4 1643 B18R2.6483 Brc1ccnc(c1)CNCCc2ccccc2 2230a_100000106460_100010173614 [1,0,0,0,0,1|2,0,0]=4 1644 B18R2.6483 Brc1ccnc(c1)CNCCc2ccccc2 270004a_100000106460_100009818557 [1,0,0,0,0,1|2,0,0]=4 1645 B18R2.6483 Brc1ccnc(c1)CNCCc2ccccc2 34a_100000106460_100010173614 [1,0,0,0,0,1|2,0,0]=4 1646 B18R2.6483 Brc1ccnc(c1)COCCc2ccccc2 34a_100000210268_100010173614 [1,0,0,0,0,1|2,0,0]=4 1647 B18R2.6483 Brc1ccnc(c1)COCCc2ccccc2 7a_100000210268_100010173614 [1,0,0,0,0,1|2,0,0]=4 1648 B18R2.6483 Brc1ccnc(c1)CSCCc2ccccc2 62a_100000765856_100010173614 [1,0,0,0,0,1|2,0,0]=4 1649 B18R2.6483 Brc1ccnc(c1)CSCCc2ccccc2 62a_100010173614_100011218657 [1,0,0,0,0,1|2,0,0]=4 1650 B18R2.6483 Cc1ccnc(c1)CNCCc2ccccc2 207a_100000106460_100011361488 [1,0,0,0,0,1|2,0,0]=4 1651 B18R2.6483 Cc1ccnc(c1)CNCCc2ccccc2 2230a_100000106460_100000718516 [1,0,0,0,0,1|2,0,0]=4 1652 B18R2.6483 Cc1ccnc(c1)CNCCc2ccccc2 270004a_100000106460_100011361488 [1,0,0,0,0,1|2,0,0]=4 1653 B18R2.6483 Cc1ccnc(c1)CNCCc2ccccc2 34a_100000106460_100000718516 [1,0,0,0,0,1|2,0,0]=4 1654 B18R2.6483 Cc1ccnc(c1)COCCc2ccccc2 34a_100000210268_100000718516 [1,0,0,0,0,1|2,0,0]=4 1655 B18R2.6483 Cc1ccnc(c1)COCCc2ccccc2 34a_100011998357_100000765856 [1,0,0,0,0,1|2,0,0]=4 1656 B18R2.6483 Cc1ccnc(c1)COCCc2ccccc2 7a_100000210268_100000718516 [1,0,0,0,0,1|2,0,0]=4 1657 B18R2.6483 Cc1ccnc(c1)CSCCc2ccccc2 62a_100000718516_100011218657 [1,0,0,0,0,1|2,0,0]=4 1658 B18R2.6483 Cc1ccnc(c1)CSCCc2ccccc2 62a_100000765856_100000718516 [1,0,0,0,0,1|2,0,0]=4 1659 B18R2.6483 Cc1ccnc(c1)SCCCc2ccccc2 62a_100000211621_100000750283 [1,0,0,0,0,1|2,0,0]=4 1660 B18R2.6483 Cc1ccnc(c1)SCCCc2ccccc2 62a_100000750283_100000211621 [1,0,0,0,0,1|2,0,0]=4 1661 B18R2.6483 Cc1cnnc(c1)COCCc2ccccc2 34a_100016212594_100000765856 [1,0,0,0,0,1|1,0,1]=4 1662 B18R2.6483 Cc1cnnc(c1)NCCCc2ccccc2 27a_100000211184_100000070100 [1,0,0,0,0,1|1,0,1]=4 1663 B18R2.6483 Cc1cnnc(c1)OCCCc2ccccc2 34a_100000766097_100000211621 [1,0,0,0,0,1|1,0,1]=4 1664 B18R2.6483 Cc1cnnc(c1)SCCCc2ccccc2 62a_100000070100_100000211621 [1,0,0,0,0,1|1,0,1]=4 1665 B18R2.6483 Cc1cnnc(c1)SCCCc2ccccc2 62a_100000211621_100000070100 [1,0,0,0,0,1|1,0,1]=4 1666 B18R2.6483 Clc1ccnc(c1)CNCCc2ccccc2 2230a_100000106460_100016988179 [1,0,0,0,0,1|2,0,0]=4 1667 B18R2.6483 Clc1ccnc(c1)CNCCc2ccccc2 270004a_100000106460_100011998288 [1,0,0,0,0,1|2,0,0]=4 1668 B18R2.6483 Clc1ccnc(c1)CNCCc2ccccc2 34a_100000106460_100016988179 [1,0,0,0,0,1|2,0,0]=4 1669 B18R2.6483 Clc1ccnc(c1)COCCc2ccccc2 34a_100000210268_100016988179 [1,0,0,0,0,1|2,0,0]=4 1670 B18R2.6483 Clc1ccnc(c1)COCCc2ccccc2 34a_100000748867_100000765856 [1,0,0,0,0,1|2,0,0]=4 1671 B18R2.6483 Clc1ccnc(c1)COCCc2ccccc2 7a_100000210268_100016988179 [1,0,0,0,0,1|2,0,0]=4 1672 B18R2.6483 Clc1ccnc(c1)CSCCc2ccccc2 62a_100000765856_100016988179 [1,0,0,0,0,1|2,0,0]=4 1673 B18R2.6483 Clc1ccnc(c1)CSCCc2ccccc2 62a_100016988179_100011218657 [1,0,0,0,0,1|2,0,0]=4 1674 B18R2.6483 Clc1ccnc(c1)SCCCc2ccccc2 62a_100000211621_100010167805 [1,0,0,0,0,1|2,0,0]=4 1675 B18R2.6483 Clc1ccnc(c1)SCCCc2ccccc2 62a_100010167805_100000211621 [1,0,0,0,0,1|2,0,0]=4 1676 B18R2.6483 Fc1ccnc(c1)NCCCc2ccccc2 27a_100000211184_100000764206 [1,0,0,0,0,1|2,0,0]=4 1677 B18R2.6483 Fc1ccnc(c1)SCCCc2ccccc2 62a_100000211621_100000764206 [1,0,0,0,0,1|2,0,0]=4 1678 B18R2.6483 Fc1ccnc(c1)SCCCc2ccccc2 62a_100000764206_100000211621 [1,0,0,0,0,1|2,0,0]=4 1679 B18R2.6483 Nc1ccnc(c1)COCCc2ccccc2 34a_100000692640_100000765856 [1,0,0,0,0,1|2,0,0]=4 1680 B18R2.6483 Nc1ccnc(c1)SCCCc2ccccc2 62a_100000211621_100009814236 [1,0,0,0,0,1|2,0,0]=4 1681 B18R2.6483 Nc1ccnc(c1)SCCCc2ccccc2 62a_100009814236_100000211621 [1,0,0,0,0,1|2,0,0]=4 1682 B18R2.6483 Nc1cnnc(c1)SCCCc2ccccc2 62a_100000211621_100011996757 [1,0,0,0,0,1|1,0,1]=4 1683 B18R2.6483 Nc1cnnc(c1)SCCCc2ccccc2 62a_100011996757_100000211621 [1,0,0,0,0,1|1,0,1]=4 1684 B18R2.6483 Oc1cc(ncn1)NCCCc2ccccc2 27a_100000211184_100000765262 [1,0,0,0,0,1|2,0,0]=4 1685 B18R2.6483 Oc1cc(ncn1)SCCCc2ccccc2 62a_100000211621_100000765262 [1,0,0,0,0,1|2,0,0]=4 1686 B18R2.6483 Oc1cccc(c1)CCNCc2ccccc2 2230a_100000747277_100015291786 [1,0,0,0,0,1|2,0,0]=4 1687 B18R2.6483 Oc1cccc(c1)CCNCc2ccccc2 34a_100000747277_100015291786 [1,0,0,0,0,1|2,0,0]=4 1688 B18R2.6483 Oc1cccc(c1)CNCCc2ccccc2 207a_100000106460_100000188321 [1,0,0,0,0,1|2,0,0]=4 1689 B18R2.6483 Oc1cccc(c1)CNCCc2ccccc2 2230a_100000106460_100011660834 [1,0,0,0,0,1|2,0,0]=4 1690 B18R2.6483 Oc1cccc(c1)CNCCc2ccccc2 2230a_100000743036_100000765856 [1,0,0,0,0,1|2,0,0]=4 1691 B18R2.6483 Oc1cccc(c1)CNCCc2ccccc2 270004a_100000106460_100000188321 [1,0,0,0,0,1|2,0,0]=4 1692 B18R2.6483 Oc1cccc(c1)CNCCc2ccccc2 34a_100000106460_100011660834 [1,0,0,0,0,1|2,0,0]=4 1693 B18R2.6483 Oc1cccc(c1)CNCCc2ccccc2 34a_100000743036_100000765856 [1,0,0,0,0,1|2,0,0]=4 1694 B18R2.6483 Oc1cccc(c1)COCCc2ccccc2 34a_100000210268_100011660834 [1,0,0,0,0,1|2,0,0]=4 1695 B18R2.6483 Oc1cccc(c1)COCCc2ccccc2 7a_100000210268_100000084143 [1,0,0,0,0,1|2,0,0]=4 1696 B18R2.6483 Oc1cccc(c1)CSCCc2ccccc2 62a_100000765856_100011660834 [1,0,0,0,0,1|2,0,0]=4 1697 B18R2.6483 Oc1cccc(c1)CSCCc2ccccc2 62a_100011660834_100011218657 [1,0,0,0,0,1|2,0,0]=4 1698 B18R2.6483 Oc1cccc(c1)NCCCc2ccccc2 34a_100000210217_100000211621 [1,0,0,0,0,1|2,0,0]=4 1699 B18R2.6483 Oc1cccc(c1)SCCCc2ccccc2 62a_100000211621_100000211634 [1,0,0,0,0,1|2,0,0]=4 1700 B18R2.6483 Oc1ccnc(c1)SCCCc2ccccc2 62a_100000211621_100000762945 [1,0,0,0,0,1|1,0,0]=3 1701 B18R2.6483 Oc1ccnc(c1)SCCOc2ccccc2 62a_100000184471_100000762945 [1,0,0,0,0,1|2,0,0]=4 1702 B18R2.6483 Oc1ccnc(c1)SCCSc2ccccc2 62a_100000246102_100000762945 [1,0,0,0,0,1|2,0,0]=4 1703 B18R2.6483 Oc1ccnc(c1)SCOCc2ccccc2 62a_100000763385_100000762945 [1,0,0,0,0,1|2,0,0]=4 1704 B18R2.6483 Oc1ccnc(c1)SCSCc2ccccc2 62a_200011217039_100000762945 [1,0,0,0,0,1|2,0,0]=4 1705 B18R2.6483 Oc1ccnc(n1)NCCCc2ccccc2 27a_100000211184_100011649813 [1,0,0,0,0,1|2,0,0]=4 1706 B18R2.6483 Oc1ccnc(n1)SCCCc2ccccc2 62a_100000211621_100011649813 [1,0,0,0,0,1|2,0,0]=4 1707 B18R2.6483 Oc1cncc(c1)CNCCc2ccccc2 207a_100000106460_100012187055 [1,0,0,0,0,1|1,0,1]=4 1708 B18R2.6483 Oc1cncc(c1)CNCCc2ccccc2 270004a_100000106460_100012187055 [1,0,0,0,0,1|1,0,1]=4 1709 B18R2.6483 Oc1cncc(c1)SCCCc2ccccc2 62a_100000211621_100000754920 [1,0,0,0,0,1|1,0,1]=4 1710 B18R2.6483 Oc1cncc(c1)SCCCc2ccccc2 62a_100000754920_100000211621 [1,0,0,0,0,1|1,0,1]=4 1711 B18R2.6483 Oc1cnnc(c1)SCCCc2ccccc2 62a_100000211621_200010734679 [1,0,0,0,0,1|0,0,1]=3 1712 B18R2.6483 Oc1cnnc(c1)SCCOc2ccccc2 62a_100000184471_200010734679 [1,0,0,0,0,1|1,0,1]=4 1713 B18R2.6483 Oc1cnnc(c1)SCCSc2ccccc2 62a_100000246102_200010734679 [1,0,0,0,0,1|1,0,1]=4 1714 B18R2.6483 Oc1cnnc(c1)SCOCc2ccccc2 62a_100000763385_200010734679 [1,0,0,0,0,1|1,0,1]=4 1715 B18R2.6483 Oc1cnnc(c1)SCSCc2ccccc2 62a_200011217039_200010734679 [1,0,0,0,0,1|1,0,1]=4 1716 B20R2.15501 Cc1cc(n[nH]c1=O)C=CCOCc2ccccc2 271570a_200011106559_100012187101 [0,0,0,0,0,2|1,0,1]=4 1717 B20R2.15501 Cc1cc(n[nH]c1=O)SCCCCc2ccccc2 62a_100000701786_100012187101 [0,0,0,0,0,2|1,0,0]=3 1718 B20R2.15501 Cc1cc(n[nH]c1=O)SCCCCc2ccncc2 62a_100020630000_100012187101 [0,0,0,0,0,2|2,0,0]=4 1719 B20R2.15501 Cc1cc(n[nH]c1=O)SCCCOc2ccccc2 62a_100000199009_100012187101 [0,0,0,0,0,2|1,0,0]=3 1720 B20R2.15501 Cc1cc(n[nH]c1=O)SCCCSc2ccccc2 62a_200011203293_100012187101 [0,0,0,0,0,2|1,0,0]=3 1721 B20R2.15501 Cc1cc(n[nH]c1=O)SCCOCc2ccccc2 62a_100000234347_100012187101 [0,0,0,0,0,2|1,0,0]=3 1722 B20R2.15501 Cc1cc(n[nH]c1=O)SCCSCc2ccccc2 62a_200011297719_100012187101 [0,0,0,0,0,2|1,0,0]=3 1723 B20R2.15501 Cc1cnc(cc1O)SCCCCc2ccccc2 62a_100000701786_100000704368 [0,0,0,0,0,2|2,0,0]=4 1724 B20R2.15501 Cc1cnc(cc1O)SCCCCc2ccccc2 62a_100000704368_100000701786 [0,0,0,0,0,2|2,0,0]=4 1725 B20R2.15501 Cc1cnc(cc1O)SCCCOc2ccccc2 62a_100000199009_100000704368 [0,0,0,0,0,2|2,0,0]=4 1726 B20R2.15501 Cc1cnc(cc1O)SCCCOc2ccccc2 62a_100000704368_100000199009 [0,0,0,0,0,2|2,0,0]=4 1727 B20R2.15501 Cc1cnc(cc1O)SCCCSc2ccccc2 62a_100000704368_200011203293 [0,0,0,0,0,2|2,0,0]=4 1728 B20R2.15501 Cc1cnc(cc1O)SCCCSc2ccccc2 62a_200011203293_100000704368 [0,0,0,0,0,2|2,0,0]=4 1729 B20R2.15501 Cc1cnc(cc1O)SCCOCc2ccccc2 62a_100000234347_100000704368 [0,0,0,0,0,2|2,0,0]=4 1730 B20R2.15501 Cc1cnc(cc1O)SCCOCc2ccccc2 62a_100000704368_100000234347 [0,0,0,0,0,2|2,0,0]=4 1731 B20R2.15501 Cc1cnc(cc1O)SCCSCc2ccccc2 62a_100000704368_200011297719 [0,0,0,0,0,2|2,0,0]=4 1732 B20R2.15501 Cc1cnc(cc1O)SCCSCc2ccccc2 62a_200011297719_100000704368 [0,0,0,0,0,2|2,0,0]=4 1733 B20R2.15501 Nc1cc(n[nH]c1=O)C=CCOCc2ccccc2 271570a_200011106559_100000102183 [0,0,0,0,0,2|1,0,1]=4 1734 B20R2.15501 Nc1cc(n[nH]c1=O)SCCCCc2ccccc2 62a_100000701786_100000102183 [0,0,0,0,0,2|1,0,0]=3 1735 B20R2.15501 Nc1cc(n[nH]c1=O)SCCCCc2ccncc2 62a_100020630000_100000102183 [0,0,0,0,0,2|2,0,0]=4 1736 B20R2.15501 Nc1cc(n[nH]c1=O)SCCCOc2ccccc2 62a_100000199009_100000102183 [0,0,0,0,0,2|1,0,0]=3 1737 B20R2.15501 Nc1cc(n[nH]c1=O)SCCCSc2ccccc2 62a_200011203293_100000102183 [0,0,0,0,0,2|1,0,0]=3 1738 B20R2.15501 Nc1cc(n[nH]c1=O)SCCOCc2ccccc2 62a_100000234347_100000102183 [0,0,0,0,0,2|1,0,0]=3 1739 B20R2.15501 Nc1cc(n[nH]c1=O)SCCSCc2ccccc2 62a_200011297719_100000102183 [0,0,0,0,0,2|1,0,0]=3 1740 B20R2.15501 O=c1[nH]cc(cc1Br)SCCCCc2ccccc2 62a_100000701786_100010125443 [0,0,0,0,0,2|2,0,0]=4 1741 B20R2.15501 O=c1[nH]cc(cc1Br)SCCCCc2ccccc2 62a_100010125443_100000701786 [0,0,0,0,0,2|2,0,0]=4 1742 B20R2.15501 O=c1[nH]cc(cc1Br)SCCCOc2ccccc2 62a_100000199009_100010125443 [0,0,0,0,0,2|2,0,0]=4 1743 B20R2.15501 O=c1[nH]cc(cc1Br)SCCCOc2ccccc2 62a_100010125443_100000199009 [0,0,0,0,0,2|2,0,0]=4 1744 B20R2.15501 O=c1[nH]cc(cc1Br)SCCCSc2ccccc2 62a_100010125443_200011203293 [0,0,0,0,0,2|2,0,0]=4 1745 B20R2.15501 O=c1[nH]cc(cc1Br)SCCCSc2ccccc2 62a_200011203293_100010125443 [0,0,0,0,0,2|2,0,0]=4 1746 B20R2.15501 O=c1[nH]cc(cc1Br)SCCOCc2ccccc2 62a_100000234347_100010125443 [0,0,0,0,0,2|2,0,0]=4 1747 B20R2.15501 O=c1[nH]cc(cc1Br)SCCOCc2ccccc2 62a_100010125443_100000234347 [0,0,0,0,0,2|2,0,0]=4 1748 B20R2.15501 O=c1[nH]cc(cc1Br)SCCSCc2ccccc2 62a_100010125443_200011297719 [0,0,0,0,0,2|2,0,0]=4 1749 B20R2.15501 O=c1[nH]cc(cc1Br)SCCSCc2ccccc2 62a_200011297719_100010125443 [0,0,0,0,0,2|2,0,0]=4 1750 B20R2.15501 O=c1[nH]cc(cc1Cl)CNCCCc2ccccc2 207a_100000211184_100000051075 [0,0,0,0,0,2|2,0,0]=4 1751 B20R2.15501 O=c1[nH]cc(cc1Cl)CNCCCc2ccccc2 270004a_100000211184_100000051075 [0,0,0,0,0,2|2,0,0]=4 1752 B20R2.15501 O=c1[nH]cc(cc1Cl)CNCCOc2ccccc2 207a_100000174943_100000051075 [0,0,0,0,0,2|2,0,0]=4 1753 B20R2.15501 O=c1[nH]cc(cc1Cl)CNCCOc2ccccc2 270004a_100000174943_100000051075 [0,0,0,0,0,2|2,0,0]=4 1754 B20R2.15501 O=c1[nH]cc(cc1Cl)CNCCSc2ccccc2 207a_100000189519_100000051075 [0,0,0,0,0,2|2,0,0]=4 1755 B20R2.15501 O=c1[nH]cc(cc1Cl)CNCCSc2ccccc2 270004a_100000189519_100000051075 [0,0,0,0,0,2|2,0,0]=4 1756 B20R2.15501 O=c1[nH]cc(cc1F)SCCCCc2ccccc2 62a_100000701786_100000723523 [0,0,0,0,0,2|2,0,0]=4 1757 B20R2.15501 O=c1[nH]cc(cc1F)SCCCCc2ccccc2 62a_100000723523_100000701786 [0,0,0,0,0,2|2,0,0]=4 1758 B20R2.15501 O=c1[nH]cc(cc1F)SCCCOc2ccccc2 62a_100000199009_100000723523 [0,0,0,0,0,2|2,0,0]=4 1759 B20R2.15501 O=c1[nH]cc(cc1F)SCCCOc2ccccc2 62a_100000723523_100000199009 [0,0,0,0,0,2|2,0,0]=4 1760 B20R2.15501 O=c1[nH]cc(cc1F)SCCCSc2ccccc2 62a_100000723523_200011203293 [0,0,0,0,0,2|2,0,0]=4 1761 B20R2.15501 O=c1[nH]cc(cc1F)SCCCSc2ccccc2 62a_200011203293_100000723523 [0,0,0,0,0,2|2,0,0]=4 1762 B20R2.15501 O=c1[nH]cc(cc1F)SCCOCc2ccccc2 62a_100000234347_100000723523 [0,0,0,0,0,2|2,0,0]=4 1763 B20R2.15501 O=c1[nH]cc(cc1F)SCCOCc2ccccc2 62a_100000723523_100000234347 [0,0,0,0,0,2|2,0,0]=4 1764 B20R2.15501 O=c1[nH]cc(cc1F)SCCSCc2ccccc2 62a_100000723523_200011297719 [0,0,0,0,0,2|2,0,0]=4 1765 B20R2.15501 O=c1[nH]cc(cc1F)SCCSCc2ccccc2 62a_200011297719_100000723523 [0,0,0,0,0,2|2,0,0]=4 1766 B20R2.15501 O=c1[nH]cc(cc1O)C=CCOCc2ccccc2 271570a_200011106559_100009814561 [0,0,0,0,0,2|1,0,1]=4 1767 B20R2.15501 O=c1[nH]cc(cc1O)SCCCCc2ccccc2 62a_100000701786_100009814561 [0,0,0,0,0,2|1,0,0]=3 1768 B20R2.15501 O=c1[nH]cc(cc1O)SCCCCc2ccncc2 62a_100020630000_100009814561 [0,0,0,0,0,2|2,0,0]=4 1769 B20R2.15501 O=c1[nH]cc(cc1O)SCCCOc2ccccc2 62a_100000199009_100009814561 [0,0,0,0,0,2|1,0,0]=3 1770 B20R2.15501 O=c1[nH]cc(cc1O)SCCCSc2ccccc2 62a_200011203293_100009814561 [0,0,0,0,0,2|1,0,0]=3 1771 B20R2.15501 O=c1[nH]cc(cc1O)SCCOCc2ccccc2 62a_100000234347_100009814561 [0,0,0,0,0,2|1,0,0]=3 1772 B20R2.15501 O=c1[nH]cc(cc1O)SCCSCc2ccccc2 62a_200011297719_100009814561 [0,0,0,0,0,2|1,0,0]=3 1773 B20R2.15501 Oc1cc(ncc1F)SCCCCc2ccccc2 62a_100000701786_100009854642 [0,0,0,0,0,2|2,0,0]=4 1774 B20R2.15501 Oc1cc(ncc1F)SCCCCc2ccccc2 62a_100009854642_100000701786 [0,0,0,0,0,2|2,0,0]=4 1775 B20R2.15501 Oc1cc(ncc1F)SCCCOc2ccccc2 62a_100000199009_100009854642 [0,0,0,0,0,2|2,0,0]=4 1776 B20R2.15501 Oc1cc(ncc1F)SCCCOc2ccccc2 62a_100009854642_100000199009 [0,0,0,0,0,2|2,0,0]=4 1777 B20R2.15501 Oc1cc(ncc1F)SCCCSc2ccccc2 62a_100009854642_200011203293 [0,0,0,0,0,2|2,0,0]=4 1778 B20R2.15501 Oc1cc(ncc1F)SCCCSc2ccccc2 62a_200011203293_100009854642 [0,0,0,0,0,2|2,0,0]=4 1779 B20R2.15501 Oc1cc(ncc1F)SCCOCc2ccccc2 62a_100000234347_100009854642 [0,0,0,0,0,2|2,0,0]=4 1780 B20R2.15501 Oc1cc(ncc1F)SCCOCc2ccccc2 62a_100009854642_100000234347 [0,0,0,0,0,2|2,0,0]=4 1781 B20R2.15501 Oc1cc(ncc1F)SCCSCc2ccccc2 62a_100009854642_200011297719 [0,0,0,0,0,2|2,0,0]=4 1782 B20R2.15501 Oc1cc(ncc1F)SCCSCc2ccccc2 62a_200011297719_100009854642 [0,0,0,0,0,2|2,0,0]=4