0 B13R1.337 C=C(Br)CCOCc1ccccc1 34a_100009813270_100015291786 [0,0,0,0,0,0|3,0,0]=3 1 B13R1.337 C=C(Br)CCOCc1ccccn1 34a_100009813270_100000721315 [0,0,0,0,0,0|4,0,0]=4 2 B13R1.337 C=C(Br)CCOCc1cccnc1 34a_100009813270_100000733263 [0,0,0,0,0,0|4,0,0]=4 3 B13R1.337 C=C(C)CCNCc1ccccc1 2230a_100015324214_100000730704 [0,0,0,0,0,0|3,0,0]=3 4 B13R1.337 C=C(C)CCNCc1ccccc1 34a_100015324214_100000730704 [0,0,0,0,0,0|3,0,0]=3 5 B13R1.337 C=C(C)CCOCc1ccccc1 34a_100000210790_100000730704 [0,0,0,0,0,0|3,0,0]=3 6 B13R1.337 C=C(C)CCOCc1ccccc1 34a_100000764851_100015291786 [0,0,0,0,0,0|3,0,0]=3 7 B13R1.337 C=C(C)CCOCc1ccccc1 7a_100000210790_100000730704 [0,0,0,0,0,0|3,0,0]=3 8 B13R1.337 C=C(C)CCOCc1ccccn1 34a_100000764851_100000721315 [0,0,0,0,0,0|4,0,0]=4 9 B13R1.337 C=C(C)CCOCc1cccnc1 34a_100000764851_100000733263 [0,0,0,0,0,0|4,0,0]=4 10 B13R1.337 C=C(C)CCSCc1ccccc1 62a_100000211182_100000730704 [0,0,0,0,0,0|3,0,0]=3 11 B13R1.337 C=C(C)CCSCc1ccccc1 62a_100000730704_100015291786 [0,0,0,0,0,0|3,0,0]=3 12 B13R1.337 C=C(C)CCSCc1ccccn1 62a_100000721315_100000730704 [0,0,0,0,0,0|4,0,0]=4 13 B13R1.337 C=C(C)CCSCc1ccccn1 62a_100000730704_100000721315 [0,0,0,0,0,0|4,0,0]=4 14 B13R1.337 C=C(C)CCSCc1cccnc1 62a_100000730704_100000741622 [0,0,0,0,0,0|4,0,0]=4 15 B13R1.337 C=C(C)CCSCc1cccnc1 62a_100000741622_100000730704 [0,0,0,0,0,0|4,0,0]=4 16 B13R1.337 C=C(C)CCSCc1ccncc1 62a_100000730704_100015193705 [0,0,0,0,0,0|4,0,0]=4 17 B13R1.337 C=C(C)CCSCc1ccncc1 62a_100015193705_100000730704 [0,0,0,0,0,0|4,0,0]=4 18 B13R1.337 C=C(C)CNCCc1ccccc1 2230a_100000106460_100000748629 [0,0,0,0,0,0|3,0,0]=3 19 B13R1.337 C=C(C)CNCCc1ccccc1 34a_100000106460_100000748629 [0,0,0,0,0,0|3,0,0]=3 20 B13R1.337 C=C(C)CNCCc1cccnc1 2230a_100000736294_100000748629 [0,0,0,0,0,0|4,0,0]=4 21 B13R1.337 C=C(C)COCCc1ccccc1 34a_100000210245_100000765856 [0,0,0,0,0,0|3,0,0]=3 22 B13R1.337 C=C(C)COCCc1ccccc1 34a_100000210268_100000748629 [0,0,0,0,0,0|3,0,0]=3 23 B13R1.337 C=C(C)COCCc1ccccc1 7a_100000210268_100000748629 [0,0,0,0,0,0|3,0,0]=3 24 B13R1.337 C=C(C)COCCc1ccccn1 34a_100000210271_100000748629 [0,0,0,0,0,0|4,0,0]=4 25 B13R1.337 C=C(C)COCCc1cccnc1 34a_100011217484_100000748629 [0,0,0,0,0,0|4,0,0]=4 26 B13R1.337 C=C(C)COCCc1ccncc1 34a_100011216225_100000748629 [0,0,0,0,0,0|4,0,0]=4 27 B13R1.337 C=C(C)CSCCc1ccccc1 62a_100000748629_100011218657 [0,0,0,0,0,0|3,0,0]=3 28 B13R1.337 C=C(C)CSCCc1ccccc1 62a_100000765856_100000211660 [0,0,0,0,0,0|3,0,0]=3 29 B13R1.337 C=C(C)CSCCc1ccccn1 62a_100000748629_100015183660 [0,0,0,0,0,0|4,0,0]=4 30 B13R1.337 C=C(C)CSCCc1ccccn1 62a_100015183660_100000211660 [0,0,0,0,0,0|4,0,0]=4 31 B13R1.337 C=C(C)CSCCc1cccnc1 62a_100000748629_200011713674 [0,0,0,0,0,0|4,0,0]=4 32 B13R1.337 C=C(C)CSCCc1cccnc1 62a_200011713674_100000211660 [0,0,0,0,0,0|4,0,0]=4 33 B13R1.337 C=C(C)CSCCc1ccncc1 62a_100000723409_100000211660 [0,0,0,0,0,0|4,0,0]=4 34 B13R1.337 C=C(C)CSCCc1ccncc1 62a_100000748629_100000723409 [0,0,0,0,0,0|4,0,0]=4 35 B13R1.337 C=C(C)CSCSc1ccccc1 62a_100000748629_100011218342 [0,0,0,0,0,0|4,0,0]=4 36 B13R1.337 C=C(C)CSCSc1ccccc1 62a_100011218342_100000211660 [0,0,0,0,0,0|4,0,0]=4 37 B13R1.337 C=C(F)CNCCc1ccccc1 2230a_100000106460_100009893438 [0,0,0,0,0,0|3,0,0]=3 38 B13R1.337 C=C(F)CNCCc1ccccc1 34a_100000106460_100009893438 [0,0,0,0,0,0|3,0,0]=3 39 B13R1.337 C=C(F)CNCCc1cccnc1 2230a_100000736294_100009893438 [0,0,0,0,0,0|4,0,0]=4 40 B13R1.337 C=C(F)COCCc1ccccc1 34a_100000210268_100009893438 [0,0,0,0,0,0|3,0,0]=3 41 B13R1.337 C=C(F)COCCc1ccccc1 34a_200010262243_100000765856 [0,0,0,0,0,0|3,0,0]=3 42 B13R1.337 C=C(F)COCCc1ccccc1 7a_100000210268_100000042424 [0,0,0,0,0,0|3,0,0]=3 43 B13R1.337 C=C(F)COCCc1ccccn1 34a_100000210271_100009893438 [0,0,0,0,0,0|4,0,0]=4 44 B13R1.337 C=C(F)COCCc1cccnc1 34a_100011217484_100009893438 [0,0,0,0,0,0|4,0,0]=4 45 B13R1.337 C=C(F)COCCc1ccncc1 34a_100011216225_100009893438 [0,0,0,0,0,0|4,0,0]=4 46 B13R1.337 C=C(F)CSCCc1ccccc1 62a_100000042424_100011218657 [0,0,0,0,0,0|3,0,0]=3 47 B13R1.337 C=C(F)CSCCc1ccccc1 62a_100000765856_100000042424 [0,0,0,0,0,0|3,0,0]=3 48 B13R1.337 C=C(F)CSCCc1ccccn1 62a_100000042424_100015183660 [0,0,0,0,0,0|4,0,0]=4 49 B13R1.337 C=C(F)CSCCc1ccccn1 62a_100015183660_100000042424 [0,0,0,0,0,0|4,0,0]=4 50 B13R1.337 C=C(F)CSCCc1cccnc1 62a_100000042424_200011713674 [0,0,0,0,0,0|4,0,0]=4 51 B13R1.337 C=C(F)CSCCc1cccnc1 62a_200011713674_100000042424 [0,0,0,0,0,0|4,0,0]=4 52 B13R1.337 C=C(F)CSCCc1ccncc1 62a_100000042424_100000723409 [0,0,0,0,0,0|4,0,0]=4 53 B13R1.337 C=C(F)CSCCc1ccncc1 62a_100000723409_100000042424 [0,0,0,0,0,0|4,0,0]=4 54 B13R1.337 C=C(F)CSCSc1ccccc1 62a_100000042424_100011218342 [0,0,0,0,0,0|4,0,0]=4 55 B13R1.337 C=C(F)CSCSc1ccccc1 62a_100011218342_100000042424 [0,0,0,0,0,0|4,0,0]=4 56 B13R1.337 CC(=CCCNc1ccccc1)C 34a_100000106764_100011217483 [0,0,0,0,0,0|3,0,1]=4 57 B13R1.337 CC(=CCCOc1ccccc1)C 34a_100000210340_100011217483 [0,0,0,0,0,0|3,0,1]=4 58 B13R1.337 CC(=CCCOc1ccccc1)C 7a_100000210340_100011217483 [0,0,0,0,0,0|3,0,1]=4 59 B13R1.337 CC(=CCCSc1ccccc1)C 62a_100000719477_100011217483 [0,0,0,0,0,0|3,0,1]=4 60 B13R1.337 CC(=CCCSc1ccccc1)C 62a_100011217483_100000041952 [0,0,0,0,0,0|3,0,1]=4 61 B13R1.337 CC(=CCNCc1ccccc1)C 2230a_100015324214_100000761012 [0,0,0,0,0,0|3,0,1]=4 62 B13R1.337 CC(=CCNCc1ccccc1)C 270004a_100000718196_100015611070 [0,0,0,0,0,0|3,0,1]=4 63 B13R1.337 CC(=CCNCc1ccccc1)C 34a_100000718196_100015291786 [0,0,0,0,0,0|3,0,1]=4 64 B13R1.337 CC(=CCNCc1ccccc1)C 34a_100015324214_100000761012 [0,0,0,0,0,0|3,0,1]=4 65 B13R1.337 CC(=CCOCc1ccccc1)C 34a_100000210790_100000761012 [0,0,0,0,0,0|3,0,1]=4 66 B13R1.337 CC(=CCOCc1ccccc1)C 34a_100000753907_100015291786 [0,0,0,0,0,0|3,0,1]=4 67 B13R1.337 CC(=CCOCc1ccccc1)C 7a_100000210790_100000761012 [0,0,0,0,0,0|3,0,1]=4 68 B13R1.337 CC(=CCSCc1ccccc1)C 62a_100000211182_100000761012 [0,0,0,0,0,0|3,0,1]=4 69 B13R1.337 CC(=CCSCc1ccccc1)C 62a_100000761012_100015291786 [0,0,0,0,0,0|3,0,1]=4 70 B13R1.337 CC(=O)C=CCCc1ccccc1 1458a_100016484021_200000210301 [0,0,0,0,0,0|1,0,2]=3 71 B13R1.337 CC(=O)CCCCc1ccccc1 1458a_100000070787_100000701786 [0,0,0,0,0,0|1,0,0]=1 72 B13R1.337 CC(=O)CCCCc1ccccc1 1458a_100011215911_200000210301 [0,0,0,0,0,0|1,0,0]=1 73 B13R1.337 CC(=O)CCCCc1ccncc1 1458a_100000070787_100020630000 [0,0,0,0,0,0|2,0,0]=2 74 B13R1.337 CC(=O)CCCNc1ccccc1 34a_100000106764_100000685027 [0,0,0,0,0,0|2,0,0]=2 75 B13R1.337 CC(=O)CCCOc1ccccc1 1458a_100000070787_100000199009 [0,0,0,0,0,0|2,0,0]=2 76 B13R1.337 CC(=O)CCCOc1ccccc1 1458a_100000212059_200000210301 [0,0,0,0,0,0|2,0,0]=2 77 B13R1.337 CC(=O)CCCOc1ccccc1 34a_100000210340_100000685027 [0,0,0,0,0,0|2,0,0]=2 78 B13R1.337 CC(=O)CCCOc1ccccc1 7a_100000210340_100011215641 [0,0,0,0,0,0|2,0,0]=2 79 B13R1.337 CC(=O)CCCOc1cccnc1 34a_100000210849_100000685027 [0,0,0,0,0,0|3,0,0]=3 80 B13R1.337 CC(=O)CCCOc1cccnc1 7a_100000210849_100011215641 [0,0,0,0,0,0|3,0,0]=3 81 B13R1.337 CC(=O)CCCOc1ccncc1 34a_100000212176_100000685027 [0,0,0,0,0,0|3,0,0]=3 82 B13R1.337 CC(=O)CCCOc1ccnnc1 34a_100015204005_100000685027 [0,0,0,0,0,0|4,0,0]=4 83 B13R1.337 CC(=O)CCCOc1cncnc1 7a_100000754086_100011215641 [0,0,0,0,0,0|4,0,0]=4 84 B13R1.337 CC(=O)CCCSc1ccccc1 1458a_100000070787_200011203293 [0,0,0,0,0,0|2,0,0]=2 85 B13R1.337 CC(=O)CCCSc1ccccc1 1458a_100000182835_200000210301 [0,0,0,0,0,0|2,0,0]=2 86 B13R1.337 CC(=O)CCCSc1ccccc1 62a_100000719477_100011215641 [0,0,0,0,0,0|2,0,0]=2 87 B13R1.337 CC(=O)CCCSc1ccccc1 62a_100011215641_100000041952 [0,0,0,0,0,0|2,0,0]=2 88 B13R1.337 CC(=O)CCCSc1ccccn1 62a_100011215641_100011216584 [0,0,0,0,0,0|3,0,0]=3 89 B13R1.337 CC(=O)CCCSc1ccccn1 62a_100011216584_100011215641 [0,0,0,0,0,0|3,0,0]=3 90 B13R1.337 CC(=O)CCCSc1cccnc1 62a_100000210063_100011215641 [0,0,0,0,0,0|3,0,0]=3 91 B13R1.337 CC(=O)CCCSc1cccnc1 62a_100011215641_100000210063 [0,0,0,0,0,0|3,0,0]=3 92 B13R1.337 CC(=O)CCCSc1cccnn1 62a_100011215641_100016991348 [0,0,0,0,0,0|4,0,0]=4 93 B13R1.337 CC(=O)CCCSc1cccnn1 62a_100016991348_100011215641 [0,0,0,0,0,0|4,0,0]=4 94 B13R1.337 CC(=O)CCCSc1ccncc1 62a_100000728582_100011215641 [0,0,0,0,0,0|3,0,0]=3 95 B13R1.337 CC(=O)CCCSc1ccncc1 62a_100011215641_100000728582 [0,0,0,0,0,0|3,0,0]=3 96 B13R1.337 CC(=O)CCCSc1ccncn1 62a_100000703185_100011215641 [0,0,0,0,0,0|4,0,0]=4 97 B13R1.337 CC(=O)CCCSc1ccncn1 62a_100011215641_100000703185 [0,0,0,0,0,0|4,0,0]=4 98 B13R1.337 CC(=O)CCCSc1ccnnc1 62a_100000732662_100011215641 [0,0,0,0,0,0|4,0,0]=4 99 B13R1.337 CC(=O)CCCSc1ccnnc1 62a_100011215641_100000732662 [0,0,0,0,0,0|4,0,0]=4 100 B13R1.337 CC(=O)CCCSc1cnccn1 62a_100000211759_100011215641 [0,0,0,0,0,0|4,0,0]=4 101 B13R1.337 CC(=O)CCCSc1cnccn1 62a_100011215641_100000211759 [0,0,0,0,0,0|4,0,0]=4 102 B13R1.337 CC(=O)CCCSc1cncnc1 62a_100011206942_100011215641 [0,0,0,0,0,0|4,0,0]=4 103 B13R1.337 CC(=O)CCCSc1cncnc1 62a_100011215641_100011206942 [0,0,0,0,0,0|4,0,0]=4 104 B13R1.337 CC(=O)CCCSc1ncccn1 62a_100000211032_100011215641 [0,0,0,0,0,0|4,0,0]=4 105 B13R1.337 CC(=O)CCCSc1ncccn1 62a_100011215641_100000211032 [0,0,0,0,0,0|4,0,0]=4 106 B13R1.337 CC(=O)CCOCc1ccccc1 1458a_100000070787_100000234347 [0,0,0,0,0,0|2,0,0]=2 107 B13R1.337 CC(=O)CCOCc1ccccc1 1458a_100000743319_200000210301 [0,0,0,0,0,0|2,0,0]=2 108 B13R1.337 CC(=O)CCOCc1ccccc1 34a_100000759926_100015291786 [0,0,0,0,0,0|2,0,0]=2 109 B13R1.337 CC(=O)CCOCc1ccccc1 7a_100000210790_100000053229 [0,0,0,0,0,0|2,0,0]=2 110 B13R1.337 CC(=O)CCOCc1ccccc1 7a_100000759926_100000211182 [0,0,0,0,0,0|2,0,0]=2 111 B13R1.337 CC(=O)CCOCc1ccccn1 34a_100000759926_100000721315 [0,0,0,0,0,0|3,0,0]=3 112 B13R1.337 CC(=O)CCOCc1ccccn1 7a_100000759926_100000721315 [0,0,0,0,0,0|3,0,0]=3 113 B13R1.337 CC(=O)CCOCc1cccnc1 34a_100000759926_100000733263 [0,0,0,0,0,0|3,0,0]=3 114 B13R1.337 CC(=O)CCOCc1cccnc1 7a_100000759926_100000741622 [0,0,0,0,0,0|3,0,0]=3 115 B13R1.337 CC(=O)CCOCc1cccnn1 34a_100000759926_100016990269 [0,0,0,0,0,0|4,0,0]=4 116 B13R1.337 CC(=O)CCOCc1cccnn1 7a_100000759926_100016990269 [0,0,0,0,0,0|4,0,0]=4 117 B13R1.337 CC(=O)CCOCc1ccncc1 7a_100000759926_100015193705 [0,0,0,0,0,0|3,0,0]=3 118 B13R1.337 CC(=O)CCOCc1cnccn1 34a_100000759926_100016995436 [0,0,0,0,0,0|4,0,0]=4 119 B13R1.337 CC(=O)CCOCc1cnccn1 7a_100000759926_100016995436 [0,0,0,0,0,0|4,0,0]=4 120 B13R1.337 CC(=O)CCOCc1cncnc1 34a_100000759926_100015196519 [0,0,0,0,0,0|4,0,0]=4 121 B13R1.337 CC(=O)CCOCc1cncnc1 7a_100000759926_100015196519 [0,0,0,0,0,0|4,0,0]=4 122 B13R1.337 CC(=O)CCOCc1ncccn1 34a_100000759926_100000703007 [0,0,0,0,0,0|4,0,0]=4 123 B13R1.337 CC(=O)CCOCc1ncccn1 7a_100000759926_100000703007 [0,0,0,0,0,0|4,0,0]=4 124 B13R1.337 CC(=O)CCSCc1ccccc1 1458a_100000070787_200011297719 [0,0,0,0,0,0|2,0,0]=2 125 B13R1.337 CC(=O)CCSCc1ccccc1 1458a_100000173759_200000210301 [0,0,0,0,0,0|2,0,0]=2 126 B13R1.337 CC(=O)CCSCc1ccccc1 62a_100000053229_100015291786 [0,0,0,0,0,0|2,0,0]=2 127 B13R1.337 CC(=O)CCSCc1ccccc1 62a_100000211182_100000053229 [0,0,0,0,0,0|2,0,0]=2 128 B13R1.337 CC(=O)CCSCc1ccccn1 1458a_100000742633_200000210301 [0,0,0,0,0,0|3,0,0]=3 129 B13R1.337 CC(=O)CCSCc1ccccn1 62a_100000053229_100000721315 [0,0,0,0,0,0|3,0,0]=3 130 B13R1.337 CC(=O)CCSCc1ccccn1 62a_100000721315_100000053229 [0,0,0,0,0,0|3,0,0]=3 131 B13R1.337 CC(=O)CCSCc1cccnc1 62a_100000053229_100000741622 [0,0,0,0,0,0|3,0,0]=3 132 B13R1.337 CC(=O)CCSCc1cccnc1 62a_100000741622_100000053229 [0,0,0,0,0,0|3,0,0]=3 133 B13R1.337 CC(=O)CCSCc1cccnn1 62a_100000053229_100016990269 [0,0,0,0,0,0|4,0,0]=4 134 B13R1.337 CC(=O)CCSCc1cccnn1 62a_100016990269_100000053229 [0,0,0,0,0,0|4,0,0]=4 135 B13R1.337 CC(=O)CCSCc1ccncc1 62a_100000053229_100015193705 [0,0,0,0,0,0|3,0,0]=3 136 B13R1.337 CC(=O)CCSCc1ccncc1 62a_100015193705_100000053229 [0,0,0,0,0,0|3,0,0]=3 137 B13R1.337 CC(=O)CCSCc1cnccn1 62a_100000053229_100016995436 [0,0,0,0,0,0|4,0,0]=4 138 B13R1.337 CC(=O)CCSCc1cnccn1 62a_100016995436_100000053229 [0,0,0,0,0,0|4,0,0]=4 139 B13R1.337 CC(=O)CCSCc1cncnc1 62a_100000053229_100015196519 [0,0,0,0,0,0|4,0,0]=4 140 B13R1.337 CC(=O)CCSCc1cncnc1 62a_100015196519_100000053229 [0,0,0,0,0,0|4,0,0]=4 141 B13R1.337 CC(=O)CCSCc1ncccn1 62a_100000053229_100000703007 [0,0,0,0,0,0|4,0,0]=4 142 B13R1.337 CC(=O)CCSCc1ncccn1 62a_100000703007_100000053229 [0,0,0,0,0,0|4,0,0]=4 143 B13R1.337 CC(=O)CCSSc1ccccn1 1458a_100000068049_200000210301 [0,0,0,0,0,0|4,0,0]=4 144 B13R1.337 CC(=O)COCCc1ccccc1 34a_100000211253_100000765856 [0,0,0,0,0,0|2,0,0]=2 145 B13R1.337 CC(=O)NC/C=C/c1ccccc1 11a_100020603302_100015343762 [0,0,0,0,0,0|2,0,2]=4 146 B13R1.337 CC(=O)NC/C=C/c1ccccc1 1626a_100020603302_100015343762 [0,0,0,0,0,0|2,0,2]=4 147 B13R1.337 CC(=O)NC/C=C/c1ccccc1 240690a_100020603302_100015343762 [0,0,0,0,0,0|2,0,2]=4 148 B13R1.337 CC(=O)NC/C=C/c1ccccc1 527a_100020603302_100103153847 [0,0,0,0,0,0|2,0,2]=4 149 B13R1.337 CC(=O)NCC#Cc1ccccc1 11a_100000735379_100015343762 [0,0,0,0,0,0|2,0,2]=4 150 B13R1.337 CC(=O)NCC#Cc1ccccc1 1626a_100000735379_100015343762 [0,0,0,0,0,0|2,0,2]=4 151 B13R1.337 CC(=O)NCC#Cc1ccccc1 240690a_100000735379_100015343762 [0,0,0,0,0,0|2,0,2]=4 152 B13R1.337 CC(=O)NCC#Cc1ccccc1 527a_100000735379_100103153847 [0,0,0,0,0,0|2,0,2]=4 153 B13R1.337 CC(=O)NCCCc1ccccc1 11a_100000211184_100015343762 [0,0,0,0,0,0|2,0,0]=2 154 B13R1.337 CC(=O)NCCCc1ccccc1 1626a_100000211184_100015343762 [0,0,0,0,0,0|2,0,0]=2 155 B13R1.337 CC(=O)NCCCc1ccccc1 240690a_100000211184_100015343762 [0,0,0,0,0,0|2,0,0]=2 156 B13R1.337 CC(=O)NCCCc1ccccc1 527a_100000211184_100103153847 [0,0,0,0,0,0|2,0,0]=2 157 B13R1.337 CC(=O)NCCCc1ccccn1 11a_100000689020_100015343762 [0,0,0,0,0,0|3,0,0]=3 158 B13R1.337 CC(=O)NCCCc1ccccn1 1626a_100000689020_100015343762 [0,0,0,0,0,0|3,0,0]=3 159 B13R1.337 CC(=O)NCCCc1ccccn1 240690a_100000689020_100015343762 [0,0,0,0,0,0|3,0,0]=3 160 B13R1.337 CC(=O)NCCCc1ccccn1 527a_100000689020_100103153847 [0,0,0,0,0,0|3,0,0]=3 161 B13R1.337 CC(=O)NCCCc1cccnc1 11a_100011532358_100015343762 [0,0,0,0,0,0|3,0,0]=3 162 B13R1.337 CC(=O)NCCCc1cccnc1 240690a_100011532358_100015343762 [0,0,0,0,0,0|3,0,0]=3 163 B13R1.337 CC(=O)NCCCc1ccncc1 1626a_100011275580_100015343762 [0,0,0,0,0,0|3,0,0]=3 164 B13R1.337 CC(=O)NCCCc1ccncc1 240690a_100011275580_100015343762 [0,0,0,0,0,0|3,0,0]=3 165 B13R1.337 CC(=O)NCCCc1ccncc1 527a_100011275580_100103153847 [0,0,0,0,0,0|3,0,0]=3 166 B13R1.337 CC(=O)NCCOc1ccccc1 11a_100000174943_100015343762 [0,0,0,0,0,0|3,0,0]=3 167 B13R1.337 CC(=O)NCCOc1ccccc1 1626a_100000174943_100015343762 [0,0,0,0,0,0|3,0,0]=3 168 B13R1.337 CC(=O)NCCOc1ccccc1 240690a_100000174943_100015343762 [0,0,0,0,0,0|3,0,0]=3 169 B13R1.337 CC(=O)NCCOc1ccccc1 527a_100000174943_100103153847 [0,0,0,0,0,0|3,0,0]=3 170 B13R1.337 CC(=O)NCCOc1ccccc1 7a_100000210340_100000189650 [0,0,0,0,0,0|3,0,0]=3 171 B13R1.337 CC(=O)NCCOc1ccccn1 11a_106741647558_100015343762 [0,0,0,0,0,0|4,0,0]=4 172 B13R1.337 CC(=O)NCCOc1ccccn1 1626a_106741647558_100015343762 [0,0,0,0,0,0|4,0,0]=4 173 B13R1.337 CC(=O)NCCOc1ccccn1 240690a_106741647558_100015343762 [0,0,0,0,0,0|4,0,0]=4 174 B13R1.337 CC(=O)NCCOc1ccccn1 527a_106741647558_100103153847 [0,0,0,0,0,0|4,0,0]=4 175 B13R1.337 CC(=O)NCCOc1cccnc1 11a_100000754688_100015343762 [0,0,0,0,0,0|4,0,0]=4 176 B13R1.337 CC(=O)NCCOc1cccnc1 240690a_100000754688_100015343762 [0,0,0,0,0,0|4,0,0]=4 177 B13R1.337 CC(=O)NCCOc1cccnc1 527a_100000754688_100103153847 [0,0,0,0,0,0|4,0,0]=4 178 B13R1.337 CC(=O)NCCOc1cccnc1 7a_100000210849_100000189650 [0,0,0,0,0,0|4,0,0]=4 179 B13R1.337 CC(=O)NCCOc1ccncc1 11a_100025717301_100015343762 [0,0,0,0,0,0|4,0,0]=4 180 B13R1.337 CC(=O)NCCOc1ccncc1 240690a_100025717301_100015343762 [0,0,0,0,0,0|4,0,0]=4 181 B13R1.337 CC(=O)NCCOc1ccncc1 527a_100025717301_100103153847 [0,0,0,0,0,0|4,0,0]=4 182 B13R1.337 CC(=O)NCCSc1ccccc1 240690a_100000189519_100015343762 [0,0,0,0,0,0|3,0,0]=3 183 B13R1.337 CC(=O)NCCSc1ccccc1 527a_100000189519_100103153847 [0,0,0,0,0,0|3,0,0]=3 184 B13R1.337 CC(=O)NCCSc1ccccc1 62a_100000189650_100000041952 [0,0,0,0,0,0|3,0,0]=3 185 B13R1.337 CC(=O)NCCSc1ccccc1 62a_100000719477_100000189650 [0,0,0,0,0,0|3,0,0]=3 186 B13R1.337 CC(=O)NCCSc1ccccn1 62a_100000189650_100011216584 [0,0,0,0,0,0|4,0,0]=4 187 B13R1.337 CC(=O)NCCSc1ccccn1 62a_100011216584_100000189650 [0,0,0,0,0,0|4,0,0]=4 188 B13R1.337 CC(=O)NCCSc1cccnc1 62a_100000189650_100000210063 [0,0,0,0,0,0|4,0,0]=4 189 B13R1.337 CC(=O)NCCSc1cccnc1 62a_100000210063_100000189650 [0,0,0,0,0,0|4,0,0]=4 190 B13R1.337 CC(=O)NCCSc1ccncc1 62a_100000189650_100000728582 [0,0,0,0,0,0|4,0,0]=4 191 B13R1.337 CC(=O)NCCSc1ccncc1 62a_100000728582_100000189650 [0,0,0,0,0,0|4,0,0]=4 192 B13R1.337 CC(=O)NN=CCc1ccccc1 4a_100000189765_100000209964 [0,0,0,0,0,0|3,0,1]=4 193 B13R1.337 CC(=O)NNCCc1ccccc1 22a_100000740470_100000070787 [0,0,0,0,0,0|3,0,0]=3 194 B13R1.337 CC(=O)OCC=Cc1ccccc1 271570a_200000047263_100000210277 [0,0,0,0,0,0|2,0,2]=4 195 B13R1.337 CC(=O)OCCNc1ccccc1 34a_100000106764_100009814007 [0,0,0,0,0,0|3,0,0]=3 196 B13R1.337 CC(=O)OCCOc1ccccc1 34a_100000210340_100009814007 [0,0,0,0,0,0|3,0,0]=3 197 B13R1.337 CC(=O)OCCOc1ccccc1 7a_100000210340_100009814007 [0,0,0,0,0,0|3,0,0]=3 198 B13R1.337 CC(=O)OCCOc1cccnc1 34a_100000210849_100009814007 [0,0,0,0,0,0|4,0,0]=4 199 B13R1.337 CC(=O)OCCOc1cccnc1 7a_100000210849_100009814007 [0,0,0,0,0,0|4,0,0]=4 200 B13R1.337 CC(=O)OCCOc1ccncc1 34a_100000212176_100009814007 [0,0,0,0,0,0|4,0,0]=4 201 B13R1.337 CC(=O)OCCSc1ccccc1 62a_100000719477_100009814007 [0,0,0,0,0,0|3,0,0]=3 202 B13R1.337 CC(=O)OCCSc1ccccc1 62a_100009814007_100000041952 [0,0,0,0,0,0|3,0,0]=3 203 B13R1.337 CC(=O)OCCSc1ccccn1 62a_100009814007_100011216584 [0,0,0,0,0,0|4,0,0]=4 204 B13R1.337 CC(=O)OCCSc1ccccn1 62a_100011216584_100009814007 [0,0,0,0,0,0|4,0,0]=4 205 B13R1.337 CC(=O)OCCSc1cccnc1 62a_100000210063_100009814007 [0,0,0,0,0,0|4,0,0]=4 206 B13R1.337 CC(=O)OCCSc1cccnc1 62a_100009814007_100000210063 [0,0,0,0,0,0|4,0,0]=4 207 B13R1.337 CC(=O)OCCSc1ccncc1 62a_100000728582_100009814007 [0,0,0,0,0,0|4,0,0]=4 208 B13R1.337 CC(=O)OCCSc1ccncc1 62a_100009814007_100000728582 [0,0,0,0,0,0|4,0,0]=4 209 B13R1.337 CC(=O)OCNCc1ccccc1 34a_100015324214_100009813279 [0,0,0,0,0,0|3,0,0]=3 210 B13R1.337 CC(=O)OCOCc1ccccc1 34a_100000210790_100009813279 [0,0,0,0,0,0|3,0,0]=3 211 B13R1.337 CC(=O)OCSCc1ccccc1 62a_100000076356_100015291786 [0,0,0,0,0,0|3,0,0]=3 212 B13R1.337 CC(=O)OCSCc1ccccc1 62a_100000211182_100000076356 [0,0,0,0,0,0|3,0,0]=3 213 B13R1.337 CC(=O)OCSCc1ccccn1 62a_100000076356_100000721315 [0,0,0,0,0,0|4,0,0]=4 214 B13R1.337 CC(=O)OCSCc1ccccn1 62a_100000721315_100000076356 [0,0,0,0,0,0|4,0,0]=4 215 B13R1.337 CC(=O)OCSCc1cccnc1 62a_100000076356_100000741622 [0,0,0,0,0,0|4,0,0]=4 216 B13R1.337 CC(=O)OCSCc1cccnc1 62a_100000741622_100000076356 [0,0,0,0,0,0|4,0,0]=4 217 B13R1.337 CC(=O)OCSCc1ccncc1 62a_100000076356_100015193705 [0,0,0,0,0,0|4,0,0]=4 218 B13R1.337 CC(=O)OCSCc1ccncc1 62a_100015193705_100000076356 [0,0,0,0,0,0|4,0,0]=4 219 B13R1.337 CC(Br)CCOCc1ccccc1 34a_100009893172_100015291786 [0,0,0,0,0,0|3,0,1]=4 220 B13R1.337 CC(Br)COCCc1ccccc1 34a_100012180447_100000765856 [0,0,0,0,0,0|3,0,1]=4 221 B13R1.337 CC(C)CCCNc1ccccc1 34a_100000106764_100011214892 [0,0,0,0,0,0|3,0,1]=4 222 B13R1.337 CC(C)CCCOc1ccccc1 34a_100000210340_100011214892 [0,0,0,0,0,0|3,0,1]=4 223 B13R1.337 CC(C)CCCOc1ccccc1 7a_100000210340_100011214892 [0,0,0,0,0,0|3,0,1]=4 224 B13R1.337 CC(C)CCCSc1ccccc1 62a_100000719477_100011214892 [0,0,0,0,0,0|3,0,1]=4 225 B13R1.337 CC(C)CCCSc1ccccc1 62a_100011214892_100000041952 [0,0,0,0,0,0|3,0,1]=4 226 B13R1.337 CC(C)CCNCc1ccccc1 207a_100000210545_100015611070 [0,0,0,0,0,0|3,0,1]=4 227 B13R1.337 CC(C)CCNCc1ccccc1 2230a_100015324214_100000210312 [0,0,0,0,0,0|3,0,1]=4 228 B13R1.337 CC(C)CCNCc1ccccc1 269862a_100015324214_100000185833 [0,0,0,0,0,0|3,0,1]=4 229 B13R1.337 CC(C)CCNCc1ccccc1 270004a_100000210545_100015611070 [0,0,0,0,0,0|3,0,1]=4 230 B13R1.337 CC(C)CCNCc1ccccc1 34a_100015324214_100000210312 [0,0,0,0,0,0|3,0,1]=4 231 B13R1.337 CC(C)CCOCc1ccccc1 34a_100000210254_100015291786 [0,0,0,0,0,0|3,0,1]=4 232 B13R1.337 CC(C)CCOCc1ccccc1 34a_100000210790_100000210312 [0,0,0,0,0,0|3,0,1]=4 233 B13R1.337 CC(C)CCOCc1ccccc1 7a_100000210254_100000211182 [0,0,0,0,0,0|3,0,1]=4 234 B13R1.337 CC(C)CCOCc1ccccc1 7a_100000210790_100000210626 [0,0,0,0,0,0|3,0,1]=4 235 B13R1.337 CC(C)CCSCc1ccccc1 62a_100000210312_100015291786 [0,0,0,0,0,0|3,0,1]=4 236 B13R1.337 CC(C)CCSCc1ccccc1 62a_100000211182_100000210312 [0,0,0,0,0,0|3,0,1]=4 237 B13R1.337 CC(C)CNCCc1ccccc1 2230a_100000106460_100000210760 [0,0,0,0,0,0|3,0,1]=4 238 B13R1.337 CC(C)CNCCc1ccccc1 2230a_100000210953_100000765856 [0,0,0,0,0,0|3,0,1]=4 239 B13R1.337 CC(C)CNCCc1ccccc1 270004a_100000106460_100000210432 [0,0,0,0,0,0|3,0,1]=4 240 B13R1.337 CC(C)CNCCc1ccccc1 34a_100000106460_100000210624 [0,0,0,0,0,0|3,0,1]=4 241 B13R1.337 CC(C)CNCCc1ccccc1 34a_100000210953_100000765856 [0,0,0,0,0,0|3,0,1]=4 242 B13R1.337 CC(C)COCCc1ccccc1 34a_100000210257_100000765856 [0,0,0,0,0,0|3,0,1]=4 243 B13R1.337 CC(C)COCCc1ccccc1 34a_100000210268_100000210624 [0,0,0,0,0,0|3,0,1]=4 244 B13R1.337 CC(C)COCCc1ccccc1 7a_100000210268_100000210760 [0,0,0,0,0,0|3,0,1]=4 245 B13R1.337 CC(C)CSCCc1ccccc1 62a_100000210624_100011218657 [0,0,0,0,0,0|3,0,1]=4 246 B13R1.337 CC(C)CSCCc1ccccc1 62a_100000765856_100000210760 [0,0,0,0,0,0|3,0,1]=4 247 B13R1.337 CC(C)NCCCc1ccccc1 2230a_100000211184_100000210206 [0,0,0,0,0,0|3,0,1]=4 248 B13R1.337 CC(C)NCCCc1ccccc1 2230a_100138425928_100000211621 [0,0,0,0,0,0|3,0,1]=4 249 B13R1.337 CC(C)NCCCc1ccccc1 34a_100000211184_100000210206 [0,0,0,0,0,0|3,0,1]=4 250 B13R1.337 CC(C)NCCCc1ccccc1 34a_100138425928_100000211621 [0,0,0,0,0,0|3,0,1]=4 251 B13R1.337 CC(C)OCCCc1ccccc1 34a_100000210828_100000210206 [0,0,0,0,0,0|3,0,1]=4 252 B13R1.337 CC(C)OCCCc1ccccc1 34a_100000212225_100000211621 [0,0,0,0,0,0|3,0,1]=4 253 B13R1.337 CC(C)OCCCc1ccccc1 7a_100000210828_100000210206 [0,0,0,0,0,0|3,0,1]=4 254 B13R1.337 CC(C)SCCCc1ccccc1 62a_100000210206_100000211621 [0,0,0,0,0,0|3,0,1]=4 255 B13R1.337 CC(C)SCCCc1ccccc1 62a_100000211621_100000210206 [0,0,0,0,0,0|3,0,1]=4 256 B13R1.337 CC(F)COCCc1ccccc1 34a_100015925927_100000765856 [0,0,0,0,0,0|3,0,1]=4 257 B13R1.337 CC(O)CCCNc1ccccc1 34a_100000106764_200000718107 [0,0,0,0,0,0|2,0,1]=3 258 B13R1.337 CC(O)CCCOc1ccccc1 34a_100000210340_200000718107 [0,0,0,0,0,0|2,0,1]=3 259 B13R1.337 CC(O)CCCOc1ccccc1 7a_100000210340_200000718107 [0,0,0,0,0,0|2,0,1]=3 260 B13R1.337 CC(O)CCCOc1cccnc1 34a_100000210849_200000718107 [0,0,0,0,0,0|3,0,1]=4 261 B13R1.337 CC(O)CCCOc1cccnc1 7a_100000210849_200000718107 [0,0,0,0,0,0|3,0,1]=4 262 B13R1.337 CC(O)CCCOc1ccncc1 34a_100000212176_200000718107 [0,0,0,0,0,0|3,0,1]=4 263 B13R1.337 CC(O)CCCSc1ccccc1 62a_100000719477_200000718107 [0,0,0,0,0,0|2,0,1]=3 264 B13R1.337 CC(O)CCCSc1ccccc1 62a_200000718107_100000041952 [0,0,0,0,0,0|2,0,1]=3 265 B13R1.337 CC(O)CCCSc1ccccn1 62a_100011216584_200000718107 [0,0,0,0,0,0|3,0,1]=4 266 B13R1.337 CC(O)CCCSc1ccccn1 62a_200000718107_100011216584 [0,0,0,0,0,0|3,0,1]=4 267 B13R1.337 CC(O)CCCSc1cccnc1 62a_100000210063_200000718107 [0,0,0,0,0,0|3,0,1]=4 268 B13R1.337 CC(O)CCCSc1cccnc1 62a_200000718107_100000210063 [0,0,0,0,0,0|3,0,1]=4 269 B13R1.337 CC(O)CCCSc1ccncc1 62a_100000728582_200000718107 [0,0,0,0,0,0|3,0,1]=4 270 B13R1.337 CC(O)CCCSc1ccncc1 62a_200000718107_100000728582 [0,0,0,0,0,0|3,0,1]=4 271 B13R1.337 CC(O)CCNCc1ccccc1 207a_200000755665_100015611070 [0,0,0,0,0,0|2,0,1]=3 272 B13R1.337 CC(O)CCNCc1ccccc1 2230a_100015324214_100012276601 [0,0,0,0,0,0|2,0,1]=3 273 B13R1.337 CC(O)CCNCc1ccccc1 2230a_200000755665_100015291786 [0,0,0,0,0,0|2,0,1]=3 274 B13R1.337 CC(O)CCNCc1ccccc1 270004a_200000755665_100015611070 [0,0,0,0,0,0|2,0,1]=3 275 B13R1.337 CC(O)CCNCc1ccccc1 34a_100015324214_100012276601 [0,0,0,0,0,0|2,0,1]=3 276 B13R1.337 CC(O)CCNCc1ccccn1 207a_200000755665_100000209966 [0,0,0,0,0,0|3,0,1]=4 277 B13R1.337 CC(O)CCNCc1ccccn1 2230a_200000755665_100000721315 [0,0,0,0,0,0|3,0,1]=4 278 B13R1.337 CC(O)CCNCc1ccccn1 270004a_200000755665_100000209966 [0,0,0,0,0,0|3,0,1]=4 279 B13R1.337 CC(O)CCNCc1cccnc1 207a_200000755665_100000209961 [0,0,0,0,0,0|3,0,1]=4 280 B13R1.337 CC(O)CCNCc1cccnc1 2230a_200000755665_100000741622 [0,0,0,0,0,0|3,0,1]=4 281 B13R1.337 CC(O)CCNCc1cccnc1 270004a_200000755665_100000209961 [0,0,0,0,0,0|3,0,1]=4 282 B13R1.337 CC(O)CCNCc1ccncc1 207a_200000755665_100000186114 [0,0,0,0,0,0|3,0,1]=4 283 B13R1.337 CC(O)CCNCc1ccncc1 2230a_200000755665_100015193705 [0,0,0,0,0,0|3,0,1]=4 284 B13R1.337 CC(O)CCOCc1ccccc1 34a_100000210790_100012276601 [0,0,0,0,0,0|2,0,1]=3 285 B13R1.337 CC(O)CCOCc1ccccc1 7a_100000210790_100012276601 [0,0,0,0,0,0|2,0,1]=3 286 B13R1.337 CC(O)CCSCc1ccccc1 62a_100000211182_100012276601 [0,0,0,0,0,0|2,0,1]=3 287 B13R1.337 CC(O)CCSCc1ccccc1 62a_100012276601_100015291786 [0,0,0,0,0,0|2,0,1]=3 288 B13R1.337 CC(O)CCSCc1ccccn1 62a_100000721315_100012276601 [0,0,0,0,0,0|3,0,1]=4 289 B13R1.337 CC(O)CCSCc1ccccn1 62a_100012276601_100000721315 [0,0,0,0,0,0|3,0,1]=4 290 B13R1.337 CC(O)CCSCc1cccnc1 62a_100000741622_100012276601 [0,0,0,0,0,0|3,0,1]=4 291 B13R1.337 CC(O)CCSCc1cccnc1 62a_100012276601_100000741622 [0,0,0,0,0,0|3,0,1]=4 292 B13R1.337 CC(O)CCSCc1ccncc1 62a_100012276601_100015193705 [0,0,0,0,0,0|3,0,1]=4 293 B13R1.337 CC(O)CCSCc1ccncc1 62a_100015193705_100012276601 [0,0,0,0,0,0|3,0,1]=4 294 B13R1.337 CC(O)CNCCc1ccccc1 2230a_100000106460_100011218427 [0,0,0,0,0,0|2,0,1]=3 295 B13R1.337 CC(O)CNCCc1ccccc1 2230a_100000210904_100000765856 [0,0,0,0,0,0|2,0,1]=3 296 B13R1.337 CC(O)CNCCc1ccccc1 34a_100000106460_100011218427 [0,0,0,0,0,0|2,0,1]=3 297 B13R1.337 CC(O)CNCCc1ccccc1 34a_100000210904_100000765856 [0,0,0,0,0,0|2,0,1]=3 298 B13R1.337 CC(O)CNCCc1ccccn1 2230a_100000210904_100015183660 [0,0,0,0,0,0|3,0,1]=4 299 B13R1.337 CC(O)CNCCc1cccnc1 2230a_100000210904_200011713674 [0,0,0,0,0,0|3,0,1]=4 300 B13R1.337 CC(O)CNCCc1cccnc1 2230a_100000736294_100011218427 [0,0,0,0,0,0|3,0,1]=4 301 B13R1.337 CC(O)CNCCc1ccncc1 2230a_100000210904_100000723409 [0,0,0,0,0,0|3,0,1]=4 302 B13R1.337 CC(O)CNCSc1ccccc1 2230a_100000210904_100011218342 [0,0,0,0,0,0|3,0,1]=4 303 B13R1.337 CC(O)COCCc1ccccc1 34a_100000210268_100011218427 [0,0,0,0,0,0|2,0,1]=3 304 B13R1.337 CC(O)COCCc1ccccc1 7a_100000210268_100011218427 [0,0,0,0,0,0|2,0,1]=3 305 B13R1.337 CC(O)COCCc1ccccn1 34a_100000210271_100011218427 [0,0,0,0,0,0|3,0,1]=4 306 B13R1.337 CC(O)COCCc1cccnc1 34a_100011217484_100011218427 [0,0,0,0,0,0|3,0,1]=4 307 B13R1.337 CC(O)COCCc1ccncc1 34a_100011216225_100011218427 [0,0,0,0,0,0|3,0,1]=4 308 B13R1.337 CC(O)CSCCc1ccccc1 62a_100000765856_100011218427 [0,0,0,0,0,0|2,0,1]=3 309 B13R1.337 CC(O)CSCCc1ccccc1 62a_100011218427_100011218657 [0,0,0,0,0,0|2,0,1]=3 310 B13R1.337 CC(O)CSCCc1ccccn1 62a_100011218427_100015183660 [0,0,0,0,0,0|3,0,1]=4 311 B13R1.337 CC(O)CSCCc1ccccn1 62a_100015183660_100011218427 [0,0,0,0,0,0|3,0,1]=4 312 B13R1.337 CC(O)CSCCc1cccnc1 62a_100011218427_200011713674 [0,0,0,0,0,0|3,0,1]=4 313 B13R1.337 CC(O)CSCCc1cccnc1 62a_200011713674_100011218427 [0,0,0,0,0,0|3,0,1]=4 314 B13R1.337 CC(O)CSCCc1ccncc1 62a_100000723409_100011218427 [0,0,0,0,0,0|3,0,1]=4 315 B13R1.337 CC(O)CSCCc1ccncc1 62a_100011218427_100000723409 [0,0,0,0,0,0|3,0,1]=4 316 B13R1.337 CC(O)CSCSc1ccccc1 62a_100011218342_100011218427 [0,0,0,0,0,0|3,0,1]=4 317 B13R1.337 CC(O)CSCSc1ccccc1 62a_100011218427_100011218342 [0,0,0,0,0,0|3,0,1]=4 318 B13R1.337 CN(C)CCCCc1ccccc1 2230a_100000741445_200000210301 [0,0,0,0,0,0|3,0,0]=3 319 B13R1.337 CN(C)CCCCc1ccccc1 2230a_100102631434_100000701786 [0,0,0,0,0,0|3,0,0]=3 320 B13R1.337 CN(C)CCCCc1ccccc1 269982a_100000741445_200000210301 [0,0,0,0,0,0|3,0,0]=3 321 B13R1.337 CN(C)CCCCc1ccccc1 269982a_100102631434_100000701786 [0,0,0,0,0,0|3,0,0]=3 322 B13R1.337 CN(C)CCCCc1ccccc1 34a_100000741445_200000210301 [0,0,0,0,0,0|3,0,0]=3 323 B13R1.337 CN(C)CCCCc1ccncc1 2230a_100102631434_100020630000 [0,0,0,0,0,0|4,0,0]=4 324 B13R1.337 CN(C)CCCCc1ccncc1 269982a_100102631434_100020630000 [0,0,0,0,0,0|4,0,0]=4 325 B13R1.337 CN(C)CCCOc1ccccc1 2230a_100000225623_200000210301 [0,0,0,0,0,0|4,0,0]=4 326 B13R1.337 CN(C)CCCOc1ccccc1 2230a_100102631434_100000199009 [0,0,0,0,0,0|4,0,0]=4 327 B13R1.337 CN(C)CCCOc1ccccc1 269982a_100000225623_200000210301 [0,0,0,0,0,0|4,0,0]=4 328 B13R1.337 CN(C)CCCOc1ccccc1 269982a_100102631434_100000199009 [0,0,0,0,0,0|4,0,0]=4 329 B13R1.337 CN(C)CCCOc1ccccc1 7a_100000210340_100000757444 [0,0,0,0,0,0|4,0,0]=4 330 B13R1.337 CN(C)CCCSc1ccccc1 2230a_100015183843_200000210301 [0,0,0,0,0,0|4,0,0]=4 331 B13R1.337 CN(C)CCCSc1ccccc1 2230a_100102631434_200011203293 [0,0,0,0,0,0|4,0,0]=4 332 B13R1.337 CN(C)CCCSc1ccccc1 269982a_100015183843_200000210301 [0,0,0,0,0,0|4,0,0]=4 333 B13R1.337 CN(C)CCCSc1ccccc1 269982a_100102631434_200011203293 [0,0,0,0,0,0|4,0,0]=4 334 B13R1.337 CN(C)CCCSc1ccccc1 62a_100000719477_100000757444 [0,0,0,0,0,0|4,0,0]=4 335 B13R1.337 CN(C)CCNCc1ccccc1 207a_100000210585_100015611070 [0,0,0,0,0,0|4,0,0]=4 336 B13R1.337 CN(C)CCNCc1ccccc1 270004a_100000210585_100015611070 [0,0,0,0,0,0|4,0,0]=4 337 B13R1.337 CN(C)CCOCc1ccccc1 2230a_100000687121_200000210301 [0,0,0,0,0,0|4,0,0]=4 338 B13R1.337 CN(C)CCOCc1ccccc1 2230a_100102631434_100000234347 [0,0,0,0,0,0|4,0,0]=4 339 B13R1.337 CN(C)CCOCc1ccccc1 269982a_100000687121_200000210301 [0,0,0,0,0,0|4,0,0]=4 340 B13R1.337 CN(C)CCOCc1ccccc1 269982a_100102631434_100000234347 [0,0,0,0,0,0|4,0,0]=4 341 B13R1.337 CN(C)CCOCc1ccccc1 7a_100000210790_100000755713 [0,0,0,0,0,0|4,0,0]=4 342 B13R1.337 CN(C)CCSCc1ccccc1 2230a_100102631434_200011297719 [0,0,0,0,0,0|4,0,0]=4 343 B13R1.337 CN(C)CCSCc1ccccc1 269982a_100102631434_200011297719 [0,0,0,0,0,0|4,0,0]=4 344 B13R1.337 CN(C)CCSCc1ccccc1 62a_100000211182_100000755713 [0,0,0,0,0,0|4,0,0]=4 345 B13R1.337 CN([13CH3])CCCCc1ccccc1 2230a_100000741445_200025704644 [0,0,0,0,0,0|3,0,0]=3 346 B13R1.337 CN([13CH3])CCCCc1ccccc1 269982a_100000741445_200025704644 [0,0,0,0,0,0|3,0,0]=3 347 B13R1.337 CN([13CH3])CCCCc1ccccc1 34a_100000741445_200025704644 [0,0,0,0,0,0|3,0,0]=3 348 B13R1.337 CN([13CH3])CCCOc1ccccc1 2230a_100000225623_200025704644 [0,0,0,0,0,0|4,0,0]=4 349 B13R1.337 CN([13CH3])CCCOc1ccccc1 269982a_100000225623_200025704644 [0,0,0,0,0,0|4,0,0]=4 350 B13R1.337 CN([13CH3])CCCSc1ccccc1 2230a_100015183843_200025704644 [0,0,0,0,0,0|4,0,0]=4 351 B13R1.337 CN([13CH3])CCCSc1ccccc1 269982a_100015183843_200025704644 [0,0,0,0,0,0|4,0,0]=4 352 B13R1.337 CN([13CH3])CCOCc1ccccc1 2230a_100000687121_200025704644 [0,0,0,0,0,0|4,0,0]=4 353 B13R1.337 CN([13CH3])CCOCc1ccccc1 269982a_100000687121_200025704644 [0,0,0,0,0,0|4,0,0]=4 354 B13R1.337 C[C@@H](Cl)COCCc1ccccc1 34a_100016084084_100000765856 [0,0,0,0,0,0|3,0,1]=4 355 B13R1.337 C[C@@H](N)CCOCc1ccccc1 34a_100000706166_100015291786 [0,0,0,0,0,0|3,0,1]=4 356 B13R1.337 C[C@@H](N)COCCc1ccccc1 34a_100000737577_100000765856 [0,0,0,0,0,0|3,0,1]=4 357 B13R1.337 C[C@@H](O)CNCCc1ccccc1 2230a_100000106460_100009817552 [0,0,0,0,0,0|2,0,1]=3 358 B13R1.337 C[C@@H](O)CNCCc1ccccc1 34a_100000106460_100009817552 [0,0,0,0,0,0|2,0,1]=3 359 B13R1.337 C[C@@H](O)CNCCc1cccnc1 2230a_100000736294_100009817552 [0,0,0,0,0,0|3,0,1]=4 360 B13R1.337 C[C@@H](O)COCCc1ccccc1 34a_100000210268_100009817552 [0,0,0,0,0,0|2,0,1]=3 361 B13R1.337 C[C@@H](O)COCCc1ccccc1 7a_100000210268_100009817552 [0,0,0,0,0,0|2,0,1]=3 362 B13R1.337 C[C@@H](O)COCCc1ccccn1 34a_100000210271_100009817552 [0,0,0,0,0,0|3,0,1]=4 363 B13R1.337 C[C@@H](O)COCCc1cccnc1 34a_100011217484_100009817552 [0,0,0,0,0,0|3,0,1]=4 364 B13R1.337 C[C@@H](O)COCCc1ccncc1 34a_100011216225_100009817552 [0,0,0,0,0,0|3,0,1]=4 365 B13R1.337 C[C@@H](O)CSCCc1ccccc1 62a_100000765856_100009817552 [0,0,0,0,0,0|2,0,1]=3 366 B13R1.337 C[C@@H](O)CSCCc1ccccc1 62a_100009817552_100011218657 [0,0,0,0,0,0|2,0,1]=3 367 B13R1.337 C[C@@H](O)CSCCc1ccccn1 62a_100009817552_100015183660 [0,0,0,0,0,0|3,0,1]=4 368 B13R1.337 C[C@@H](O)CSCCc1ccccn1 62a_100015183660_100009817552 [0,0,0,0,0,0|3,0,1]=4 369 B13R1.337 C[C@@H](O)CSCCc1cccnc1 62a_100009817552_200011713674 [0,0,0,0,0,0|3,0,1]=4 370 B13R1.337 C[C@@H](O)CSCCc1cccnc1 62a_200011713674_100009817552 [0,0,0,0,0,0|3,0,1]=4 371 B13R1.337 C[C@@H](O)CSCCc1ccncc1 62a_100000723409_100009817552 [0,0,0,0,0,0|3,0,1]=4 372 B13R1.337 C[C@@H](O)CSCCc1ccncc1 62a_100009817552_100000723409 [0,0,0,0,0,0|3,0,1]=4 373 B13R1.337 C[C@@H](O)CSCSc1ccccc1 62a_100009817552_100011218342 [0,0,0,0,0,0|3,0,1]=4 374 B13R1.337 C[C@@H](O)CSCSc1ccccc1 62a_100011218342_100009817552 [0,0,0,0,0,0|3,0,1]=4 375 B13R1.337 FC(=CCCNc1ccccc1)F 34a_100000106764_200009816681 [0,0,0,0,0,0|3,0,1]=4 376 B13R1.337 FC(=CCCOc1ccccc1)F 34a_100000210340_200009816681 [0,0,0,0,0,0|3,0,1]=4 377 B13R1.337 FC(=CCCOc1ccccc1)F 7a_100000210340_200009816681 [0,0,0,0,0,0|3,0,1]=4 378 B13R1.337 FC(=CCCSc1ccccc1)F 62a_100000719477_200009816681 [0,0,0,0,0,0|3,0,1]=4 379 B13R1.337 FC(=CCCSc1ccccc1)F 62a_200009816681_100000041952 [0,0,0,0,0,0|3,0,1]=4 380 B13R1.337 FC(F)CCOCc1ccccc1 34a_100103093639_100015291786 [0,0,0,0,0,0|3,0,1]=4 381 B13R1.337 FC(F)CNCCc1ccccc1 2230a_100000106460_100011934356 [0,0,0,0,0,0|3,0,1]=4 382 B13R1.337 FC(F)CNCCc1ccccc1 34a_100000106460_100011934356 [0,0,0,0,0,0|3,0,1]=4 383 B13R1.337 FC(F)CNCCc1ccccc1 34a_100000765723_100000765856 [0,0,0,0,0,0|3,0,1]=4 384 B13R1.337 FC(F)COCCc1ccccc1 34a_100000210268_100011934356 [0,0,0,0,0,0|3,0,1]=4 385 B13R1.337 FC(F)COCCc1ccccc1 34a_100000743014_100000765856 [0,0,0,0,0,0|3,0,1]=4 386 B13R1.337 FC(F)COCCc1ccccc1 7a_100000210268_100011934356 [0,0,0,0,0,0|3,0,1]=4 387 B13R1.337 FC(F)CSCCc1ccccc1 62a_100000765856_100011934356 [0,0,0,0,0,0|3,0,1]=4 388 B13R1.337 FC(F)CSCCc1ccccc1 62a_100011934356_100011218657 [0,0,0,0,0,0|3,0,1]=4 389 B13R1.337 NC(=O)CCCNc1ccccc1 34a_100000106764_100102525003 [0,0,0,0,0,0|2,0,0]=2 390 B13R1.337 NC(=O)CCCNc1cccnn1 27a_100000739312_100016991348 [0,0,0,0,0,0|4,0,0]=4 391 B13R1.337 NC(=O)CCCNc1ccncn1 27a_100000739312_100000703185 [0,0,0,0,0,0|4,0,0]=4 392 B13R1.337 NC(=O)CCCNc1cnccn1 27a_100000739312_100000211759 [0,0,0,0,0,0|4,0,0]=4 393 B13R1.337 NC(=O)CCCNc1ncccn1 27a_100000739312_100000211032 [0,0,0,0,0,0|4,0,0]=4 394 B13R1.337 NC(=O)CCCOc1ccccc1 34a_100000210340_100102525003 [0,0,0,0,0,0|2,0,0]=2 395 B13R1.337 NC(=O)CCCOc1ccccc1 7a_100000210340_100102525003 [0,0,0,0,0,0|2,0,0]=2 396 B13R1.337 NC(=O)CCCOc1cccnc1 34a_100000210849_100102525003 [0,0,0,0,0,0|3,0,0]=3 397 B13R1.337 NC(=O)CCCOc1cccnc1 7a_100000210849_100102525003 [0,0,0,0,0,0|3,0,0]=3 398 B13R1.337 NC(=O)CCCOc1ccncc1 34a_100000212176_100102525003 [0,0,0,0,0,0|3,0,0]=3 399 B13R1.337 NC(=O)CCCOc1ccnnc1 34a_100015204005_100102525003 [0,0,0,0,0,0|4,0,0]=4 400 B13R1.337 NC(=O)CCCOc1cncnc1 7a_100000754086_100102525003 [0,0,0,0,0,0|4,0,0]=4 401 B13R1.337 NC(=O)CCCSc1ccccc1 62a_100000719477_100102525003 [0,0,0,0,0,0|2,0,0]=2 402 B13R1.337 NC(=O)CCCSc1ccccc1 62a_100102525003_100000041952 [0,0,0,0,0,0|2,0,0]=2 403 B13R1.337 NC(=O)CCCSc1ccccn1 62a_100011216584_100102525003 [0,0,0,0,0,0|3,0,0]=3 404 B13R1.337 NC(=O)CCCSc1ccccn1 62a_100102525003_100011216584 [0,0,0,0,0,0|3,0,0]=3 405 B13R1.337 NC(=O)CCCSc1cccnc1 62a_100000210063_100102525003 [0,0,0,0,0,0|3,0,0]=3 406 B13R1.337 NC(=O)CCCSc1cccnc1 62a_100102525003_100000210063 [0,0,0,0,0,0|3,0,0]=3 407 B13R1.337 NC(=O)CCCSc1cccnn1 62a_100016991348_100102525003 [0,0,0,0,0,0|4,0,0]=4 408 B13R1.337 NC(=O)CCCSc1cccnn1 62a_100102525003_100016991348 [0,0,0,0,0,0|4,0,0]=4 409 B13R1.337 NC(=O)CCCSc1ccncc1 62a_100000728582_100102525003 [0,0,0,0,0,0|3,0,0]=3 410 B13R1.337 NC(=O)CCCSc1ccncc1 62a_100102525003_100000728582 [0,0,0,0,0,0|3,0,0]=3 411 B13R1.337 NC(=O)CCCSc1ccncn1 62a_100000703185_100102525003 [0,0,0,0,0,0|4,0,0]=4 412 B13R1.337 NC(=O)CCCSc1ccncn1 62a_100102525003_100000703185 [0,0,0,0,0,0|4,0,0]=4 413 B13R1.337 NC(=O)CCCSc1ccnnc1 62a_100000732662_100102525003 [0,0,0,0,0,0|4,0,0]=4 414 B13R1.337 NC(=O)CCCSc1ccnnc1 62a_100102525003_100000732662 [0,0,0,0,0,0|4,0,0]=4 415 B13R1.337 NC(=O)CCCSc1cnccn1 62a_100000211759_100102525003 [0,0,0,0,0,0|4,0,0]=4 416 B13R1.337 NC(=O)CCCSc1cnccn1 62a_100102525003_100000211759 [0,0,0,0,0,0|4,0,0]=4 417 B13R1.337 NC(=O)CCCSc1cncnc1 62a_100011206942_100102525003 [0,0,0,0,0,0|4,0,0]=4 418 B13R1.337 NC(=O)CCCSc1cncnc1 62a_100102525003_100011206942 [0,0,0,0,0,0|4,0,0]=4 419 B13R1.337 NC(=O)CCCSc1ncccn1 62a_100000211032_100102525003 [0,0,0,0,0,0|4,0,0]=4 420 B13R1.337 NC(=O)CCCSc1ncccn1 62a_100102525003_100000211032 [0,0,0,0,0,0|4,0,0]=4 421 B13R1.337 NC(=O)CCNCc1ccccc1 207a_100000740010_100015611070 [0,0,0,0,0,0|2,0,0]=2 422 B13R1.337 NC(=O)CCNCc1ccccc1 2230a_100015324214_100000744528 [0,0,0,0,0,0|2,0,0]=2 423 B13R1.337 NC(=O)CCNCc1ccccc1 34a_100015324214_100000731001 [0,0,0,0,0,0|2,0,0]=2 424 B13R1.337 NC(=O)CCNCc1ccccn1 207a_100000740010_100000209966 [0,0,0,0,0,0|3,0,0]=3 425 B13R1.337 NC(=O)CCNCc1cccnc1 207a_100000740010_100000209961 [0,0,0,0,0,0|3,0,0]=3 426 B13R1.337 NC(=O)CCNCc1cccnn1 2230a_100159270163_100000744528 [0,0,0,0,0,0|4,0,0]=4 427 B13R1.337 NC(=O)CCNCc1ccncc1 207a_100000740010_100000186114 [0,0,0,0,0,0|3,0,0]=3 428 B13R1.337 NC(=O)CCNCc1cncnc1 2230a_100011243677_100000744528 [0,0,0,0,0,0|4,0,0]=4 429 B13R1.337 NC(=O)CCOCc1ccccc1 34a_100000210790_100000731001 [0,0,0,0,0,0|2,0,0]=2 430 B13R1.337 NC(=O)CCOCc1ccccc1 34a_100000757172_100015291786 [0,0,0,0,0,0|2,0,0]=2 431 B13R1.337 NC(=O)CCOCc1ccccc1 7a_100000210790_100000744528 [0,0,0,0,0,0|2,0,0]=2 432 B13R1.337 NC(=O)CCOCc1ccccc1 7a_100000757172_100000211182 [0,0,0,0,0,0|2,0,0]=2 433 B13R1.337 NC(=O)CCOCc1ccccn1 34a_100000757172_100000721315 [0,0,0,0,0,0|3,0,0]=3 434 B13R1.337 NC(=O)CCOCc1ccccn1 7a_100000757172_100000721315 [0,0,0,0,0,0|3,0,0]=3 435 B13R1.337 NC(=O)CCOCc1cccnc1 34a_100000757172_100000733263 [0,0,0,0,0,0|3,0,0]=3 436 B13R1.337 NC(=O)CCOCc1cccnc1 7a_100000757172_100000741622 [0,0,0,0,0,0|3,0,0]=3 437 B13R1.337 NC(=O)CCOCc1cccnn1 34a_100000757172_100016990269 [0,0,0,0,0,0|4,0,0]=4 438 B13R1.337 NC(=O)CCOCc1cccnn1 7a_100000757172_100016990269 [0,0,0,0,0,0|4,0,0]=4 439 B13R1.337 NC(=O)CCOCc1ccncc1 7a_100000757172_100015193705 [0,0,0,0,0,0|3,0,0]=3 440 B13R1.337 NC(=O)CCOCc1cnccn1 34a_100000757172_100016995436 [0,0,0,0,0,0|4,0,0]=4 441 B13R1.337 NC(=O)CCOCc1cnccn1 7a_100000757172_100016995436 [0,0,0,0,0,0|4,0,0]=4 442 B13R1.337 NC(=O)CCOCc1cncnc1 34a_100000757172_100015196519 [0,0,0,0,0,0|4,0,0]=4 443 B13R1.337 NC(=O)CCOCc1cncnc1 7a_100000757172_100015196519 [0,0,0,0,0,0|4,0,0]=4 444 B13R1.337 NC(=O)CCOCc1ncccn1 34a_100000757172_100000703007 [0,0,0,0,0,0|4,0,0]=4 445 B13R1.337 NC(=O)CCOCc1ncccn1 7a_100000757172_100000703007 [0,0,0,0,0,0|4,0,0]=4 446 B13R1.337 NC(=O)CCSCc1ccccc1 62a_100000211182_100000744528 [0,0,0,0,0,0|2,0,0]=2 447 B13R1.337 NC(=O)CCSCc1ccccc1 62a_100000744528_100015291786 [0,0,0,0,0,0|2,0,0]=2 448 B13R1.337 NC(=O)CCSCc1ccccn1 62a_100000721315_100000744528 [0,0,0,0,0,0|3,0,0]=3 449 B13R1.337 NC(=O)CCSCc1ccccn1 62a_100000744528_100000721315 [0,0,0,0,0,0|3,0,0]=3 450 B13R1.337 NC(=O)CCSCc1cccnc1 62a_100000741622_100000744528 [0,0,0,0,0,0|3,0,0]=3 451 B13R1.337 NC(=O)CCSCc1cccnc1 62a_100000744528_100000741622 [0,0,0,0,0,0|3,0,0]=3 452 B13R1.337 NC(=O)CCSCc1cccnn1 62a_100000744528_100016990269 [0,0,0,0,0,0|4,0,0]=4 453 B13R1.337 NC(=O)CCSCc1cccnn1 62a_100016990269_100000744528 [0,0,0,0,0,0|4,0,0]=4 454 B13R1.337 NC(=O)CCSCc1ccncc1 62a_100000744528_100015193705 [0,0,0,0,0,0|3,0,0]=3 455 B13R1.337 NC(=O)CCSCc1ccncc1 62a_100015193705_100000744528 [0,0,0,0,0,0|3,0,0]=3 456 B13R1.337 NC(=O)CCSCc1cnccn1 62a_100000744528_100016995436 [0,0,0,0,0,0|4,0,0]=4 457 B13R1.337 NC(=O)CCSCc1cnccn1 62a_100016995436_100000744528 [0,0,0,0,0,0|4,0,0]=4 458 B13R1.337 NC(=O)CCSCc1cncnc1 62a_100000744528_100015196519 [0,0,0,0,0,0|4,0,0]=4 459 B13R1.337 NC(=O)CCSCc1cncnc1 62a_100015196519_100000744528 [0,0,0,0,0,0|4,0,0]=4 460 B13R1.337 NC(=O)CCSCc1ncccn1 62a_100000703007_100000744528 [0,0,0,0,0,0|4,0,0]=4 461 B13R1.337 NC(=O)CCSCc1ncccn1 62a_100000744528_100000703007 [0,0,0,0,0,0|4,0,0]=4 462 B13R1.337 NC(=O)CNCCc1ccccc1 2230a_100000106460_100000747473 [0,0,0,0,0,0|2,0,0]=2 463 B13R1.337 NC(=O)CNCCc1ccccc1 2230a_100000711301_100000765856 [0,0,0,0,0,0|2,0,0]=2 464 B13R1.337 NC(=O)CNCCc1ccccc1 34a_100000106460_100000187820 [0,0,0,0,0,0|2,0,0]=2 465 B13R1.337 NC(=O)CNCCc1ccccn1 2230a_100000711301_100015183660 [0,0,0,0,0,0|3,0,0]=3 466 B13R1.337 NC(=O)CNCCc1cccnc1 2230a_100000711301_200011713674 [0,0,0,0,0,0|3,0,0]=3 467 B13R1.337 NC(=O)CNCCc1cccnc1 2230a_100000736294_100000747473 [0,0,0,0,0,0|3,0,0]=3 468 B13R1.337 NC(=O)CNCCc1ccncc1 2230a_100000711301_100000723409 [0,0,0,0,0,0|3,0,0]=3 469 B13R1.337 NC(=O)CNCSc1ccccc1 2230a_100000711301_100011218342 [0,0,0,0,0,0|3,0,0]=3 470 B13R1.337 NC(=O)COCCc1ccccc1 34a_100000210268_100000187820 [0,0,0,0,0,0|2,0,0]=2 471 B13R1.337 NC(=O)COCCc1ccccc1 7a_100000210268_100000187820 [0,0,0,0,0,0|2,0,0]=2 472 B13R1.337 NC(=O)COCCc1ccccn1 34a_100000210271_100000187820 [0,0,0,0,0,0|3,0,0]=3 473 B13R1.337 NC(=O)COCCc1cccnc1 34a_100011217484_100000187820 [0,0,0,0,0,0|3,0,0]=3 474 B13R1.337 NC(=O)COCCc1ccncc1 34a_100011216225_100000187820 [0,0,0,0,0,0|3,0,0]=3 475 B13R1.337 NC(=O)COCCc1cnccn1 34a_100011349526_100000187820 [0,0,0,0,0,0|4,0,0]=4 476 B13R1.337 NC(=O)COCCc1cncnc1 34a_100011709255_100000187820 [0,0,0,0,0,0|4,0,0]=4 477 B13R1.337 NC(=O)CSCCc1ccccc1 62a_100000747473_100011218657 [0,0,0,0,0,0|2,0,0]=2 478 B13R1.337 NC(=O)CSCCc1ccccc1 62a_100000765856_100000747473 [0,0,0,0,0,0|2,0,0]=2 479 B13R1.337 NC(=O)CSCCc1ccccn1 62a_100000747473_100015183660 [0,0,0,0,0,0|3,0,0]=3 480 B13R1.337 NC(=O)CSCCc1ccccn1 62a_100015183660_100000747473 [0,0,0,0,0,0|3,0,0]=3 481 B13R1.337 NC(=O)CSCCc1cccnc1 62a_100000747473_200011713674 [0,0,0,0,0,0|3,0,0]=3 482 B13R1.337 NC(=O)CSCCc1cccnc1 62a_200011713674_100000747473 [0,0,0,0,0,0|3,0,0]=3 483 B13R1.337 NC(=O)CSCCc1ccncc1 62a_100000723409_100000747473 [0,0,0,0,0,0|3,0,0]=3 484 B13R1.337 NC(=O)CSCCc1ccncc1 62a_100000747473_100000723409 [0,0,0,0,0,0|3,0,0]=3 485 B13R1.337 NC(=O)CSCSc1ccccc1 62a_100000747473_100011218342 [0,0,0,0,0,0|3,0,0]=3 486 B13R1.337 NC(=O)CSCSc1ccccc1 62a_100011218342_100000747473 [0,0,0,0,0,0|3,0,0]=3 487 B13R1.337 NC(=O)NCCOc1ccccc1 7a_100000210340_200000034859 [0,0,0,0,0,0|3,0,0]=3 488 B13R1.337 NC(=O)NCCOc1cccnc1 7a_100000210849_200000034859 [0,0,0,0,0,0|4,0,0]=4 489 B13R1.337 NC(=O)NCCSc1ccccc1 62a_100000719477_200000034859 [0,0,0,0,0,0|3,0,0]=3 490 B13R1.337 NC(=O)NCCSc1ccccc1 62a_200000034859_100000041952 [0,0,0,0,0,0|3,0,0]=3 491 B13R1.337 NC(=O)NCCSc1ccccn1 62a_100011216584_200000034859 [0,0,0,0,0,0|4,0,0]=4 492 B13R1.337 NC(=O)NCCSc1ccccn1 62a_200000034859_100011216584 [0,0,0,0,0,0|4,0,0]=4 493 B13R1.337 NC(=O)NCCSc1cccnc1 62a_100000210063_200000034859 [0,0,0,0,0,0|4,0,0]=4 494 B13R1.337 NC(=O)NCCSc1cccnc1 62a_200000034859_100000210063 [0,0,0,0,0,0|4,0,0]=4 495 B13R1.337 NC(=O)NCCSc1ccncc1 62a_100000728582_200000034859 [0,0,0,0,0,0|4,0,0]=4 496 B13R1.337 NC(=O)NCCSc1ccncc1 62a_200000034859_100000728582 [0,0,0,0,0,0|4,0,0]=4 497 B13R1.337 NC(=O)OCCNc1ccccc1 34a_100000106764_200011214921 [0,0,0,0,0,0|3,0,0]=3 498 B13R1.337 NC(=O)OCCOc1ccccc1 34a_100000210340_200011214921 [0,0,0,0,0,0|3,0,0]=3 499 B13R1.337 NC(=O)OCCOc1ccccc1 7a_100000210340_200011214921 [0,0,0,0,0,0|3,0,0]=3 500 B13R1.337 NC(=O)OCCOc1cccnc1 34a_100000210849_200011214921 [0,0,0,0,0,0|4,0,0]=4 501 B13R1.337 NC(=O)OCCOc1cccnc1 7a_100000210849_200011214921 [0,0,0,0,0,0|4,0,0]=4 502 B13R1.337 NC(=O)OCCOc1ccncc1 34a_100000212176_200011214921 [0,0,0,0,0,0|4,0,0]=4 503 B13R1.337 NC(=O)OCCSc1ccccc1 62a_100000719477_200011214921 [0,0,0,0,0,0|3,0,0]=3 504 B13R1.337 NC(=O)OCCSc1ccccc1 62a_200011214921_100000041952 [0,0,0,0,0,0|3,0,0]=3 505 B13R1.337 NC(=O)OCCSc1ccccn1 62a_100011216584_200011214921 [0,0,0,0,0,0|4,0,0]=4 506 B13R1.337 NC(=O)OCCSc1ccccn1 62a_200011214921_100011216584 [0,0,0,0,0,0|4,0,0]=4 507 B13R1.337 NC(=O)OCCSc1cccnc1 62a_100000210063_200011214921 [0,0,0,0,0,0|4,0,0]=4 508 B13R1.337 NC(=O)OCCSc1cccnc1 62a_200011214921_100000210063 [0,0,0,0,0,0|4,0,0]=4 509 B13R1.337 NC(=O)OCCSc1ccncc1 62a_100000728582_200011214921 [0,0,0,0,0,0|4,0,0]=4 510 B13R1.337 NC(=O)OCCSc1ccncc1 62a_200011214921_100000728582 [0,0,0,0,0,0|4,0,0]=4 511 B13R1.337 O=C(O)CNCCc1ccccc1 269956a_100016091260_100000765856 [0,0,0,0,0,0|1,0,0]=1 512 B13R1.337 O=C(O)CNCCc1ccccn1 269956a_100016091260_100015183660 [0,0,0,0,0,0|2,0,0]=2 513 B13R1.337 O=C(O)CNCCc1cccnc1 269956a_100016091260_200011713674 [0,0,0,0,0,0|2,0,0]=2 514 B13R1.337 O=C(O)CNCCc1ccncc1 269956a_100016091260_100000723409 [0,0,0,0,0,0|2,0,0]=2 515 B13R1.337 O=C(O)CNCSc1ccccc1 269956a_100016091260_100011218342 [0,0,0,0,0,0|2,0,0]=2 516 B13R1.337 O=C(O)CONCc1ccccc1 269956a_100000106656_100015291786 [0,0,0,0,0,0|2,0,0]=2 517 B13R1.337 O=C(O)CONCc1ccccn1 269956a_100000106656_100000721315 [0,0,0,0,0,0|3,0,0]=3 518 B13R1.337 O=C(O)CONCc1cccnc1 269956a_100000106656_100000733263 [0,0,0,0,0,0|3,0,0]=3 519 B13R1.337 O=C(O)CONCc1cccnn1 269956a_100000106656_100016990269 [0,0,0,0,0,0|4,0,0]=4 520 B13R1.337 O=C(O)CONCc1ccncc1 269956a_100000106656_100015193705 [0,0,0,0,0,0|3,0,0]=3 521 B13R1.337 O=C(O)CONCc1cnccn1 269956a_100000106656_100016995436 [0,0,0,0,0,0|4,0,0]=4 522 B13R1.337 O=C(O)CONCc1cncnc1 269956a_100000106656_100016991940 [0,0,0,0,0,0|4,0,0]=4 523 B13R1.337 O=C(O)CONCc1ncccn1 269956a_100000106656_100000703007 [0,0,0,0,0,0|4,0,0]=4 524 B13R1.337 O=C([O-])CNCCc1ccccc1 34a_100000106460_100020667443 [0,0,0,0,0,0|1,0,1]=2 525 B13R1.337 O=C([O-])COCCc1ccccc1 34a_100000210268_100020667443 [0,0,0,0,0,0|1,0,1]=2 526 B13R1.337 O=C([O-])COCCc1ccccn1 34a_100000210271_100020667443 [0,0,0,0,0,0|2,0,1]=3 527 B13R1.337 O=C([O-])COCCc1cccnc1 34a_100011217484_100020667443 [0,0,0,0,0,0|2,0,1]=3 528 B13R1.337 O=C([O-])COCCc1ccncc1 34a_100011216225_100020667443 [0,0,0,0,0,0|2,0,1]=3 529 B13R1.337 O=C([O-])COCCc1cnccn1 34a_100011349526_100020667443 [0,0,0,0,0,0|3,0,1]=4 530 B13R1.337 O=C([O-])COCCc1cncnc1 34a_100011709255_100020667443 [0,0,0,0,0,0|3,0,1]=4 531 B13R1.337 O=C([O-])CSCCc1ccccc1 62a_100000765856_100020667443 [0,0,0,0,0,0|1,0,1]=2 532 B13R1.337 O=C([O-])CSCCc1ccccc1 62a_100020667443_100011218657 [0,0,0,0,0,0|1,0,1]=2 533 B13R1.337 O=C([O-])CSCCc1ccccn1 62a_100015183660_100020667443 [0,0,0,0,0,0|2,0,1]=3 534 B13R1.337 O=C([O-])CSCCc1ccccn1 62a_100020667443_100015183660 [0,0,0,0,0,0|2,0,1]=3 535 B13R1.337 O=C([O-])CSCCc1cccnc1 62a_100020667443_200011713674 [0,0,0,0,0,0|2,0,1]=3 536 B13R1.337 O=C([O-])CSCCc1cccnc1 62a_200011713674_100020667443 [0,0,0,0,0,0|2,0,1]=3 537 B13R1.337 O=C([O-])CSCCc1ccncc1 62a_100000723409_100020667443 [0,0,0,0,0,0|2,0,1]=3 538 B13R1.337 O=C([O-])CSCCc1ccncc1 62a_100020667443_100000723409 [0,0,0,0,0,0|2,0,1]=3 539 B13R1.337 O=C([O-])CSCSc1ccccc1 62a_100011218342_100020667443 [0,0,0,0,0,0|2,0,1]=3 540 B13R1.337 O=C([O-])CSCSc1ccccc1 62a_100020667443_100011218342 [0,0,0,0,0,0|2,0,1]=3 541 B13R1.337 O=[N+]([O-])CNCCc1ccccc1 34a_100000106460_100000761209 [0,0,0,0,0,0|2,0,1]=3 542 B13R1.337 O=[N+]([O-])COCCc1ccccc1 34a_100000210268_100000761209 [0,0,0,0,0,0|2,0,1]=3 543 B13R1.337 O=[N+]([O-])COCCc1ccccn1 34a_100000210271_100000761209 [0,0,0,0,0,0|3,0,1]=4 544 B13R1.337 O=[N+]([O-])COCCc1cccnc1 34a_100011217484_100000761209 [0,0,0,0,0,0|3,0,1]=4 545 B13R1.337 O=[N+]([O-])COCCc1ccncc1 34a_100011216225_100000761209 [0,0,0,0,0,0|3,0,1]=4 546 B13R1.337 O=[N+]([O-])CSCCc1ccccc1 62a_100000765856_100000761209 [0,0,0,0,0,0|2,0,1]=3 547 B13R1.337 O=[N+]([O-])CSCCc1ccccn1 62a_100015183660_100000761209 [0,0,0,0,0,0|3,0,1]=4 548 B13R1.337 O=[N+]([O-])CSCCc1cccnc1 62a_200011713674_100000761209 [0,0,0,0,0,0|3,0,1]=4 549 B13R1.337 O=[N+]([O-])CSCCc1ccncc1 62a_100000723409_100000761209 [0,0,0,0,0,0|3,0,1]=4 550 B13R1.337 O=[N+]([O-])CSCSc1ccccc1 62a_100011218342_100000761209 [0,0,0,0,0,0|3,0,1]=4 551 B13R1.337 [13CH3]C(=O)C=CCCc1ccccc1 1458a_100016484021_200025704644 [0,0,0,0,0,0|1,0,2]=3 552 B13R1.337 [13CH3]C(=O)CCCCc1ccccc1 1458a_100011215911_200025704644 [0,0,0,0,0,0|1,0,0]=1 553 B13R1.337 [13CH3]C(=O)CCCOc1ccccc1 1458a_100000212059_200025704644 [0,0,0,0,0,0|2,0,0]=2 554 B13R1.337 [13CH3]C(=O)CCCSc1ccccc1 1458a_100000182835_200025704644 [0,0,0,0,0,0|2,0,0]=2 555 B13R1.337 [13CH3]C(=O)CCOCc1ccccc1 1458a_100000743319_200025704644 [0,0,0,0,0,0|2,0,0]=2 556 B13R1.337 [13CH3]C(=O)CCSCc1ccccc1 1458a_100000173759_200025704644 [0,0,0,0,0,0|2,0,0]=2 557 B13R1.337 [13CH3]C(=O)CCSCc1ccccn1 1458a_100000742633_200025704644 [0,0,0,0,0,0|3,0,0]=3 558 B13R1.337 [13CH3]C(=O)CCSSc1ccccn1 1458a_100000068049_200025704644 [0,0,0,0,0,0|4,0,0]=4 559 B12R1.8 BrCCCOCc1ccccc1 34a_100011217188_100015291786 [1,0,0,0,0,0|2,0,1]=4 560 B12R1.8 BrCCOCCc1ccccc1 34a_100000211926_100000765856 [1,0,0,0,0,0|2,0,1]=4 561 B12R1.8 C#CCCCNc1ccccc1 34a_100000106764_100000695029 [1,0,0,0,0,0|2,0,1]=4 562 B12R1.8 C#CCCCOc1ccccc1 34a_100000210340_100000695029 [1,0,0,0,0,0|2,0,1]=4 563 B12R1.8 C#CCCCOc1ccccc1 7a_100000210340_100011215417 [1,0,0,0,0,0|2,0,1]=4 564 B12R1.8 C#CCCCSc1ccccc1 62a_100000719477_100011215417 [1,0,0,0,0,0|2,0,1]=4 565 B12R1.8 C#CCCCSc1ccccc1 62a_100011215417_100000041952 [1,0,0,0,0,0|2,0,1]=4 566 B12R1.8 C#CCCNCc1ccccc1 2230a_100015324214_100000688953 [1,0,0,0,0,0|2,0,1]=4 567 B12R1.8 C#CCCNCc1ccccc1 34a_100000755551_100015291786 [1,0,0,0,0,0|2,0,1]=4 568 B12R1.8 C#CCCNCc1ccccc1 34a_100015324214_100000688953 [1,0,0,0,0,0|2,0,1]=4 569 B12R1.8 C#CCCOCc1ccccc1 34a_100000210790_100000688953 [1,0,0,0,0,0|2,0,1]=4 570 B12R1.8 C#CCCOCc1ccccc1 34a_100011215631_100015291786 [1,0,0,0,0,0|2,0,1]=4 571 B12R1.8 C#CCCOCc1ccccc1 7a_100000210790_100000688953 [1,0,0,0,0,0|2,0,1]=4 572 B12R1.8 C#CCCSCc1ccccc1 62a_100000211182_100000688953 [1,0,0,0,0,0|2,0,1]=4 573 B12R1.8 C#CCCSCc1ccccc1 62a_100000688953_100015291786 [1,0,0,0,0,0|2,0,1]=4 574 B12R1.8 C#CCNCCc1ccccc1 2230a_100000106460_100000038162 [1,0,0,0,0,0|2,0,1]=4 575 B12R1.8 C#CCNCCc1ccccc1 34a_100000106460_100000184674 [1,0,0,0,0,0|2,0,1]=4 576 B12R1.8 C#CCNCCc1ccccc1 34a_100000212058_100000765856 [1,0,0,0,0,0|2,0,1]=4 577 B12R1.8 C#CCOCCc1ccccc1 34a_100000210247_100000765856 [1,0,0,0,0,0|2,0,1]=4 578 B12R1.8 C#CCOCCc1ccccc1 34a_100000210268_100000184674 [1,0,0,0,0,0|2,0,1]=4 579 B12R1.8 C#CCOCCc1ccccc1 7a_100000210268_100000038162 [1,0,0,0,0,0|2,0,1]=4 580 B12R1.8 C#CCSCCc1ccccc1 62a_100000038162_100011218657 [1,0,0,0,0,0|2,0,1]=4 581 B12R1.8 C/C=C/CNCc1ccccc1 34a_100015324214_100102629194 [1,0,0,0,0,0|2,0,1]=4 582 B12R1.8 C/C=C/COCc1ccccc1 34a_100000210790_100102629194 [1,0,0,0,0,0|2,0,1]=4 583 B12R1.8 C/C=C/COCc1ccccc1 34a_100016270725_100015291786 [1,0,0,0,0,0|2,0,1]=4 584 B12R1.8 C/C=C/COCc1ccccc1 7a_100000210790_100102629194 [1,0,0,0,0,0|2,0,1]=4 585 B12R1.8 C/C=C/CSCc1ccccc1 62a_100000211182_100102629194 [1,0,0,0,0,0|2,0,1]=4 586 B12R1.8 C/C=C/CSCc1ccccc1 62a_100102629194_100015291786 [1,0,0,0,0,0|2,0,1]=4 587 B12R1.8 C=CCCCNc1ccccc1 34a_100000106764_100000757094 [1,0,0,0,0,0|2,0,0]=3 588 B12R1.8 C=CCCCOc1ccccc1 34a_100000210340_100000757094 [1,0,0,0,0,0|2,0,0]=3 589 B12R1.8 C=CCCCOc1ccccc1 7a_100000210340_100000757094 [1,0,0,0,0,0|2,0,0]=3 590 B12R1.8 C=CCCCOc1cccnc1 34a_100000210849_100000757094 [1,0,0,0,0,0|3,0,0]=4 591 B12R1.8 C=CCCCOc1cccnc1 7a_100000210849_100000757094 [1,0,0,0,0,0|3,0,0]=4 592 B12R1.8 C=CCCCOc1ccncc1 34a_100000212176_100000757094 [1,0,0,0,0,0|3,0,0]=4 593 B12R1.8 C=CCCCSc1ccccc1 62a_100000719477_100000757094 [1,0,0,0,0,0|2,0,0]=3 594 B12R1.8 C=CCCCSc1ccccc1 62a_100011713584_100000041952 [1,0,0,0,0,0|2,0,0]=3 595 B12R1.8 C=CCCCSc1ccccn1 62a_100011216584_100000757094 [1,0,0,0,0,0|3,0,0]=4 596 B12R1.8 C=CCCCSc1ccccn1 62a_100011713584_100011216584 [1,0,0,0,0,0|3,0,0]=4 597 B12R1.8 C=CCCCSc1cccnc1 62a_100000210063_100000757094 [1,0,0,0,0,0|3,0,0]=4 598 B12R1.8 C=CCCCSc1cccnc1 62a_100011713584_100000210063 [1,0,0,0,0,0|3,0,0]=4 599 B12R1.8 C=CCCCSc1ccncc1 62a_100000728582_100000757094 [1,0,0,0,0,0|3,0,0]=4 600 B12R1.8 C=CCCCSc1ccncc1 62a_100011713584_100000728582 [1,0,0,0,0,0|3,0,0]=4 601 B12R1.8 C=CCCNCc1ccccc1 207a_100015191253_100015611070 [1,0,0,0,0,0|2,0,0]=3 602 B12R1.8 C=CCCNCc1ccccc1 2230a_100015191253_100015291786 [1,0,0,0,0,0|2,0,0]=3 603 B12R1.8 C=CCCNCc1ccccc1 2230a_100015324214_100000754431 [1,0,0,0,0,0|2,0,0]=3 604 B12R1.8 C=CCCNCc1ccccc1 270004a_100015191253_100015611070 [1,0,0,0,0,0|2,0,0]=3 605 B12R1.8 C=CCCNCc1ccccc1 34a_100015324214_100000754431 [1,0,0,0,0,0|2,0,0]=3 606 B12R1.8 C=CCCNCc1ccccn1 207a_100015191253_100000209966 [1,0,0,0,0,0|3,0,0]=4 607 B12R1.8 C=CCCNCc1ccccn1 2230a_100015191253_100000721315 [1,0,0,0,0,0|3,0,0]=4 608 B12R1.8 C=CCCNCc1ccccn1 270004a_100015191253_100000209966 [1,0,0,0,0,0|3,0,0]=4 609 B12R1.8 C=CCCNCc1cccnc1 207a_100015191253_100000209961 [1,0,0,0,0,0|3,0,0]=4 610 B12R1.8 C=CCCNCc1cccnc1 2230a_100015191253_100000741622 [1,0,0,0,0,0|3,0,0]=4 611 B12R1.8 C=CCCNCc1cccnc1 270004a_100015191253_100000209961 [1,0,0,0,0,0|3,0,0]=4 612 B12R1.8 C=CCCNCc1ccncc1 207a_100015191253_100000186114 [1,0,0,0,0,0|3,0,0]=4 613 B12R1.8 C=CCCNCc1ccncc1 2230a_100015191253_100015193705 [1,0,0,0,0,0|3,0,0]=4 614 B12R1.8 C=CCCOCc1ccccc1 34a_100000210790_100000754431 [1,0,0,0,0,0|2,0,0]=3 615 B12R1.8 C=CCCOCc1ccccc1 34a_100011205117_100015291786 [1,0,0,0,0,0|2,0,0]=3 616 B12R1.8 C=CCCOCc1ccccc1 7a_100000210790_100000754431 [1,0,0,0,0,0|2,0,0]=3 617 B12R1.8 C=CCCOCc1ccccn1 34a_100011205117_100000721315 [1,0,0,0,0,0|3,0,0]=4 618 B12R1.8 C=CCCOCc1cccnc1 34a_100011205117_100000733263 [1,0,0,0,0,0|3,0,0]=4 619 B12R1.8 C=CCCSCc1ccccc1 62a_100000211182_100000754431 [1,0,0,0,0,0|2,0,0]=3 620 B12R1.8 C=CCCSCc1ccccc1 62a_100000754431_100015291786 [1,0,0,0,0,0|2,0,0]=3 621 B12R1.8 C=CCCSCc1ccccn1 62a_100000721315_100000754431 [1,0,0,0,0,0|3,0,0]=4 622 B12R1.8 C=CCCSCc1ccccn1 62a_100000754431_100000721315 [1,0,0,0,0,0|3,0,0]=4 623 B12R1.8 C=CCCSCc1cccnc1 62a_100000741622_100000754431 [1,0,0,0,0,0|3,0,0]=4 624 B12R1.8 C=CCCSCc1cccnc1 62a_100000754431_100000741622 [1,0,0,0,0,0|3,0,0]=4 625 B12R1.8 C=CCCSCc1ccncc1 62a_100000754431_100015193705 [1,0,0,0,0,0|3,0,0]=4 626 B12R1.8 C=CCCSCc1ccncc1 62a_100015193705_100000754431 [1,0,0,0,0,0|3,0,0]=4 627 B12R1.8 C=CCNCCc1ccccc1 2230a_100000106460_100000210623 [1,0,0,0,0,0|2,0,0]=3 628 B12R1.8 C=CCNCCc1ccccc1 2230a_100020586998_100000765856 [1,0,0,0,0,0|2,0,0]=3 629 B12R1.8 C=CCNCCc1ccccc1 34a_100000106460_100015514636 [1,0,0,0,0,0|2,0,0]=3 630 B12R1.8 C=CCNCCc1ccccn1 2230a_100020586998_100015183660 [1,0,0,0,0,0|3,0,0]=4 631 B12R1.8 C=CCNCCc1cccnc1 2230a_100000736294_100000210623 [1,0,0,0,0,0|3,0,0]=4 632 B12R1.8 C=CCNCCc1cccnc1 2230a_100020586998_200011713674 [1,0,0,0,0,0|3,0,0]=4 633 B12R1.8 C=CCNCCc1ccncc1 2230a_100020586998_100000723409 [1,0,0,0,0,0|3,0,0]=4 634 B12R1.8 C=CCNCSc1ccccc1 2230a_100020586998_100011218342 [1,0,0,0,0,0|3,0,0]=4 635 B12R1.8 C=CCOCCc1ccccc1 34a_100000210268_100015514636 [1,0,0,0,0,0|2,0,0]=3 636 B12R1.8 C=CCOCCc1ccccc1 34a_200000210373_100000765856 [1,0,0,0,0,0|2,0,0]=3 637 B12R1.8 C=CCOCCc1ccccc1 7a_100000210268_100015514636 [1,0,0,0,0,0|2,0,0]=3 638 B12R1.8 C=CCOCCc1ccccn1 34a_100000210271_100015514636 [1,0,0,0,0,0|3,0,0]=4 639 B12R1.8 C=CCOCCc1cccnc1 34a_100011217484_100015514636 [1,0,0,0,0,0|3,0,0]=4 640 B12R1.8 C=CCOCCc1ccncc1 34a_100011216225_100015514636 [1,0,0,0,0,0|3,0,0]=4 641 B12R1.8 C=CCSCCc1ccccc1 62a_100000210623_100011218657 [1,0,0,0,0,0|2,0,0]=3 642 B12R1.8 C=CCSCCc1ccccc1 62a_100000765856_100000210623 [1,0,0,0,0,0|2,0,0]=3 643 B12R1.8 C=CCSCCc1ccccn1 62a_100000210623_100015183660 [1,0,0,0,0,0|3,0,0]=4 644 B12R1.8 C=CCSCCc1ccccn1 62a_100015183660_100000210623 [1,0,0,0,0,0|3,0,0]=4 645 B12R1.8 C=CCSCCc1cccnc1 62a_100000210623_200011713674 [1,0,0,0,0,0|3,0,0]=4 646 B12R1.8 C=CCSCCc1cccnc1 62a_200011713674_100000210623 [1,0,0,0,0,0|3,0,0]=4 647 B12R1.8 C=CCSCCc1ccncc1 62a_100000210623_100000723409 [1,0,0,0,0,0|3,0,0]=4 648 B12R1.8 C=CCSCCc1ccncc1 62a_100000723409_100000210623 [1,0,0,0,0,0|3,0,0]=4 649 B12R1.8 C=CCSCSc1ccccc1 62a_100000210623_100011218342 [1,0,0,0,0,0|3,0,0]=4 650 B12R1.8 C=CCSCSc1ccccc1 62a_100011218342_100000210623 [1,0,0,0,0,0|3,0,0]=4 651 B12R1.8 C=COCCNc1ccccc1 34a_100000106764_100000039644 [1,0,0,0,0,0|3,0,0]=4 652 B12R1.8 C=COCCOc1ccccc1 34a_100000210340_100000039644 [1,0,0,0,0,0|3,0,0]=4 653 B12R1.8 C=COCCOc1ccccc1 7a_100000210340_100000039644 [1,0,0,0,0,0|3,0,0]=4 654 B12R1.8 C=COCCSc1ccccc1 62a_100000039644_100000041952 [1,0,0,0,0,0|3,0,0]=4 655 B12R1.8 C=COCCSc1ccccc1 62a_100000719477_100000039644 [1,0,0,0,0,0|3,0,0]=4 656 B12R1.8 CC=CCNCc1ccccc1 2230a_100015324214_100000070051 [1,0,0,0,0,0|2,0,1]=4 657 B12R1.8 CC=CCNCc1ccccc1 34a_100015324214_100000070051 [1,0,0,0,0,0|2,0,1]=4 658 B12R1.8 CC=CCOCc1ccccc1 34a_100000210790_100000070051 [1,0,0,0,0,0|2,0,1]=4 659 B12R1.8 CC=CCOCc1ccccc1 7a_100000210790_100000070051 [1,0,0,0,0,0|2,0,1]=4 660 B12R1.8 CC=CCSCc1ccccc1 62a_100000070051_100015291786 [1,0,0,0,0,0|2,0,1]=4 661 B12R1.8 CC=CCSCc1ccccc1 62a_100000211182_100000070051 [1,0,0,0,0,0|2,0,1]=4 662 B12R1.8 CC=NNCCc1ccccc1 4a_100000740470_200000210099 [1,0,0,0,0,0|3,0,0]=4 663 B12R1.8 CCCCCNc1ccccc1 34a_100000106764_100000718602 [1,0,0,0,0,0|2,0,1]=4 664 B12R1.8 CCCCCOc1ccccc1 34a_100000210340_100000718602 [1,0,0,0,0,0|2,0,1]=4 665 B12R1.8 CCCCCOc1ccccc1 7a_100000210340_100000210326 [1,0,0,0,0,0|2,0,1]=4 666 B12R1.8 CCCCCSc1ccccc1 62a_100000210326_100000041952 [1,0,0,0,0,0|2,0,1]=4 667 B12R1.8 CCCCCSc1ccccc1 62a_100000719477_100000210326 [1,0,0,0,0,0|2,0,1]=4 668 B12R1.8 CCCCNCc1ccccc1 207a_100000102301_100015611070 [1,0,0,0,0,0|2,0,1]=4 669 B12R1.8 CCCCNCc1ccccc1 2230a_100000102301_100015291786 [1,0,0,0,0,0|2,0,1]=4 670 B12R1.8 CCCCNCc1ccccc1 2230a_100015324214_100000210211 [1,0,0,0,0,0|2,0,1]=4 671 B12R1.8 CCCCNCc1ccccc1 270004a_100000102301_100015611070 [1,0,0,0,0,0|2,0,1]=4 672 B12R1.8 CCCCNCc1ccccc1 34a_100015324214_100000210210 [1,0,0,0,0,0|2,0,1]=4 673 B12R1.8 CCCCNCc1ccccc1 7a_106832991798_100000211182 [1,0,0,0,0,0|2,0,1]=4 674 B12R1.8 CCCCOCc1ccccc1 34a_100000210227_100015291786 [1,0,0,0,0,0|2,0,1]=4 675 B12R1.8 CCCCOCc1ccccc1 34a_100000210790_100000210210 [1,0,0,0,0,0|2,0,1]=4 676 B12R1.8 CCCCOCc1ccccc1 7a_100000210227_100000211182 [1,0,0,0,0,0|2,0,1]=4 677 B12R1.8 CCCCOCc1ccccc1 7a_100000210790_100000210211 [1,0,0,0,0,0|2,0,1]=4 678 B12R1.8 CCCCSCc1ccccc1 62a_100000210211_100015291786 [1,0,0,0,0,0|2,0,1]=4 679 B12R1.8 CCCCSCc1ccccc1 62a_100000211182_100000210210 [1,0,0,0,0,0|2,0,1]=4 680 B12R1.8 CCCNCCc1ccccc1 2230a_100000106460_100000210303 [1,0,0,0,0,0|2,0,1]=4 681 B12R1.8 CCCNCCc1ccccc1 34a_100000106460_100000210303 [1,0,0,0,0,0|2,0,1]=4 682 B12R1.8 CCCOCCc1ccccc1 34a_100000210258_100000765856 [1,0,0,0,0,0|2,0,1]=4 683 B12R1.8 CCCOCCc1ccccc1 34a_100000210268_100000210303 [1,0,0,0,0,0|2,0,1]=4 684 B12R1.8 CCCOCCc1ccccc1 7a_100000210268_100000210303 [1,0,0,0,0,0|2,0,1]=4 685 B12R1.8 CCCSCCc1ccccc1 62a_100000210303_100011218657 [1,0,0,0,0,0|2,0,1]=4 686 B12R1.8 CCCSCCc1ccccc1 62a_100000765856_100000210303 [1,0,0,0,0,0|2,0,1]=4 687 B12R1.8 CCNCCCc1ccccc1 2230a_100000211184_100000210202 [1,0,0,0,0,0|2,0,1]=4 688 B12R1.8 CCNCCCc1ccccc1 2230a_100015525214_100000211621 [1,0,0,0,0,0|2,0,1]=4 689 B12R1.8 CCNCCCc1ccccc1 34a_100000211184_100000210202 [1,0,0,0,0,0|2,0,1]=4 690 B12R1.8 CCOCCCc1ccccc1 34a_100000210828_100000210202 [1,0,0,0,0,0|2,0,1]=4 691 B12R1.8 CCOCCCc1ccccc1 34a_100121572206_100000211621 [1,0,0,0,0,0|2,0,1]=4 692 B12R1.8 CCOCCCc1ccccc1 7a_100000210828_100000210202 [1,0,0,0,0,0|2,0,1]=4 693 B12R1.8 CCSCCCc1ccccc1 62a_100000210202_100000211621 [1,0,0,0,0,0|2,0,1]=4 694 B12R1.8 CCSCCCc1ccccc1 62a_100000211621_100000210202 [1,0,0,0,0,0|2,0,1]=4 695 B12R1.8 CNCCCCc1ccccc1 2230a_100015280158_200000210301 [1,0,0,0,0,0|2,0,0]=3 696 B12R1.8 CNCCCCc1ccccc1 2230a_106832991635_100000701786 [1,0,0,0,0,0|2,0,0]=3 697 B12R1.8 CNCCCCc1ccccc1 34a_100015280158_200000210301 [1,0,0,0,0,0|2,0,0]=3 698 B12R1.8 CNCCCCc1ccccc1 34a_100102657272_100000701786 [1,0,0,0,0,0|2,0,0]=3 699 B12R1.8 CNCCCCc1ccccc1 7a_106832991635_100000701786 [1,0,0,0,0,0|2,0,0]=3 700 B12R1.8 CNCCCCc1ccncc1 2230a_106832991635_100020630000 [1,0,0,0,0,0|3,0,0]=4 701 B12R1.8 CNCCCCc1ccncc1 7a_106832991635_100020630000 [1,0,0,0,0,0|3,0,0]=4 702 B12R1.8 CNCCCOc1ccccc1 2230a_100000216521_200000210301 [1,0,0,0,0,0|3,0,0]=4 703 B12R1.8 CNCCCOc1ccccc1 2230a_106832991635_100000199009 [1,0,0,0,0,0|3,0,0]=4 704 B12R1.8 CNCCCOc1ccccc1 34a_100000216521_200000210301 [1,0,0,0,0,0|3,0,0]=4 705 B12R1.8 CNCCCOc1ccccc1 34a_100102657272_100000199009 [1,0,0,0,0,0|3,0,0]=4 706 B12R1.8 CNCCCOc1ccccc1 7a_106832991635_100000199009 [1,0,0,0,0,0|3,0,0]=4 707 B12R1.8 CNCCCSc1ccccc1 2230a_100000184639_200000210301 [1,0,0,0,0,0|3,0,0]=4 708 B12R1.8 CNCCCSc1ccccc1 2230a_106832991635_200011203293 [1,0,0,0,0,0|3,0,0]=4 709 B12R1.8 CNCCCSc1ccccc1 34a_100102657272_200011203293 [1,0,0,0,0,0|3,0,0]=4 710 B12R1.8 CNCCCSc1ccccc1 7a_106832991635_200011203293 [1,0,0,0,0,0|3,0,0]=4 711 B12R1.8 CNCCOCc1ccccc1 2230a_100000753106_200000210301 [1,0,0,0,0,0|3,0,0]=4 712 B12R1.8 CNCCOCc1ccccc1 2230a_106832991635_100000234347 [1,0,0,0,0,0|3,0,0]=4 713 B12R1.8 CNCCOCc1ccccc1 34a_100000753106_200000210301 [1,0,0,0,0,0|3,0,0]=4 714 B12R1.8 CNCCOCc1ccccc1 34a_100102657272_100000234347 [1,0,0,0,0,0|3,0,0]=4 715 B12R1.8 CNCCOCc1ccccc1 7a_106832991635_100000234347 [1,0,0,0,0,0|3,0,0]=4 716 B12R1.8 CNCCSCc1ccccc1 2230a_100000189534_200000210301 [1,0,0,0,0,0|3,0,0]=4 717 B12R1.8 CNCCSCc1ccccc1 2230a_106832991635_200011297719 [1,0,0,0,0,0|3,0,0]=4 718 B12R1.8 CNCCSCc1ccccc1 34a_100000189534_200000210301 [1,0,0,0,0,0|3,0,0]=4 719 B12R1.8 CNCCSCc1ccccc1 34a_100102657272_200011297719 [1,0,0,0,0,0|3,0,0]=4 720 B12R1.8 CNCCSCc1ccccc1 7a_100000189534_200000210301 [1,0,0,0,0,0|3,0,0]=4 721 B12R1.8 COCCCCc1ccccc1 34a_100000703073_200000210301 [1,0,0,0,0,0|2,0,0]=3 722 B12R1.8 COCCCCc1ccccc1 34a_100138415774_100000701786 [1,0,0,0,0,0|2,0,0]=3 723 B12R1.8 COCCCCc1ccccc1 7a_100000703073_200000210301 [1,0,0,0,0,0|2,0,0]=3 724 B12R1.8 COCCCCc1ccccn1 34a_100012186994_200000210301 [1,0,0,0,0,0|3,0,0]=4 725 B12R1.8 COCCCCc1cccnc1 34a_100012039607_200000210301 [1,0,0,0,0,0|3,0,0]=4 726 B12R1.8 COCCCCc1cccnc1 7a_100012039607_200000210301 [1,0,0,0,0,0|3,0,0]=4 727 B12R1.8 COCCCCc1ccncc1 34a_100011787716_200000210301 [1,0,0,0,0,0|3,0,0]=4 728 B12R1.8 COCCCNc1ccccc1 34a_100000106764_100000740836 [1,0,0,0,0,0|3,0,0]=4 729 B12R1.8 COCCCNc1ccccc1 34a_100000212590_200000210301 [1,0,0,0,0,0|3,0,0]=4 730 B12R1.8 COCCCOc1ccccc1 34a_100000210340_100000740836 [1,0,0,0,0,0|3,0,0]=4 731 B12R1.8 COCCCOc1ccccc1 34a_100011215863_200000210301 [1,0,0,0,0,0|3,0,0]=4 732 B12R1.8 COCCCOc1ccccc1 34a_100138415774_100000199009 [1,0,0,0,0,0|3,0,0]=4 733 B12R1.8 COCCCOc1ccccc1 7a_100000210340_100000740836 [1,0,0,0,0,0|3,0,0]=4 734 B12R1.8 COCCCOc1ccccc1 7a_100011215863_200000210301 [1,0,0,0,0,0|3,0,0]=4 735 B12R1.8 COCCCSc1ccccc1 34a_100138415774_200011203293 [1,0,0,0,0,0|3,0,0]=4 736 B12R1.8 COCCCSc1ccccc1 62a_100000709357_100000041952 [1,0,0,0,0,0|3,0,0]=4 737 B12R1.8 COCCCSc1ccccc1 62a_100000719477_100000709357 [1,0,0,0,0,0|3,0,0]=4 738 B12R1.8 COCCNCc1ccccc1 207a_100000209980_100015611070 [1,0,0,0,0,0|3,0,0]=4 739 B12R1.8 COCCNCc1ccccc1 2230a_100000209980_100015291786 [1,0,0,0,0,0|3,0,0]=4 740 B12R1.8 COCCNCc1ccccc1 2230a_100015324214_100011201679 [1,0,0,0,0,0|3,0,0]=4 741 B12R1.8 COCCNCc1ccccc1 270004a_100000209980_100015611070 [1,0,0,0,0,0|3,0,0]=4 742 B12R1.8 COCCNCc1ccccc1 34a_100000180844_200000210301 [1,0,0,0,0,0|3,0,0]=4 743 B12R1.8 COCCNCc1ccccc1 34a_100015324214_100011201679 [1,0,0,0,0,0|3,0,0]=4 744 B12R1.8 COCCOCc1ccccc1 34a_100000210237_100015291786 [1,0,0,0,0,0|3,0,0]=4 745 B12R1.8 COCCOCc1ccccc1 34a_100000210790_100011201679 [1,0,0,0,0,0|3,0,0]=4 746 B12R1.8 COCCOCc1ccccc1 34a_100000759325_200000210301 [1,0,0,0,0,0|3,0,0]=4 747 B12R1.8 COCCOCc1ccccc1 34a_100138415774_100000234347 [1,0,0,0,0,0|3,0,0]=4 748 B12R1.8 COCCOCc1ccccc1 7a_100000210790_100000233755 [1,0,0,0,0,0|3,0,0]=4 749 B12R1.8 COCCOCc1ccccc1 7a_100000759325_200000210301 [1,0,0,0,0,0|3,0,0]=4 750 B12R1.8 COCCSCc1ccccc1 34a_100011205989_200000210301 [1,0,0,0,0,0|3,0,0]=4 751 B12R1.8 COCCSCc1ccccc1 34a_100138415774_200011297719 [1,0,0,0,0,0|3,0,0]=4 752 B12R1.8 COCCSCc1ccccc1 62a_100000211182_100000233755 [1,0,0,0,0,0|3,0,0]=4 753 B12R1.8 COCCSCc1ccccc1 62a_100000233755_100015291786 [1,0,0,0,0,0|3,0,0]=4 754 B12R1.8 COCCSCc1ccccc1 7a_100011205989_200000210301 [1,0,0,0,0,0|3,0,0]=4 755 B12R1.8 COCNCCc1ccccc1 2230a_100000106460_100000766300 [1,0,0,0,0,0|3,0,0]=4 756 B12R1.8 COCSCCc1ccccc1 62a_100000765856_100000766300 [1,0,0,0,0,0|3,0,0]=4 757 B12R1.8 COCSCCc1ccccc1 62a_100000766300_100011218657 [1,0,0,0,0,0|3,0,0]=4 758 B12R1.8 CSCCCCc1ccccc1 62a_100000701786_200000210301 [1,0,0,0,0,0|2,0,0]=3 759 B12R1.8 CSCCCCc1ccccc1 62a_200000210301_100000701786 [1,0,0,0,0,0|2,0,0]=3 760 B12R1.8 CSCCCCc1ccncc1 62a_100020630000_200000210301 [1,0,0,0,0,0|3,0,0]=4 761 B12R1.8 CSCCCCc1ccncc1 62a_200000210301_100020630000 [1,0,0,0,0,0|3,0,0]=4 762 B12R1.8 CSCCCOc1ccccc1 62a_100000199009_200000210301 [1,0,0,0,0,0|3,0,0]=4 763 B12R1.8 CSCCCOc1ccccc1 62a_200000210301_100000199009 [1,0,0,0,0,0|3,0,0]=4 764 B12R1.8 CSCCCSc1ccccc1 62a_200000210301_200011203293 [1,0,0,0,0,0|3,0,0]=4 765 B12R1.8 CSCCCSc1ccccc1 62a_200011203293_200000210301 [1,0,0,0,0,0|3,0,0]=4 766 B12R1.8 CSCCNCc1ccccc1 207a_100020590264_100015611070 [1,0,0,0,0,0|3,0,0]=4 767 B12R1.8 CSCCNCc1ccccc1 2230a_100015324214_100000751147 [1,0,0,0,0,0|3,0,0]=4 768 B12R1.8 CSCCNCc1ccccc1 2230a_100020590264_100015291786 [1,0,0,0,0,0|3,0,0]=4 769 B12R1.8 CSCCNCc1ccccc1 270004a_100020590264_100015611070 [1,0,0,0,0,0|3,0,0]=4 770 B12R1.8 CSCCNCc1ccccc1 34a_100015324214_100000212216 [1,0,0,0,0,0|3,0,0]=4 771 B12R1.8 CSCCOCc1ccccc1 34a_100000210790_100000212216 [1,0,0,0,0,0|3,0,0]=4 772 B12R1.8 CSCCOCc1ccccc1 34a_100000230434_100015291786 [1,0,0,0,0,0|3,0,0]=4 773 B12R1.8 CSCCOCc1ccccc1 62a_100000234347_200000210301 [1,0,0,0,0,0|3,0,0]=4 774 B12R1.8 CSCCOCc1ccccc1 62a_200000210301_100000234347 [1,0,0,0,0,0|3,0,0]=4 775 B12R1.8 CSCCOCc1ccccc1 7a_100000210790_100000212216 [1,0,0,0,0,0|3,0,0]=4 776 B12R1.8 CSCCOCc1ccccc1 7a_100000230434_100000211182 [1,0,0,0,0,0|3,0,0]=4 777 B12R1.8 CSCCSCc1ccccc1 62a_100000211182_100000751147 [1,0,0,0,0,0|3,0,0]=4 778 B12R1.8 CSCCSCc1ccccc1 62a_100000212216_100015291786 [1,0,0,0,0,0|3,0,0]=4 779 B12R1.8 CSCCSCc1ccccc1 62a_200000210301_200011297719 [1,0,0,0,0,0|3,0,0]=4 780 B12R1.8 CSCCSCc1ccccc1 62a_200011297719_200000210301 [1,0,0,0,0,0|3,0,0]=4 781 B12R1.8 CSCNCCc1ccccc1 2230a_100000106460_100011218213 [1,0,0,0,0,0|3,0,0]=4 782 B12R1.8 CSCNCCc1ccccc1 34a_100000106460_100011218213 [1,0,0,0,0,0|3,0,0]=4 783 B12R1.8 CSCOCCc1ccccc1 34a_100000210268_100011218213 [1,0,0,0,0,0|3,0,0]=4 784 B12R1.8 CSCSCCc1ccccc1 62a_100000765856_100011218213 [1,0,0,0,0,0|3,0,0]=4 785 B12R1.8 CSCSCCc1ccccc1 62a_100011218213_100011218657 [1,0,0,0,0,0|3,0,0]=4 786 B12R1.8 ClCCCOCc1ccccc1 34a_100000230001_100015291786 [1,0,0,0,0,0|2,0,1]=4 787 B12R1.8 FCCCCNc1ccccc1 34a_100000106764_100000729493 [1,0,0,0,0,0|2,0,1]=4 788 B12R1.8 FCCCCOc1ccccc1 34a_100000210340_100000729493 [1,0,0,0,0,0|2,0,1]=4 789 B12R1.8 FCCCCOc1ccccc1 7a_100000210340_100000729493 [1,0,0,0,0,0|2,0,1]=4 790 B12R1.8 FCCCCSc1ccccc1 62a_100000719477_100000729493 [1,0,0,0,0,0|2,0,1]=4 791 B12R1.8 FCCCCSc1ccccc1 62a_100000729493_100000041952 [1,0,0,0,0,0|2,0,1]=4 792 B12R1.8 FCCCNCc1ccccc1 207a_100015189416_100015611070 [1,0,0,0,0,0|2,0,1]=4 793 B12R1.8 FCCCNCc1ccccc1 2230a_100015189416_100015291786 [1,0,0,0,0,0|2,0,1]=4 794 B12R1.8 FCCCNCc1ccccc1 2230a_100015324214_100011934791 [1,0,0,0,0,0|2,0,1]=4 795 B12R1.8 FCCCNCc1ccccc1 270004a_100015189416_100015611070 [1,0,0,0,0,0|2,0,1]=4 796 B12R1.8 FCCCNCc1ccccc1 34a_100015189416_100015291786 [1,0,0,0,0,0|2,0,1]=4 797 B12R1.8 FCCCNCc1ccccc1 34a_100015324214_100011934791 [1,0,0,0,0,0|2,0,1]=4 798 B12R1.8 FCCCOCc1ccccc1 34a_100000210790_100011934791 [1,0,0,0,0,0|2,0,1]=4 799 B12R1.8 FCCCOCc1ccccc1 34a_100000759539_100015291786 [1,0,0,0,0,0|2,0,1]=4 800 B12R1.8 FCCCOCc1ccccc1 7a_100000210790_100011934791 [1,0,0,0,0,0|2,0,1]=4 801 B12R1.8 FCCCSCc1ccccc1 62a_100000211182_100011934791 [1,0,0,0,0,0|2,0,1]=4 802 B12R1.8 FCCCSCc1ccccc1 62a_100011934791_100015291786 [1,0,0,0,0,0|2,0,1]=4 803 B12R1.8 FCCNCCc1ccccc1 2230a_100000106460_100011217306 [1,0,0,0,0,0|2,0,1]=4 804 B12R1.8 FCCNCCc1ccccc1 34a_100000106460_100011217306 [1,0,0,0,0,0|2,0,1]=4 805 B12R1.8 FCCNCCc1ccccc1 34a_100000724931_100000765856 [1,0,0,0,0,0|2,0,1]=4 806 B12R1.8 FCCOCCc1ccccc1 34a_100000210268_100011217306 [1,0,0,0,0,0|2,0,1]=4 807 B12R1.8 FCCOCCc1ccccc1 7a_100000210268_100011217306 [1,0,0,0,0,0|2,0,1]=4 808 B12R1.8 FCCSCCc1ccccc1 62a_100000765856_100011217306 [1,0,0,0,0,0|2,0,1]=4 809 B12R1.8 FCCSCCc1ccccc1 62a_100011217306_100011218657 [1,0,0,0,0,0|2,0,1]=4 810 B12R1.8 FCNCCCc1ccccc1 34a_100000211184_100015361967 [1,0,0,0,0,0|2,0,1]=4 811 B12R1.8 FCOCCCc1ccccc1 34a_100000210828_100015361967 [1,0,0,0,0,0|2,0,1]=4 812 B12R1.8 FCOCCCc1ccccc1 7a_100000210828_100015361967 [1,0,0,0,0,0|2,0,1]=4 813 B12R1.8 FCSCCCc1ccccc1 62a_100000211621_100015361967 [1,0,0,0,0,0|2,0,1]=4 814 B12R1.8 FCSCCCc1ccccc1 62a_100015361967_100000211621 [1,0,0,0,0,0|2,0,1]=4 815 B12R1.8 N#CCCCOc1ccccc1 7a_100000210340_100000687738 [1,0,0,0,0,0|2,0,1]=4 816 B12R1.8 N#CCCCSc1ccccc1 62a_100000687738_100000041952 [1,0,0,0,0,0|2,0,1]=4 817 B12R1.8 N#CCCCSc1ccccc1 62a_100000719477_100000687738 [1,0,0,0,0,0|2,0,1]=4 818 B12R1.8 N#CCCNCc1ccccc1 2230a_100015324214_100011215226 [1,0,0,0,0,0|2,0,1]=4 819 B12R1.8 N#CCCNCc1ccccc1 270004a_100000720768_100015611070 [1,0,0,0,0,0|2,0,1]=4 820 B12R1.8 N#CCCOCc1ccccc1 7a_100000210790_100000184422 [1,0,0,0,0,0|2,0,1]=4 821 B12R1.8 N#CCCSCc1ccccc1 62a_100000211182_100011215226 [1,0,0,0,0,0|2,0,1]=4 822 B12R1.8 N#CCCSCc1ccccc1 62a_100011215226_100015291786 [1,0,0,0,0,0|2,0,1]=4 823 B12R1.8 N#CCNCCc1ccccc1 2230a_100000106460_100011215382 [1,0,0,0,0,0|2,0,1]=4 824 B12R1.8 N#CCOCCc1ccccc1 7a_100000210268_100011215382 [1,0,0,0,0,0|2,0,1]=4 825 B12R1.8 N#CCSCCc1ccccc1 62a_100000765856_100011215382 [1,0,0,0,0,0|2,0,1]=4 826 B12R1.8 N#CCSCCc1ccccc1 62a_100011215382_100011218657 [1,0,0,0,0,0|2,0,1]=4 827 B12R1.8 NCCCOCc1ccccc1 34a_100000182051_100015291786 [1,0,0,0,0,0|2,0,1]=4 828 B12R1.8 NCCOCCc1ccccc1 34a_100000210304_100000765856 [1,0,0,0,0,0|2,0,1]=4 829 B12R1.8 NOCCOCc1ccccc1 34a_100000700252_100015291786 [1,0,0,0,0,0|3,0,0]=4 830 B12R1.8 O=CCCCOc1ccccc1 7a_100000210340_200011292268 [1,0,0,0,0,0|1,0,0]=2 831 B12R1.8 O=CCCCOc1cccnc1 7a_100000210849_200011292268 [1,0,0,0,0,0|2,0,0]=3 832 B12R1.8 O=CCCCOc1cncnc1 7a_100000754086_200011292268 [1,0,0,0,0,0|3,0,0]=4 833 B12R1.8 O=CCCCSc1ccccc1 62a_100000719477_200011292268 [1,0,0,0,0,0|1,0,0]=2 834 B12R1.8 O=CCCCSc1ccccc1 62a_200011292268_100000041952 [1,0,0,0,0,0|1,0,0]=2 835 B12R1.8 O=CCCCSc1ccccn1 62a_100011216584_200011292268 [1,0,0,0,0,0|2,0,0]=3 836 B12R1.8 O=CCCCSc1ccccn1 62a_200011292268_100011216584 [1,0,0,0,0,0|2,0,0]=3 837 B12R1.8 O=CCCCSc1cccnc1 62a_100000210063_200011292268 [1,0,0,0,0,0|2,0,0]=3 838 B12R1.8 O=CCCCSc1cccnc1 62a_200011292268_100000210063 [1,0,0,0,0,0|2,0,0]=3 839 B12R1.8 O=CCCCSc1cccnn1 62a_100016991348_200011292268 [1,0,0,0,0,0|3,0,0]=4 840 B12R1.8 O=CCCCSc1cccnn1 62a_200011292268_100016991348 [1,0,0,0,0,0|3,0,0]=4 841 B12R1.8 O=CCCCSc1ccncc1 62a_100000728582_200011292268 [1,0,0,0,0,0|2,0,0]=3 842 B12R1.8 O=CCCCSc1ccncc1 62a_200011292268_100000728582 [1,0,0,0,0,0|2,0,0]=3 843 B12R1.8 O=CCCCSc1ccncn1 62a_100000703185_200011292268 [1,0,0,0,0,0|3,0,0]=4 844 B12R1.8 O=CCCCSc1ccncn1 62a_200011292268_100000703185 [1,0,0,0,0,0|3,0,0]=4 845 B12R1.8 O=CCCCSc1ccnnc1 62a_100000732662_200011292268 [1,0,0,0,0,0|3,0,0]=4 846 B12R1.8 O=CCCCSc1ccnnc1 62a_200011292268_100000732662 [1,0,0,0,0,0|3,0,0]=4 847 B12R1.8 O=CCCCSc1cnccn1 62a_100000211759_200011292268 [1,0,0,0,0,0|3,0,0]=4 848 B12R1.8 O=CCCCSc1cnccn1 62a_200011292268_100000211759 [1,0,0,0,0,0|3,0,0]=4 849 B12R1.8 O=CCCCSc1cncnc1 62a_100011206942_200011292268 [1,0,0,0,0,0|3,0,0]=4 850 B12R1.8 O=CCCCSc1cncnc1 62a_200011292268_100011206942 [1,0,0,0,0,0|3,0,0]=4 851 B12R1.8 O=CCCCSc1ncccn1 62a_100000211032_200011292268 [1,0,0,0,0,0|3,0,0]=4 852 B12R1.8 O=CCCCSc1ncccn1 62a_200011292268_100000211032 [1,0,0,0,0,0|3,0,0]=4 853 B12R1.8 O=CCNCCc1ccccc1 2230a_100000106460_200015260668 [1,0,0,0,0,0|1,0,0]=2 854 B12R1.8 O=CCNCCc1ccccc1 34a_100000106460_200009817547 [1,0,0,0,0,0|1,0,0]=2 855 B12R1.8 O=CCNCCc1cccnc1 2230a_100000736294_200015260668 [1,0,0,0,0,0|2,0,0]=3 856 B12R1.8 O=CCOCCc1ccccc1 34a_100000210268_200009817547 [1,0,0,0,0,0|1,0,0]=2 857 B12R1.8 O=CCOCCc1ccccc1 7a_100000210268_200015260668 [1,0,0,0,0,0|1,0,0]=2 858 B12R1.8 O=CCOCCc1ccccn1 34a_100000210271_200009817547 [1,0,0,0,0,0|2,0,0]=3 859 B12R1.8 O=CCOCCc1cccnc1 34a_100011217484_200009817547 [1,0,0,0,0,0|2,0,0]=3 860 B12R1.8 O=CCOCCc1ccncc1 34a_100011216225_200009817547 [1,0,0,0,0,0|2,0,0]=3 861 B12R1.8 O=CCOCCc1cnccn1 34a_100011349526_200009817547 [1,0,0,0,0,0|3,0,0]=4 862 B12R1.8 O=CCOCCc1cncnc1 34a_100011709255_200009817547 [1,0,0,0,0,0|3,0,0]=4 863 B12R1.8 O=CCSCCc1ccccc1 62a_100000765856_200015260668 [1,0,0,0,0,0|1,0,0]=2 864 B12R1.8 O=CCSCCc1ccccc1 62a_200015260668_100011218657 [1,0,0,0,0,0|1,0,0]=2 865 B12R1.8 O=CCSCCc1ccccn1 62a_100015183660_200015260668 [1,0,0,0,0,0|2,0,0]=3 866 B12R1.8 O=CCSCCc1ccccn1 62a_200015260668_100015183660 [1,0,0,0,0,0|2,0,0]=3 867 B12R1.8 O=CCSCCc1cccnc1 62a_200011713674_200015260668 [1,0,0,0,0,0|2,0,0]=3 868 B12R1.8 O=CCSCCc1cccnc1 62a_200015260668_200011713674 [1,0,0,0,0,0|2,0,0]=3 869 B12R1.8 O=CCSCCc1ccncc1 62a_100000723409_200015260668 [1,0,0,0,0,0|2,0,0]=3 870 B12R1.8 O=CCSCCc1ccncc1 62a_200015260668_100000723409 [1,0,0,0,0,0|2,0,0]=3 871 B12R1.8 O=CCSCSc1ccccc1 62a_100011218342_200015260668 [1,0,0,0,0,0|2,0,0]=3 872 B12R1.8 O=CCSCSc1ccccc1 62a_200015260668_100011218342 [1,0,0,0,0,0|2,0,0]=3 873 B12R1.8 OCCCCNc1ccccc1 34a_100000106764_100011216708 [1,0,0,0,0,0|1,0,1]=3 874 B12R1.8 OCCCCOc1ccccc1 34a_100000210340_100011216708 [1,0,0,0,0,0|1,0,1]=3 875 B12R1.8 OCCCCOc1ccccc1 7a_100000210340_100000210776 [1,0,0,0,0,0|1,0,1]=3 876 B12R1.8 OCCCCOc1cccnc1 34a_100000210849_100011216708 [1,0,0,0,0,0|2,0,1]=4 877 B12R1.8 OCCCCOc1cccnc1 7a_100000210849_100000210776 [1,0,0,0,0,0|2,0,1]=4 878 B12R1.8 OCCCCOc1ccncc1 34a_100000212176_100011216708 [1,0,0,0,0,0|2,0,1]=4 879 B12R1.8 OCCCCSc1ccccc1 62a_100000210776_100000041952 [1,0,0,0,0,0|1,0,1]=3 880 B12R1.8 OCCCCSc1ccccc1 62a_100000719477_100000210776 [1,0,0,0,0,0|1,0,1]=3 881 B12R1.8 OCCCCSc1ccccn1 62a_100000210776_100011216584 [1,0,0,0,0,0|2,0,1]=4 882 B12R1.8 OCCCCSc1ccccn1 62a_100011216584_100000210776 [1,0,0,0,0,0|2,0,1]=4 883 B12R1.8 OCCCCSc1cccnc1 62a_100000210063_100000210776 [1,0,0,0,0,0|2,0,1]=4 884 B12R1.8 OCCCCSc1cccnc1 62a_100000210776_100000210063 [1,0,0,0,0,0|2,0,1]=4 885 B12R1.8 OCCCCSc1ccncc1 62a_100000210776_100000728582 [1,0,0,0,0,0|2,0,1]=4 886 B12R1.8 OCCCCSc1ccncc1 62a_100000728582_100000210776 [1,0,0,0,0,0|2,0,1]=4 887 B12R1.8 OCCCNCc1ccccc1 207a_100000182051_100015611070 [1,0,0,0,0,0|1,0,1]=3 888 B12R1.8 OCCCNCc1ccccc1 2230a_100015324214_100000230001 [1,0,0,0,0,0|1,0,1]=3 889 B12R1.8 OCCCNCc1ccccc1 270004a_100000182051_100015611070 [1,0,0,0,0,0|1,0,1]=3 890 B12R1.8 OCCCNCc1ccccc1 34a_100015324214_100000230001 [1,0,0,0,0,0|1,0,1]=3 891 B12R1.8 OCCCNCc1ccccn1 207a_100000182051_100000209966 [1,0,0,0,0,0|2,0,1]=4 892 B12R1.8 OCCCNCc1ccccn1 270004a_100000182051_100000209966 [1,0,0,0,0,0|2,0,1]=4 893 B12R1.8 OCCCNCc1cccnc1 207a_100000182051_100000209961 [1,0,0,0,0,0|2,0,1]=4 894 B12R1.8 OCCCNCc1cccnc1 270004a_100000182051_100000209961 [1,0,0,0,0,0|2,0,1]=4 895 B12R1.8 OCCCNCc1ccncc1 207a_100000182051_100000186114 [1,0,0,0,0,0|2,0,1]=4 896 B12R1.8 OCCCOCc1ccccc1 34a_100000210790_100000230001 [1,0,0,0,0,0|1,0,1]=3 897 B12R1.8 OCCCOCc1ccccc1 7a_100000210790_100011215043 [1,0,0,0,0,0|1,0,1]=3 898 B12R1.8 OCCCSCc1ccccc1 62a_100000211182_100011215043 [1,0,0,0,0,0|1,0,1]=3 899 B12R1.8 OCCCSCc1ccccc1 62a_100011215043_100015291786 [1,0,0,0,0,0|1,0,1]=3 900 B12R1.8 OCCCSCc1ccccn1 62a_100000721315_100011215043 [1,0,0,0,0,0|2,0,1]=4 901 B12R1.8 OCCCSCc1ccccn1 62a_100011215043_100000721315 [1,0,0,0,0,0|2,0,1]=4 902 B12R1.8 OCCCSCc1cccnc1 62a_100000741622_100011215043 [1,0,0,0,0,0|2,0,1]=4 903 B12R1.8 OCCCSCc1cccnc1 62a_100011215043_100000741622 [1,0,0,0,0,0|2,0,1]=4 904 B12R1.8 OCCCSCc1ccncc1 62a_100011215043_100015193705 [1,0,0,0,0,0|2,0,1]=4 905 B12R1.8 OCCCSCc1ccncc1 62a_100015193705_100011215043 [1,0,0,0,0,0|2,0,1]=4 906 B12R1.8 OCCNCCc1ccccc1 2230a_100000106460_100000211926 [1,0,0,0,0,0|1,0,1]=3 907 B12R1.8 OCCNCCc1ccccc1 2230a_100016997473_100000765856 [1,0,0,0,0,0|1,0,1]=3 908 B12R1.8 OCCNCCc1ccccc1 34a_100000106460_100000211926 [1,0,0,0,0,0|1,0,1]=3 909 B12R1.8 OCCNCCc1ccccc1 34a_100016990907_100000765856 [1,0,0,0,0,0|1,0,1]=3 910 B12R1.8 OCCNCCc1ccccn1 2230a_100016997473_100015183660 [1,0,0,0,0,0|2,0,1]=4 911 B12R1.8 OCCNCCc1cccnc1 2230a_100000736294_100000211926 [1,0,0,0,0,0|2,0,1]=4 912 B12R1.8 OCCNCCc1cccnc1 2230a_100016997473_200011713674 [1,0,0,0,0,0|2,0,1]=4 913 B12R1.8 OCCNCCc1ccncc1 2230a_100016997473_100000723409 [1,0,0,0,0,0|2,0,1]=4 914 B12R1.8 OCCNCSc1ccccc1 2230a_100016997473_100011218342 [1,0,0,0,0,0|2,0,1]=4 915 B12R1.8 OCCOCCc1ccccc1 34a_100000210268_100000211926 [1,0,0,0,0,0|1,0,1]=3 916 B12R1.8 OCCOCCc1ccccc1 7a_100000210268_100000211926 [1,0,0,0,0,0|1,0,1]=3 917 B12R1.8 OCCOCCc1ccccn1 34a_100000210271_100000211926 [1,0,0,0,0,0|2,0,1]=4 918 B12R1.8 OCCOCCc1cccnc1 34a_100011217484_100000211926 [1,0,0,0,0,0|2,0,1]=4 919 B12R1.8 OCCOCCc1ccncc1 34a_100011216225_100000211926 [1,0,0,0,0,0|2,0,1]=4 920 B12R1.8 OCCSCCc1ccccc1 62a_100000211926_100011218657 [1,0,0,0,0,0|1,0,1]=3 921 B12R1.8 OCCSCCc1ccccc1 62a_100000765856_100000211926 [1,0,0,0,0,0|1,0,1]=3 922 B12R1.8 OCCSCCc1ccccn1 62a_100000211926_100015183660 [1,0,0,0,0,0|2,0,1]=4 923 B12R1.8 OCCSCCc1ccccn1 62a_100015183660_100000211926 [1,0,0,0,0,0|2,0,1]=4 924 B12R1.8 OCCSCCc1cccnc1 62a_100000211926_200011713674 [1,0,0,0,0,0|2,0,1]=4 925 B12R1.8 OCCSCCc1cccnc1 62a_200011713674_100000211926 [1,0,0,0,0,0|2,0,1]=4 926 B12R1.8 OCCSCCc1ccncc1 62a_100000211926_100000723409 [1,0,0,0,0,0|2,0,1]=4 927 B12R1.8 OCCSCCc1ccncc1 62a_100000723409_100000211926 [1,0,0,0,0,0|2,0,1]=4 928 B12R1.8 OCCSCSc1ccccc1 62a_100000211926_100011218342 [1,0,0,0,0,0|2,0,1]=4 929 B12R1.8 OCCSCSc1ccccc1 62a_100011218342_100000211926 [1,0,0,0,0,0|2,0,1]=4 930 B12R1.8 [13CH3]NCCCCc1ccccc1 2230a_100015280158_200025704644 [1,0,0,0,0,0|2,0,0]=3 931 B12R1.8 [13CH3]NCCCCc1ccccc1 34a_100015280158_200025704644 [1,0,0,0,0,0|2,0,0]=3 932 B12R1.8 [13CH3]NCCCOc1ccccc1 2230a_100000216521_200025704644 [1,0,0,0,0,0|3,0,0]=4 933 B12R1.8 [13CH3]NCCCOc1ccccc1 34a_100000216521_200025704644 [1,0,0,0,0,0|3,0,0]=4 934 B12R1.8 [13CH3]NCCCSc1ccccc1 2230a_100000184639_200025704644 [1,0,0,0,0,0|3,0,0]=4 935 B12R1.8 [13CH3]NCCOCc1ccccc1 2230a_100000753106_200025704644 [1,0,0,0,0,0|3,0,0]=4 936 B12R1.8 [13CH3]NCCOCc1ccccc1 34a_100000753106_200025704644 [1,0,0,0,0,0|3,0,0]=4 937 B12R1.8 [13CH3]NCCSCc1ccccc1 2230a_100000189534_200025704644 [1,0,0,0,0,0|3,0,0]=4 938 B12R1.8 [13CH3]NCCSCc1ccccc1 34a_100000189534_200025704644 [1,0,0,0,0,0|3,0,0]=4 939 B12R1.8 [13CH3]NCCSCc1ccccc1 7a_100000189534_200025704644 [1,0,0,0,0,0|3,0,0]=4 940 B12R1.8 [13CH3]OCCCCc1ccccc1 34a_100000703073_200025704644 [1,0,0,0,0,0|2,0,0]=3 941 B12R1.8 [13CH3]OCCCCc1ccccc1 7a_100000703073_200025704644 [1,0,0,0,0,0|2,0,0]=3 942 B12R1.8 [13CH3]OCCCCc1ccccn1 34a_100012186994_200025704644 [1,0,0,0,0,0|3,0,0]=4 943 B12R1.8 [13CH3]OCCCCc1cccnc1 34a_100012039607_200025704644 [1,0,0,0,0,0|3,0,0]=4 944 B12R1.8 [13CH3]OCCCCc1cccnc1 7a_100012039607_200025704644 [1,0,0,0,0,0|3,0,0]=4 945 B12R1.8 [13CH3]OCCCCc1ccncc1 34a_100011787716_200025704644 [1,0,0,0,0,0|3,0,0]=4 946 B12R1.8 [13CH3]OCCCNc1ccccc1 34a_100000212590_200025704644 [1,0,0,0,0,0|3,0,0]=4 947 B12R1.8 [13CH3]OCCCOc1ccccc1 34a_100011215863_200025704644 [1,0,0,0,0,0|3,0,0]=4 948 B12R1.8 [13CH3]OCCCOc1ccccc1 7a_100011215863_200025704644 [1,0,0,0,0,0|3,0,0]=4 949 B12R1.8 [13CH3]OCCNCc1ccccc1 34a_100000180844_200025704644 [1,0,0,0,0,0|3,0,0]=4 950 B12R1.8 [13CH3]OCCOCc1ccccc1 34a_100000759325_200025704644 [1,0,0,0,0,0|3,0,0]=4 951 B12R1.8 [13CH3]OCCOCc1ccccc1 7a_100000759325_200025704644 [1,0,0,0,0,0|3,0,0]=4 952 B12R1.8 [13CH3]OCCSCc1ccccc1 34a_100011205989_200025704644 [1,0,0,0,0,0|3,0,0]=4 953 B12R1.8 [13CH3]OCCSCc1ccccc1 7a_100011205989_200025704644 [1,0,0,0,0,0|3,0,0]=4 954 B12R1.8 [13CH3]SCCCCc1ccccc1 62a_100000701786_200025704644 [1,0,0,0,0,0|2,0,0]=3 955 B12R1.8 [13CH3]SCCCCc1ccccc1 62a_200025704644_100000701786 [1,0,0,0,0,0|2,0,0]=3 956 B12R1.8 [13CH3]SCCCCc1ccncc1 62a_100020630000_200025704644 [1,0,0,0,0,0|3,0,0]=4 957 B12R1.8 [13CH3]SCCCCc1ccncc1 62a_200025704644_100020630000 [1,0,0,0,0,0|3,0,0]=4 958 B12R1.8 [13CH3]SCCCOc1ccccc1 62a_100000199009_200025704644 [1,0,0,0,0,0|3,0,0]=4 959 B12R1.8 [13CH3]SCCCOc1ccccc1 62a_200025704644_100000199009 [1,0,0,0,0,0|3,0,0]=4 960 B12R1.8 [13CH3]SCCCSc1ccccc1 62a_200011203293_200025704644 [1,0,0,0,0,0|3,0,0]=4 961 B12R1.8 [13CH3]SCCCSc1ccccc1 62a_200025704644_200011203293 [1,0,0,0,0,0|3,0,0]=4 962 B12R1.8 [13CH3]SCCOCc1ccccc1 62a_100000234347_200025704644 [1,0,0,0,0,0|3,0,0]=4 963 B12R1.8 [13CH3]SCCOCc1ccccc1 62a_200025704644_100000234347 [1,0,0,0,0,0|3,0,0]=4 964 B12R1.8 [13CH3]SCCSCc1ccccc1 62a_200011297719_200025704644 [1,0,0,0,0,0|3,0,0]=4 965 B12R1.8 [13CH3]SCCSCc1ccccc1 62a_200025704644_200011297719 [1,0,0,0,0,0|3,0,0]=4 966 B14R1.148 C=C(Br)CCOCc1cccc(c1)Br 34a_100009813270_100000698116 [0,1,0,0,0,0|3,0,0]=4 967 B14R1.148 C=C(Br)CCOCc1cccc(c1)C 34a_100009813270_100000211840 [0,1,0,0,0,0|3,0,0]=4 968 B14R1.148 C=C(Br)CCOCc1cccc(c1)Cl 34a_100009813270_100000187163 [0,1,0,0,0,0|3,0,0]=4 969 B14R1.148 C=C(Br)CCOCc1cccc(c1)F 34a_100009813270_100000187166 [0,1,0,0,0,0|3,0,0]=4 970 B14R1.148 C=C(Br)CCOCc1cccc(c1)I 34a_100009813270_100011218688 [0,1,0,0,0,0|3,0,0]=4 971 B14R1.148 C=C(Br)CCOCc1cccc(c1)O 34a_100009813270_100011660834 [0,1,0,0,0,0|3,0,0]=4 972 B14R1.148 C=C(C)CCNCc1cccc(c1)Br 2230a_100000174977_100000730704 [0,1,0,0,0,0|3,0,0]=4 973 B14R1.148 C=C(C)CCNCc1cccc(c1)Br 34a_100000174977_100000730704 [0,1,0,0,0,0|3,0,0]=4 974 B14R1.148 C=C(C)CCNCc1cccc(c1)C 2230a_100000185548_100000730704 [0,1,0,0,0,0|3,0,0]=4 975 B14R1.148 C=C(C)CCNCc1cccc(c1)C 34a_100000185548_100000730704 [0,1,0,0,0,0|3,0,0]=4 976 B14R1.148 C=C(C)CCNCc1cccc(c1)Cl 2230a_100000174878_100000730704 [0,1,0,0,0,0|3,0,0]=4 977 B14R1.148 C=C(C)CCNCc1cccc(c1)Cl 34a_100000174878_100000730704 [0,1,0,0,0,0|3,0,0]=4 978 B14R1.148 C=C(C)CCNCc1cccc(c1)F 2230a_100000174948_100000730704 [0,1,0,0,0,0|3,0,0]=4 979 B14R1.148 C=C(C)CCNCc1cccc(c1)F 34a_100000174948_100000730704 [0,1,0,0,0,0|3,0,0]=4 980 B14R1.148 C=C(C)CCNCc1cccc(c1)I 2230a_100000106179_100000730704 [0,1,0,0,0,0|3,0,0]=4 981 B14R1.148 C=C(C)CCNCc1cccc(c1)I 34a_100000106179_100000730704 [0,1,0,0,0,0|3,0,0]=4 982 B14R1.148 C=C(C)CCNCc1cccc(c1)O 2230a_100000743036_100000730704 [0,1,0,0,0,0|3,0,0]=4 983 B14R1.148 C=C(C)CCNCc1cccc(c1)O 34a_100000743036_100000730704 [0,1,0,0,0,0|3,0,0]=4 984 B14R1.148 C=C(C)CCOCc1cccc(c1)Br 34a_100000687537_100000730704 [0,1,0,0,0,0|3,0,0]=4 985 B14R1.148 C=C(C)CCOCc1cccc(c1)Br 34a_100000764851_100000698116 [0,1,0,0,0,0|3,0,0]=4 986 B14R1.148 C=C(C)CCOCc1cccc(c1)Br 7a_100000687537_100000730704 [0,1,0,0,0,0|3,0,0]=4 987 B14R1.148 C=C(C)CCOCc1cccc(c1)C 34a_100000764851_100000211840 [0,1,0,0,0,0|3,0,0]=4 988 B14R1.148 C=C(C)CCOCc1cccc(c1)C 34a_100011217746_100000730704 [0,1,0,0,0,0|3,0,0]=4 989 B14R1.148 C=C(C)CCOCc1cccc(c1)C 7a_100011217746_100000730704 [0,1,0,0,0,0|3,0,0]=4 990 B14R1.148 C=C(C)CCOCc1cccc(c1)Cl 34a_100000241301_100000730704 [0,1,0,0,0,0|3,0,0]=4 991 B14R1.148 C=C(C)CCOCc1cccc(c1)Cl 34a_100000764851_100000187163 [0,1,0,0,0,0|3,0,0]=4 992 B14R1.148 C=C(C)CCOCc1cccc(c1)Cl 7a_100000241301_100000730704 [0,1,0,0,0,0|3,0,0]=4 993 B14R1.148 C=C(C)CCOCc1cccc(c1)F 34a_100000210976_100000730704 [0,1,0,0,0,0|3,0,0]=4 994 B14R1.148 C=C(C)CCOCc1cccc(c1)F 34a_100000764851_100000187166 [0,1,0,0,0,0|3,0,0]=4 995 B14R1.148 C=C(C)CCOCc1cccc(c1)F 7a_100000210976_100000730704 [0,1,0,0,0,0|3,0,0]=4 996 B14R1.148 C=C(C)CCOCc1cccc(c1)I 34a_100000764851_100011218688 [0,1,0,0,0,0|3,0,0]=4 997 B14R1.148 C=C(C)CCOCc1cccc(c1)I 34a_100011215336_100000730704 [0,1,0,0,0,0|3,0,0]=4 998 B14R1.148 C=C(C)CCOCc1cccc(c1)I 7a_100011215336_100000730704 [0,1,0,0,0,0|3,0,0]=4 999 B14R1.148 C=C(C)CCOCc1cccc(c1)N 34a_100000211919_100000730704 [0,1,0,0,0,0|3,0,0]=4 1000 B14R1.148 C=C(C)CCOCc1cccc(c1)O 34a_100000764851_100011660834 [0,1,0,0,0,0|3,0,0]=4 1001 B14R1.148 C=C(C)CCSCc1cccc(c1)Br 62a_100000211773_100000730704 [0,1,0,0,0,0|3,0,0]=4 1002 B14R1.148 C=C(C)CCSCc1cccc(c1)Br 62a_100000730704_100000211773 [0,1,0,0,0,0|3,0,0]=4 1003 B14R1.148 C=C(C)CCSCc1cccc(c1)C 62a_100000211840_100000730704 [0,1,0,0,0,0|3,0,0]=4 1004 B14R1.148 C=C(C)CCSCc1cccc(c1)C 62a_100000730704_100000211840 [0,1,0,0,0,0|3,0,0]=4 1005 B14R1.148 C=C(C)CCSCc1cccc(c1)Cl 62a_100000187163_100000730704 [0,1,0,0,0,0|3,0,0]=4 1006 B14R1.148 C=C(C)CCSCc1cccc(c1)Cl 62a_100000730704_100000187163 [0,1,0,0,0,0|3,0,0]=4 1007 B14R1.148 C=C(C)CCSCc1cccc(c1)F 62a_100000230114_100000730704 [0,1,0,0,0,0|3,0,0]=4 1008 B14R1.148 C=C(C)CCSCc1cccc(c1)F 62a_100000730704_100000230114 [0,1,0,0,0,0|3,0,0]=4 1009 B14R1.148 C=C(C)CCSCc1cccc(c1)I 62a_100000730704_100011218688 [0,1,0,0,0,0|3,0,0]=4 1010 B14R1.148 C=C(C)CCSCc1cccc(c1)I 62a_100011218688_100000730704 [0,1,0,0,0,0|3,0,0]=4 1011 B14R1.148 C=C(C)CCSCc1cccc(c1)O 62a_100000730704_100011660834 [0,1,0,0,0,0|3,0,0]=4 1012 B14R1.148 C=C(C)CCSCc1cccc(c1)O 62a_100011660834_100000730704 [0,1,0,0,0,0|3,0,0]=4 1013 B14R1.148 C=C(C)CNCCc1cccc(c1)Br 2230a_100011207229_100000748629 [0,1,0,0,0,0|3,0,0]=4 1014 B14R1.148 C=C(C)CNCCc1cccc(c1)Br 34a_100011207229_100000748629 [0,1,0,0,0,0|3,0,0]=4 1015 B14R1.148 C=C(C)CNCCc1cccc(c1)C 2230a_100000749837_100000748629 [0,1,0,0,0,0|3,0,0]=4 1016 B14R1.148 C=C(C)CNCCc1cccc(c1)C 34a_100000749837_100000748629 [0,1,0,0,0,0|3,0,0]=4 1017 B14R1.148 C=C(C)CNCCc1cccc(c1)Cl 2230a_100000185263_100000748629 [0,1,0,0,0,0|3,0,0]=4 1018 B14R1.148 C=C(C)CNCCc1cccc(c1)Cl 34a_100000185263_100000748629 [0,1,0,0,0,0|3,0,0]=4 1019 B14R1.148 C=C(C)CNCCc1cccc(c1)F 2230a_100000205154_100000748629 [0,1,0,0,0,0|3,0,0]=4 1020 B14R1.148 C=C(C)CNCCc1cccc(c1)F 34a_100000205154_100000748629 [0,1,0,0,0,0|3,0,0]=4 1021 B14R1.148 C=C(C)CNCCc1cccc(c1)O 2230a_100000747277_100000748629 [0,1,0,0,0,0|3,0,0]=4 1022 B14R1.148 C=C(C)CNCCc1cccc(c1)O 34a_100000747277_100000748629 [0,1,0,0,0,0|3,0,0]=4 1023 B14R1.148 C=C(C)COCCc1cccc(c1)Br 34a_100000210245_100011740638 [0,1,0,0,0,0|3,0,0]=4 1024 B14R1.148 C=C(C)COCCc1cccc(c1)Br 34a_100011217444_100000748629 [0,1,0,0,0,0|3,0,0]=4 1025 B14R1.148 C=C(C)COCCc1cccc(c1)Br 7a_100011217444_100000748629 [0,1,0,0,0,0|3,0,0]=4 1026 B14R1.148 C=C(C)COCCc1cccc(c1)C 34a_100000210245_100011713685 [0,1,0,0,0,0|3,0,0]=4 1027 B14R1.148 C=C(C)COCCc1cccc(c1)C 34a_100011217157_100000748629 [0,1,0,0,0,0|3,0,0]=4 1028 B14R1.148 C=C(C)COCCc1cccc(c1)C 7a_100011217157_100000748629 [0,1,0,0,0,0|3,0,0]=4 1029 B14R1.148 C=C(C)COCCc1cccc(c1)Cl 34a_100000210245_100011713710 [0,1,0,0,0,0|3,0,0]=4 1030 B14R1.148 C=C(C)COCCc1cccc(c1)Cl 34a_100000754733_100000748629 [0,1,0,0,0,0|3,0,0]=4 1031 B14R1.148 C=C(C)COCCc1cccc(c1)Cl 7a_100000754733_100000748629 [0,1,0,0,0,0|3,0,0]=4 1032 B14R1.148 C=C(C)COCCc1cccc(c1)F 34a_100000210245_100011217235 [0,1,0,0,0,0|3,0,0]=4 1033 B14R1.148 C=C(C)COCCc1cccc(c1)F 34a_100000763591_100000748629 [0,1,0,0,0,0|3,0,0]=4 1034 B14R1.148 C=C(C)COCCc1cccc(c1)F 7a_100000763591_100000748629 [0,1,0,0,0,0|3,0,0]=4 1035 B14R1.148 C=C(C)COCCc1cccc(c1)N 34a_100011996697_100000748629 [0,1,0,0,0,0|3,0,0]=4 1036 B14R1.148 C=C(C)CSCCc1cccc(c1)Br 62a_100000748629_100011740638 [0,1,0,0,0,0|3,0,0]=4 1037 B14R1.148 C=C(C)CSCCc1cccc(c1)Br 62a_100011740638_100000211660 [0,1,0,0,0,0|3,0,0]=4 1038 B14R1.148 C=C(C)CSCCc1cccc(c1)C 62a_100000748629_100011713685 [0,1,0,0,0,0|3,0,0]=4 1039 B14R1.148 C=C(C)CSCCc1cccc(c1)C 62a_100011713685_100000211660 [0,1,0,0,0,0|3,0,0]=4 1040 B14R1.148 C=C(C)CSCCc1cccc(c1)Cl 62a_100000748629_100011713710 [0,1,0,0,0,0|3,0,0]=4 1041 B14R1.148 C=C(C)CSCCc1cccc(c1)Cl 62a_100011713710_100000211660 [0,1,0,0,0,0|3,0,0]=4 1042 B14R1.148 C=C(C)CSCCc1cccc(c1)F 62a_100000748629_100011217235 [0,1,0,0,0,0|3,0,0]=4 1043 B14R1.148 C=C(C)CSCCc1cccc(c1)F 62a_100011217235_100000211660 [0,1,0,0,0,0|3,0,0]=4 1044 B14R1.148 C=C(F)CNCCc1cccc(c1)Br 2230a_100011207229_100009893438 [0,1,0,0,0,0|3,0,0]=4 1045 B14R1.148 C=C(F)CNCCc1cccc(c1)Br 34a_100011207229_100009893438 [0,1,0,0,0,0|3,0,0]=4 1046 B14R1.148 C=C(F)CNCCc1cccc(c1)C 2230a_100000749837_100009893438 [0,1,0,0,0,0|3,0,0]=4 1047 B14R1.148 C=C(F)CNCCc1cccc(c1)C 34a_100000749837_100009893438 [0,1,0,0,0,0|3,0,0]=4 1048 B14R1.148 C=C(F)CNCCc1cccc(c1)Cl 2230a_100000185263_100009893438 [0,1,0,0,0,0|3,0,0]=4 1049 B14R1.148 C=C(F)CNCCc1cccc(c1)Cl 34a_100000185263_100009893438 [0,1,0,0,0,0|3,0,0]=4 1050 B14R1.148 C=C(F)CNCCc1cccc(c1)F 2230a_100000205154_100009893438 [0,1,0,0,0,0|3,0,0]=4 1051 B14R1.148 C=C(F)CNCCc1cccc(c1)F 34a_100000205154_100009893438 [0,1,0,0,0,0|3,0,0]=4 1052 B14R1.148 C=C(F)CNCCc1cccc(c1)O 2230a_100000747277_100009893438 [0,1,0,0,0,0|3,0,0]=4 1053 B14R1.148 C=C(F)CNCCc1cccc(c1)O 34a_100000747277_100009893438 [0,1,0,0,0,0|3,0,0]=4 1054 B14R1.148 C=C(F)COCCc1cccc(c1)Br 34a_100011217444_100009893438 [0,1,0,0,0,0|3,0,0]=4 1055 B14R1.148 C=C(F)COCCc1cccc(c1)Br 34a_200010262243_100011740638 [0,1,0,0,0,0|3,0,0]=4 1056 B14R1.148 C=C(F)COCCc1cccc(c1)Br 7a_100011217444_100000042424 [0,1,0,0,0,0|3,0,0]=4 1057 B14R1.148 C=C(F)COCCc1cccc(c1)C 34a_100011217157_100009893438 [0,1,0,0,0,0|3,0,0]=4 1058 B14R1.148 C=C(F)COCCc1cccc(c1)C 34a_200010262243_100011713685 [0,1,0,0,0,0|3,0,0]=4 1059 B14R1.148 C=C(F)COCCc1cccc(c1)C 7a_100011217157_100000042424 [0,1,0,0,0,0|3,0,0]=4 1060 B14R1.148 C=C(F)COCCc1cccc(c1)Cl 34a_100000754733_100009893438 [0,1,0,0,0,0|3,0,0]=4 1061 B14R1.148 C=C(F)COCCc1cccc(c1)Cl 34a_200010262243_100011713710 [0,1,0,0,0,0|3,0,0]=4 1062 B14R1.148 C=C(F)COCCc1cccc(c1)Cl 7a_100000754733_100000042424 [0,1,0,0,0,0|3,0,0]=4 1063 B14R1.148 C=C(F)COCCc1cccc(c1)F 34a_100000763591_100009893438 [0,1,0,0,0,0|3,0,0]=4 1064 B14R1.148 C=C(F)COCCc1cccc(c1)F 34a_200010262243_100011217235 [0,1,0,0,0,0|3,0,0]=4 1065 B14R1.148 C=C(F)COCCc1cccc(c1)F 7a_100000763591_100000042424 [0,1,0,0,0,0|3,0,0]=4 1066 B14R1.148 C=C(F)COCCc1cccc(c1)N 34a_100011996697_100009893438 [0,1,0,0,0,0|3,0,0]=4 1067 B14R1.148 C=C(F)CSCCc1cccc(c1)Br 62a_100000042424_100011740638 [0,1,0,0,0,0|3,0,0]=4 1068 B14R1.148 C=C(F)CSCCc1cccc(c1)Br 62a_100011740638_100000042424 [0,1,0,0,0,0|3,0,0]=4 1069 B14R1.148 C=C(F)CSCCc1cccc(c1)C 62a_100000042424_100011713685 [0,1,0,0,0,0|3,0,0]=4 1070 B14R1.148 C=C(F)CSCCc1cccc(c1)C 62a_100011713685_100000042424 [0,1,0,0,0,0|3,0,0]=4 1071 B14R1.148 C=C(F)CSCCc1cccc(c1)Cl 62a_100000042424_100011713710 [0,1,0,0,0,0|3,0,0]=4 1072 B14R1.148 C=C(F)CSCCc1cccc(c1)Cl 62a_100011713710_100000042424 [0,1,0,0,0,0|3,0,0]=4 1073 B14R1.148 C=C(F)CSCCc1cccc(c1)F 62a_100000042424_100011217235 [0,1,0,0,0,0|3,0,0]=4 1074 B14R1.148 C=C(F)CSCCc1cccc(c1)F 62a_100011217235_100000042424 [0,1,0,0,0,0|3,0,0]=4 1075 B14R1.148 CC(=O)CCCCc1cccc(c1)Br 1458a_200010160685_200000210301 [0,1,0,0,0,0|1,0,0]=2 1076 B14R1.148 CC(=O)CCCNc1cccc(c1)Br 34a_100000210019_100000685027 [0,1,0,0,0,0|2,0,0]=3 1077 B14R1.148 CC(=O)CCCNc1cccc(c1)C 34a_100000188690_100000685027 [0,1,0,0,0,0|2,0,0]=3 1078 B14R1.148 CC(=O)CCCNc1cccc(c1)Cl 34a_100000185859_100000685027 [0,1,0,0,0,0|2,0,0]=3 1079 B14R1.148 CC(=O)CCCNc1cccc(c1)F 34a_100000210047_100000685027 [0,1,0,0,0,0|2,0,0]=3 1080 B14R1.148 CC(=O)CCCNc1cccc(c1)I 34a_100000211102_100000685027 [0,1,0,0,0,0|2,0,0]=3 1081 B14R1.148 CC(=O)CCCNc1cccc(c1)O 34a_100000210217_100000685027 [0,1,0,0,0,0|2,0,0]=3 1082 B14R1.148 CC(=O)CCCOc1cc[nH]c(=O)c1 34a_100000032262_100000685027 [0,1,0,0,0,0|3,0,0]=4 1083 B14R1.148 CC(=O)CCCOc1ccc[n+](c1)[O-] 34a_100000039713_100000685027 [0,1,0,0,0,0|3,0,0]=4 1084 B14R1.148 CC(=O)CCCOc1ccc[n+](c1)[O-] 7a_100000039713_100011215641 [0,1,0,0,0,0|3,0,0]=4 1085 B14R1.148 CC(=O)CCCOc1cccc(=O)[nH]1 34a_100000033347_100000685027 [0,1,0,0,0,0|3,0,0]=4 1086 B14R1.148 CC(=O)CCCOc1cccc(c1)Br 34a_100000210342_100000685027 [0,1,0,0,0,0|2,0,0]=3 1087 B14R1.148 CC(=O)CCCOc1cccc(c1)Br 7a_100000210342_100011215641 [0,1,0,0,0,0|2,0,0]=3 1088 B14R1.148 CC(=O)CCCOc1cccc(c1)C 1458a_100000070787_100000212303 [0,1,0,0,0,0|2,0,0]=3 1089 B14R1.148 CC(=O)CCCOc1cccc(c1)C 1458a_100000183260_200000210301 [0,1,0,0,0,0|2,0,0]=3 1090 B14R1.148 CC(=O)CCCOc1cccc(c1)C 34a_100000210337_100000685027 [0,1,0,0,0,0|2,0,0]=3 1091 B14R1.148 CC(=O)CCCOc1cccc(c1)C 7a_100000210337_100011215641 [0,1,0,0,0,0|2,0,0]=3 1092 B14R1.148 CC(=O)CCCOc1cccc(c1)Cl 1458a_100000070787_100000742658 [0,1,0,0,0,0|2,0,0]=3 1093 B14R1.148 CC(=O)CCCOc1cccc(c1)Cl 34a_100000210295_100000685027 [0,1,0,0,0,0|2,0,0]=3 1094 B14R1.148 CC(=O)CCCOc1cccc(c1)Cl 7a_100000210295_100011215641 [0,1,0,0,0,0|2,0,0]=3 1095 B14R1.148 CC(=O)CCCOc1cccc(c1)F 34a_100000210426_100000685027 [0,1,0,0,0,0|2,0,0]=3 1096 B14R1.148 CC(=O)CCCOc1cccc(c1)F 7a_100000210426_100011215641 [0,1,0,0,0,0|2,0,0]=3 1097 B14R1.148 CC(=O)CCCOc1cccc(c1)I 34a_100000211634_100000685027 [0,1,0,0,0,0|2,0,0]=3 1098 B14R1.148 CC(=O)CCCOc1cccc(c1)I 7a_100000211634_100011215641 [0,1,0,0,0,0|2,0,0]=3 1099 B14R1.148 CC(=O)CCCOc1cccc(c1)N 34a_100000210217_100000685027 [0,1,0,0,0,0|2,0,0]=3 1100 B14R1.148 CC(=O)CCCOc1cccc(c1)O 1458a_200009913207_200000210301 [0,1,0,0,0,0|2,0,0]=3 1101 B14R1.148 CC(=O)CCCOc1cccc(n1)F 34a_100011432558_100000685027 [0,1,0,0,0,0|3,0,0]=4 1102 B14R1.148 CC(=O)CCCOc1ccnc(c1)C 34a_100000688365_100000685027 [0,1,0,0,0,0|3,0,0]=4 1103 B14R1.148 CC(=O)CCCOc1ccnc(c1)Cl 34a_100000762945_100000685027 [0,1,0,0,0,0|3,0,0]=4 1104 B14R1.148 CC(=O)CCCOc1ccnc(c1)F 34a_100000732698_100000685027 [0,1,0,0,0,0|3,0,0]=4 1105 B14R1.148 CC(=O)CCCOc1ccnc(c1)N 34a_100011834064_100000685027 [0,1,0,0,0,0|3,0,0]=4 1106 B14R1.148 CC(=O)CCCOc1cncc(c1)Br 34a_100000754920_100000685027 [0,1,0,0,0,0|3,0,0]=4 1107 B14R1.148 CC(=O)CCCOc1cncc(c1)Br 7a_100000754920_100011215641 [0,1,0,0,0,0|3,0,0]=4 1108 B14R1.148 CC(=O)CCCOc1cncc(c1)C 34a_100011830280_100000685027 [0,1,0,0,0,0|3,0,0]=4 1109 B14R1.148 CC(=O)CCCOc1cncc(c1)C 7a_100011830280_100011215641 [0,1,0,0,0,0|3,0,0]=4 1110 B14R1.148 CC(=O)CCCOc1cncc(c1)Cl 7a_100000032511_100011215641 [0,1,0,0,0,0|3,0,0]=4 1111 B14R1.148 CC(=O)CCCOc1cncc(c1)F 34a_100011830296_100000685027 [0,1,0,0,0,0|3,0,0]=4 1112 B14R1.148 CC(=O)CCCOc1cncc(c1)F 7a_100011830296_100011215641 [0,1,0,0,0,0|3,0,0]=4 1113 B14R1.148 CC(=O)CCCOc1cncc(c1)N 34a_100011997051_100000685027 [0,1,0,0,0,0|3,0,0]=4 1114 B14R1.148 CC(=O)CCCSc1cc(=O)cc[nH]1 62a_100009817434_100011215641 [0,1,0,0,0,0|3,0,0]=4 1115 B14R1.148 CC(=O)CCCSc1cc(ccn1)C 62a_100000750283_100011215641 [0,1,0,0,0,0|3,0,0]=4 1116 B14R1.148 CC(=O)CCCSc1cc(ccn1)C 62a_100011215641_100000750283 [0,1,0,0,0,0|3,0,0]=4 1117 B14R1.148 CC(=O)CCCSc1cc(ccn1)Cl 62a_100010167805_100011215641 [0,1,0,0,0,0|3,0,0]=4 1118 B14R1.148 CC(=O)CCCSc1cc(ccn1)Cl 62a_100011215641_100010167805 [0,1,0,0,0,0|3,0,0]=4 1119 B14R1.148 CC(=O)CCCSc1cc(ccn1)F 62a_100000764206_100011215641 [0,1,0,0,0,0|3,0,0]=4 1120 B14R1.148 CC(=O)CCCSc1cc(ccn1)F 62a_100011215641_100000764206 [0,1,0,0,0,0|3,0,0]=4 1121 B14R1.148 CC(=O)CCCSc1cc(ccn1)N 62a_100009814236_100011215641 [0,1,0,0,0,0|3,0,0]=4 1122 B14R1.148 CC(=O)CCCSc1cc(ccn1)N 62a_100011215641_100009814236 [0,1,0,0,0,0|3,0,0]=4 1123 B14R1.148 CC(=O)CCCSc1cc(ccn1)O 62a_100011215641_100000762945 [0,1,0,0,0,0|3,0,0]=4 1124 B14R1.148 CC(=O)CCCSc1cc[nH]c(=O)c1 62a_100009816521_100011215641 [0,1,0,0,0,0|3,0,0]=4 1125 B14R1.148 CC(=O)CCCSc1cc[nH]c(=O)c1 62a_100011215641_100009816521 [0,1,0,0,0,0|3,0,0]=4 1126 B14R1.148 CC(=O)CCCSc1ccc[n+](c1)C 62a_100009996589_100011215641 [0,1,0,0,0,0|3,0,0]=4 1127 B14R1.148 CC(=O)CCCSc1ccc[n+](c1)C 62a_100011215641_100009996589 [0,1,0,0,0,0|3,0,0]=4 1128 B14R1.148 CC(=O)CCCSc1ccc[n+](c1)[O-] 62a_100011215641_100009815978 [0,1,0,0,0,0|3,0,0]=4 1129 B14R1.148 CC(=O)CCCSc1cccc(=O)[nH]1 62a_100011215641_100000752884 [0,1,0,0,0,0|3,0,0]=4 1130 B14R1.148 CC(=O)CCCSc1cccc(c1)Br 62a_100000691529_100011215641 [0,1,0,0,0,0|2,0,0]=3 1131 B14R1.148 CC(=O)CCCSc1cccc(c1)Br 62a_100011215641_100000691529 [0,1,0,0,0,0|2,0,0]=3 1132 B14R1.148 CC(=O)CCCSc1cccc(c1)C 62a_100011215228_100011215641 [0,1,0,0,0,0|2,0,0]=3 1133 B14R1.148 CC(=O)CCCSc1cccc(c1)C 62a_100011215641_100011215228 [0,1,0,0,0,0|2,0,0]=3 1134 B14R1.148 CC(=O)CCCSc1cccc(c1)Cl 62a_100000699651_100011215641 [0,1,0,0,0,0|2,0,0]=3 1135 B14R1.148 CC(=O)CCCSc1cccc(c1)Cl 62a_100011215641_100000699651 [0,1,0,0,0,0|2,0,0]=3 1136 B14R1.148 CC(=O)CCCSc1cccc(c1)F 62a_100000685547_100011215641 [0,1,0,0,0,0|2,0,0]=3 1137 B14R1.148 CC(=O)CCCSc1cccc(c1)F 62a_100011215641_100000685547 [0,1,0,0,0,0|2,0,0]=3 1138 B14R1.148 CC(=O)CCCSc1cccc(c1)N 62a_100000210019_100011215641 [0,1,0,0,0,0|2,0,0]=3 1139 B14R1.148 CC(=O)CCCSc1cccc(c1)N 62a_100011215641_100000210019 [0,1,0,0,0,0|2,0,0]=3 1140 B14R1.148 CC(=O)CCCSc1cccc(c1)O 62a_100011215641_100000211634 [0,1,0,0,0,0|2,0,0]=3 1141 B14R1.148 CC(=O)CCCSc1cccc(c1)[S] 62a_100011215641_114929384022 [0,1,0,0,0,0|2,0,0]=3 1142 B14R1.148 CC(=O)CCCSc1cccc(c1)[S] 62a_114929384022_100011215641 [0,1,0,0,0,0|2,0,0]=3 1143 B14R1.148 CC(=O)CCCSc1cccc(n1)Br 62a_100000684672_100011215641 [0,1,0,0,0,0|3,0,0]=4 1144 B14R1.148 CC(=O)CCCSc1cccc(n1)Br 62a_100011215641_100000684672 [0,1,0,0,0,0|3,0,0]=4 1145 B14R1.148 CC(=O)CCCSc1cccc(n1)C 62a_100000742759_100011215641 [0,1,0,0,0,0|3,0,0]=4 1146 B14R1.148 CC(=O)CCCSc1cccc(n1)C 62a_100011215641_100000742759 [0,1,0,0,0,0|3,0,0]=4 1147 B14R1.148 CC(=O)CCCSc1cccc(n1)Cl 62a_100000051397_100011215641 [0,1,0,0,0,0|3,0,0]=4 1148 B14R1.148 CC(=O)CCCSc1cccc(n1)Cl 62a_100011215641_100000051397 [0,1,0,0,0,0|3,0,0]=4 1149 B14R1.148 CC(=O)CCCSc1cccc(n1)F 62a_100009815982_100011215641 [0,1,0,0,0,0|3,0,0]=4 1150 B14R1.148 CC(=O)CCCSc1cccc(n1)F 62a_100011215641_100009815982 [0,1,0,0,0,0|3,0,0]=4 1151 B14R1.148 CC(=O)CCCSc1cccc(n1)N 62a_100000740741_100011215641 [0,1,0,0,0,0|3,0,0]=4 1152 B14R1.148 CC(=O)CCCSc1cccc(n1)N 62a_100011215641_100000740741 [0,1,0,0,0,0|3,0,0]=4 1153 B14R1.148 CC(=O)CCCSc1ccnc(c1)Br 62a_100009814637_100011215641 [0,1,0,0,0,0|3,0,0]=4 1154 B14R1.148 CC(=O)CCCSc1ccnc(c1)Br 62a_100011215641_100009814637 [0,1,0,0,0,0|3,0,0]=4 1155 B14R1.148 CC(=O)CCCSc1ccnc(c1)C 62a_100000758586_100011215641 [0,1,0,0,0,0|3,0,0]=4 1156 B14R1.148 CC(=O)CCCSc1ccnc(c1)C 62a_100011215641_100000758586 [0,1,0,0,0,0|3,0,0]=4 1157 B14R1.148 CC(=O)CCCSc1ccnc(c1)Cl 62a_100000035001_100011215641 [0,1,0,0,0,0|3,0,0]=4 1158 B14R1.148 CC(=O)CCCSc1ccnc(c1)Cl 62a_100011215641_100000035001 [0,1,0,0,0,0|3,0,0]=4 1159 B14R1.148 CC(=O)CCCSc1ccnc(c1)F 62a_100009816116_100011215641 [0,1,0,0,0,0|3,0,0]=4 1160 B14R1.148 CC(=O)CCCSc1ccnc(c1)F 62a_100011215641_100009816116 [0,1,0,0,0,0|3,0,0]=4 1161 B14R1.148 CC(=O)CCCSc1ccnc(c1)N 62a_100000049665_100011215641 [0,1,0,0,0,0|3,0,0]=4 1162 B14R1.148 CC(=O)CCCSc1ccnc(c1)N 62a_100011215641_100000049665 [0,1,0,0,0,0|3,0,0]=4 1163 B14R1.148 CC(=O)CCCSc1cncc(c1)Br 62a_100000728054_100011215641 [0,1,0,0,0,0|3,0,0]=4 1164 B14R1.148 CC(=O)CCCSc1cncc(c1)Br 62a_100011215641_100000728054 [0,1,0,0,0,0|3,0,0]=4 1165 B14R1.148 CC(=O)CCCSc1cncc(c1)C 62a_100000760492_100011215641 [0,1,0,0,0,0|3,0,0]=4 1166 B14R1.148 CC(=O)CCCSc1cncc(c1)C 62a_100011215641_100000760492 [0,1,0,0,0,0|3,0,0]=4 1167 B14R1.148 CC(=O)CCCSc1cncc(c1)Cl 62a_100000049639_100011215641 [0,1,0,0,0,0|3,0,0]=4 1168 B14R1.148 CC(=O)CCCSc1cncc(c1)Cl 62a_100011215641_100000049639 [0,1,0,0,0,0|3,0,0]=4 1169 B14R1.148 CC(=O)CCCSc1cncc(c1)F 62a_100000744099_100011215641 [0,1,0,0,0,0|3,0,0]=4 1170 B14R1.148 CC(=O)CCCSc1cncc(c1)F 62a_100011215641_100000744099 [0,1,0,0,0,0|3,0,0]=4 1171 B14R1.148 CC(=O)CCCSc1cncc(c1)N 62a_100000687067_100011215641 [0,1,0,0,0,0|3,0,0]=4 1172 B14R1.148 CC(=O)CCCSc1cncc(c1)N 62a_100011215641_100000687067 [0,1,0,0,0,0|3,0,0]=4 1173 B14R1.148 CC(=O)CCCSc1cncc(c1)O 62a_100000754920_100011215641 [0,1,0,0,0,0|3,0,0]=4 1174 B14R1.148 CC(=O)CCCSc1cncc(c1)O 62a_100011215641_100000754920 [0,1,0,0,0,0|3,0,0]=4 1175 B14R1.148 CC(=O)CCOCc1cc(ccn1)Br 34a_100000759926_100010173614 [0,1,0,0,0,0|3,0,0]=4 1176 B14R1.148 CC(=O)CCOCc1cc(ccn1)Br 7a_100000759926_100010173614 [0,1,0,0,0,0|3,0,0]=4 1177 B14R1.148 CC(=O)CCOCc1cc(ccn1)C 34a_100000759926_100000718516 [0,1,0,0,0,0|3,0,0]=4 1178 B14R1.148 CC(=O)CCOCc1cc(ccn1)C 7a_100000759926_100000718516 [0,1,0,0,0,0|3,0,0]=4 1179 B14R1.148 CC(=O)CCOCc1cc(ccn1)Cl 34a_100000759926_100016988179 [0,1,0,0,0,0|3,0,0]=4 1180 B14R1.148 CC(=O)CCOCc1cc(ccn1)Cl 7a_100000759926_100016988179 [0,1,0,0,0,0|3,0,0]=4 1181 B14R1.148 CC(=O)CCOCc1ccc[n+](c1)[O-] 7a_100000037817_100000053229 [0,1,0,0,0,0|3,0,0]=4 1182 B14R1.148 CC(=O)CCOCc1cccc(c1)Br 34a_100000759926_100000698116 [0,1,0,0,0,0|2,0,0]=3 1183 B14R1.148 CC(=O)CCOCc1cccc(c1)Br 7a_100000687537_100000053229 [0,1,0,0,0,0|2,0,0]=3 1184 B14R1.148 CC(=O)CCOCc1cccc(c1)Br 7a_100000759926_100000211773 [0,1,0,0,0,0|2,0,0]=3 1185 B14R1.148 CC(=O)CCOCc1cccc(c1)C 34a_100000759926_100000211840 [0,1,0,0,0,0|2,0,0]=3 1186 B14R1.148 CC(=O)CCOCc1cccc(c1)C 7a_100000759926_100000211840 [0,1,0,0,0,0|2,0,0]=3 1187 B14R1.148 CC(=O)CCOCc1cccc(c1)C 7a_100011217746_100000053229 [0,1,0,0,0,0|2,0,0]=3 1188 B14R1.148 CC(=O)CCOCc1cccc(c1)Cl 34a_100000759926_100000187163 [0,1,0,0,0,0|2,0,0]=3 1189 B14R1.148 CC(=O)CCOCc1cccc(c1)Cl 7a_100000241301_100000053229 [0,1,0,0,0,0|2,0,0]=3 1190 B14R1.148 CC(=O)CCOCc1cccc(c1)Cl 7a_100000759926_100000187163 [0,1,0,0,0,0|2,0,0]=3 1191 B14R1.148 CC(=O)CCOCc1cccc(c1)F 34a_100000759926_100000187166 [0,1,0,0,0,0|2,0,0]=3 1192 B14R1.148 CC(=O)CCOCc1cccc(c1)F 7a_100000210976_100000053229 [0,1,0,0,0,0|2,0,0]=3 1193 B14R1.148 CC(=O)CCOCc1cccc(c1)F 7a_100000759926_100000230114 [0,1,0,0,0,0|2,0,0]=3 1194 B14R1.148 CC(=O)CCOCc1cccc(c1)I 34a_100000759926_100011218688 [0,1,0,0,0,0|2,0,0]=3 1195 B14R1.148 CC(=O)CCOCc1cccc(c1)I 7a_100000759926_100011218688 [0,1,0,0,0,0|2,0,0]=3 1196 B14R1.148 CC(=O)CCOCc1cccc(c1)I 7a_100011215336_100000053229 [0,1,0,0,0,0|2,0,0]=3 1197 B14R1.148 CC(=O)CCOCc1cccc(c1)O 34a_100000759926_100011660834 [0,1,0,0,0,0|2,0,0]=3 1198 B14R1.148 CC(=O)CCOCc1cccc(c1)O 7a_100000759926_100000084143 [0,1,0,0,0,0|2,0,0]=3 1199 B14R1.148 CC(=O)CCOCc1cccc(n1)Br 34a_100000759926_100009889011 [0,1,0,0,0,0|3,0,0]=4 1200 B14R1.148 CC(=O)CCOCc1cccc(n1)Br 7a_100000759926_100009889011 [0,1,0,0,0,0|3,0,0]=4 1201 B14R1.148 CC(=O)CCOCc1cccc(n1)C 34a_100000759926_100000757606 [0,1,0,0,0,0|3,0,0]=4 1202 B14R1.148 CC(=O)CCOCc1cccc(n1)C 7a_100000759926_100000757606 [0,1,0,0,0,0|3,0,0]=4 1203 B14R1.148 CC(=O)CCOCc1cccc(n1)Cl 34a_100000759926_100000086093 [0,1,0,0,0,0|3,0,0]=4 1204 B14R1.148 CC(=O)CCOCc1cccc(n1)Cl 7a_100000759926_100000086093 [0,1,0,0,0,0|3,0,0]=4 1205 B14R1.148 CC(=O)CCOCc1cccc(n1)F 34a_100000759926_100009819644 [0,1,0,0,0,0|3,0,0]=4 1206 B14R1.148 CC(=O)CCOCc1cccc(n1)F 7a_100000759926_100009819644 [0,1,0,0,0,0|3,0,0]=4 1207 B14R1.148 CC(=O)CCOCc1ccnc(c1)Br 34a_100000759926_100010243470 [0,1,0,0,0,0|3,0,0]=4 1208 B14R1.148 CC(=O)CCOCc1ccnc(c1)Br 7a_100000759926_100010254460 [0,1,0,0,0,0|3,0,0]=4 1209 B14R1.148 CC(=O)CCOCc1ccnc(c1)Br 7a_100009814636_100000053229 [0,1,0,0,0,0|3,0,0]=4 1210 B14R1.148 CC(=O)CCOCc1ccnc(c1)C 34a_100000759926_200020672517 [0,1,0,0,0,0|3,0,0]=4 1211 B14R1.148 CC(=O)CCOCc1ccnc(c1)C 7a_100000759926_200020672517 [0,1,0,0,0,0|3,0,0]=4 1212 B14R1.148 CC(=O)CCOCc1ccnc(c1)Cl 34a_100000759926_100000764220 [0,1,0,0,0,0|3,0,0]=4 1213 B14R1.148 CC(=O)CCOCc1ccnc(c1)Cl 7a_100000759926_100000764220 [0,1,0,0,0,0|3,0,0]=4 1214 B14R1.148 CC(=O)CCOCc1cncc(c1)Br 34a_100000759926_100000738771 [0,1,0,0,0,0|3,0,0]=4 1215 B14R1.148 CC(=O)CCOCc1cncc(c1)Br 7a_100000759926_100000738771 [0,1,0,0,0,0|3,0,0]=4 1216 B14R1.148 CC(=O)CCOCc1cncc(c1)Br 7a_100011259137_100000053229 [0,1,0,0,0,0|3,0,0]=4 1217 B14R1.148 CC(=O)CCOCc1cncc(c1)C 34a_100000759926_100000716715 [0,1,0,0,0,0|3,0,0]=4 1218 B14R1.148 CC(=O)CCOCc1cncc(c1)C 7a_100000759926_100000716715 [0,1,0,0,0,0|3,0,0]=4 1219 B14R1.148 CC(=O)CCOCc1cncc(c1)C 7a_100011998709_100000053229 [0,1,0,0,0,0|3,0,0]=4 1220 B14R1.148 CC(=O)CCOCc1cncc(c1)Cl 34a_100000759926_100016992070 [0,1,0,0,0,0|3,0,0]=4 1221 B14R1.148 CC(=O)CCOCc1cncc(c1)Cl 7a_100000092867_100000053229 [0,1,0,0,0,0|3,0,0]=4 1222 B14R1.148 CC(=O)CCOCc1cncc(c1)Cl 7a_100000759926_100016992070 [0,1,0,0,0,0|3,0,0]=4 1223 B14R1.148 CC(=O)CCOCc1cncc(c1)F 34a_100000759926_100000725299 [0,1,0,0,0,0|3,0,0]=4 1224 B14R1.148 CC(=O)CCOCc1cncc(c1)F 7a_100000759926_100000725299 [0,1,0,0,0,0|3,0,0]=4 1225 B14R1.148 CC(=O)CCOCc1cncc(c1)F 7a_100011962875_100000053229 [0,1,0,0,0,0|3,0,0]=4 1226 B14R1.148 CC(=O)CCSCc1cc(ccn1)Br 62a_100000053229_100010173614 [0,1,0,0,0,0|3,0,0]=4 1227 B14R1.148 CC(=O)CCSCc1cc(ccn1)Br 62a_100010173614_100000053229 [0,1,0,0,0,0|3,0,0]=4 1228 B14R1.148 CC(=O)CCSCc1cc(ccn1)C 62a_100000053229_100000718516 [0,1,0,0,0,0|3,0,0]=4 1229 B14R1.148 CC(=O)CCSCc1cc(ccn1)C 62a_100000718516_100000053229 [0,1,0,0,0,0|3,0,0]=4 1230 B14R1.148 CC(=O)CCSCc1cc(ccn1)Cl 62a_100000053229_100016988179 [0,1,0,0,0,0|3,0,0]=4 1231 B14R1.148 CC(=O)CCSCc1cc(ccn1)Cl 62a_100016988179_100000053229 [0,1,0,0,0,0|3,0,0]=4 1232 B14R1.148 CC(=O)CCSCc1cccc(c1)Br 62a_100000053229_100000211773 [0,1,0,0,0,0|2,0,0]=3 1233 B14R1.148 CC(=O)CCSCc1cccc(c1)Br 62a_100000211773_100000053229 [0,1,0,0,0,0|2,0,0]=3 1234 B14R1.148 CC(=O)CCSCc1cccc(c1)C 62a_100000053229_100000211840 [0,1,0,0,0,0|2,0,0]=3 1235 B14R1.148 CC(=O)CCSCc1cccc(c1)C 62a_100000211840_100000053229 [0,1,0,0,0,0|2,0,0]=3 1236 B14R1.148 CC(=O)CCSCc1cccc(c1)Cl 62a_100000053229_100000187163 [0,1,0,0,0,0|2,0,0]=3 1237 B14R1.148 CC(=O)CCSCc1cccc(c1)Cl 62a_100000187163_100000053229 [0,1,0,0,0,0|2,0,0]=3 1238 B14R1.148 CC(=O)CCSCc1cccc(c1)F 62a_100000053229_100000230114 [0,1,0,0,0,0|2,0,0]=3 1239 B14R1.148 CC(=O)CCSCc1cccc(c1)F 62a_100000230114_100000053229 [0,1,0,0,0,0|2,0,0]=3 1240 B14R1.148 CC(=O)CCSCc1cccc(c1)I 62a_100000053229_100011218688 [0,1,0,0,0,0|2,0,0]=3 1241 B14R1.148 CC(=O)CCSCc1cccc(c1)I 62a_100011218688_100000053229 [0,1,0,0,0,0|2,0,0]=3 1242 B14R1.148 CC(=O)CCSCc1cccc(c1)O 62a_100000053229_100011660834 [0,1,0,0,0,0|2,0,0]=3 1243 B14R1.148 CC(=O)CCSCc1cccc(c1)O 62a_100011660834_100000053229 [0,1,0,0,0,0|2,0,0]=3 1244 B14R1.148 CC(=O)CCSCc1cccc(n1)Br 62a_100000053229_100009889011 [0,1,0,0,0,0|3,0,0]=4 1245 B14R1.148 CC(=O)CCSCc1cccc(n1)Br 62a_100009889011_100000053229 [0,1,0,0,0,0|3,0,0]=4 1246 B14R1.148 CC(=O)CCSCc1cccc(n1)C 62a_100000053229_100000757606 [0,1,0,0,0,0|3,0,0]=4 1247 B14R1.148 CC(=O)CCSCc1cccc(n1)C 62a_100000757606_100000053229 [0,1,0,0,0,0|3,0,0]=4 1248 B14R1.148 CC(=O)CCSCc1cccc(n1)Cl 62a_100000053229_100000086093 [0,1,0,0,0,0|3,0,0]=4 1249 B14R1.148 CC(=O)CCSCc1cccc(n1)Cl 62a_100000086093_100000053229 [0,1,0,0,0,0|3,0,0]=4 1250 B14R1.148 CC(=O)CCSCc1cccc(n1)F 62a_100000053229_100009819644 [0,1,0,0,0,0|3,0,0]=4 1251 B14R1.148 CC(=O)CCSCc1cccc(n1)F 62a_100009819644_100000053229 [0,1,0,0,0,0|3,0,0]=4 1252 B14R1.148 CC(=O)CCSCc1ccnc(c1)Br 62a_100000053229_100010243470 [0,1,0,0,0,0|3,0,0]=4 1253 B14R1.148 CC(=O)CCSCc1ccnc(c1)Br 62a_100010254460_100000053229 [0,1,0,0,0,0|3,0,0]=4 1254 B14R1.148 CC(=O)CCSCc1ccnc(c1)C 62a_100000053229_200020672517 [0,1,0,0,0,0|3,0,0]=4 1255 B14R1.148 CC(=O)CCSCc1ccnc(c1)C 62a_200020672517_100000053229 [0,1,0,0,0,0|3,0,0]=4 1256 B14R1.148 CC(=O)CCSCc1ccnc(c1)Cl 62a_100000053229_100000764220 [0,1,0,0,0,0|3,0,0]=4 1257 B14R1.148 CC(=O)CCSCc1ccnc(c1)Cl 62a_100000764220_100000053229 [0,1,0,0,0,0|3,0,0]=4 1258 B14R1.148 CC(=O)CCSCc1cncc(c1)Br 62a_100000053229_100000738771 [0,1,0,0,0,0|3,0,0]=4 1259 B14R1.148 CC(=O)CCSCc1cncc(c1)Br 62a_100000738771_100000053229 [0,1,0,0,0,0|3,0,0]=4 1260 B14R1.148 CC(=O)CCSCc1cncc(c1)C 62a_100000053229_100000716715 [0,1,0,0,0,0|3,0,0]=4 1261 B14R1.148 CC(=O)CCSCc1cncc(c1)C 62a_100000716715_100000053229 [0,1,0,0,0,0|3,0,0]=4 1262 B14R1.148 CC(=O)CCSCc1cncc(c1)Cl 62a_100000053229_100016992070 [0,1,0,0,0,0|3,0,0]=4 1263 B14R1.148 CC(=O)CCSCc1cncc(c1)Cl 62a_100016992070_100000053229 [0,1,0,0,0,0|3,0,0]=4 1264 B14R1.148 CC(=O)CCSCc1cncc(c1)F 62a_100000053229_100000725299 [0,1,0,0,0,0|3,0,0]=4 1265 B14R1.148 CC(=O)CCSCc1cncc(c1)F 62a_100000725299_100000053229 [0,1,0,0,0,0|3,0,0]=4 1266 B14R1.148 CC(=O)COCCc1cccc(c1)Br 34a_100000211253_100011740638 [0,1,0,0,0,0|2,0,0]=3 1267 B14R1.148 CC(=O)COCCc1cccc(c1)C 34a_100000211253_100011713685 [0,1,0,0,0,0|2,0,0]=3 1268 B14R1.148 CC(=O)COCCc1cccc(c1)Cl 34a_100000211253_100011713710 [0,1,0,0,0,0|2,0,0]=3 1269 B14R1.148 CC(=O)COCCc1cccc(c1)F 34a_100000211253_100011217235 [0,1,0,0,0,0|2,0,0]=3 1270 B14R1.148 CC(=O)NCCCc1cccc(c1)Br 11a_100000753791_100015343762 [0,1,0,0,0,0|2,0,0]=3 1271 B14R1.148 CC(=O)NCCCc1cccc(c1)Br 1626a_100000753791_100015343762 [0,1,0,0,0,0|2,0,0]=3 1272 B14R1.148 CC(=O)NCCCc1cccc(c1)Br 240690a_100000753791_100015343762 [0,1,0,0,0,0|2,0,0]=3 1273 B14R1.148 CC(=O)NCCCc1cccc(c1)Br 527a_100000753791_100103153847 [0,1,0,0,0,0|2,0,0]=3 1274 B14R1.148 CC(=O)NCCCc1cccc(c1)C 11a_103496528808_100015343762 [0,1,0,0,0,0|2,0,0]=3 1275 B14R1.148 CC(=O)NCCCc1cccc(c1)C 1626a_103496528808_100015343762 [0,1,0,0,0,0|2,0,0]=3 1276 B14R1.148 CC(=O)NCCCc1cccc(c1)C 240690a_103496528808_100015343762 [0,1,0,0,0,0|2,0,0]=3 1277 B14R1.148 CC(=O)NCCCc1cccc(c1)C 527a_103496528808_100103153847 [0,1,0,0,0,0|2,0,0]=3 1278 B14R1.148 CC(=O)NCCCc1cccc(c1)Cl 11a_100000704586_100015343762 [0,1,0,0,0,0|2,0,0]=3 1279 B14R1.148 CC(=O)NCCCc1cccc(c1)Cl 1626a_100000704586_100015343762 [0,1,0,0,0,0|2,0,0]=3 1280 B14R1.148 CC(=O)NCCCc1cccc(c1)Cl 240690a_100000704586_100015343762 [0,1,0,0,0,0|2,0,0]=3 1281 B14R1.148 CC(=O)NCCCc1cccc(c1)Cl 527a_100000704586_100103153847 [0,1,0,0,0,0|2,0,0]=3 1282 B14R1.148 CC(=O)NCCCc1cccc(c1)F 11a_100000754185_100015343762 [0,1,0,0,0,0|2,0,0]=3 1283 B14R1.148 CC(=O)NCCCc1cccc(c1)F 1626a_100000754185_100015343762 [0,1,0,0,0,0|2,0,0]=3 1284 B14R1.148 CC(=O)NCCCc1cccc(c1)F 240690a_100000754185_100015343762 [0,1,0,0,0,0|2,0,0]=3 1285 B14R1.148 CC(=O)NCCCc1cccc(c1)F 527a_100000754185_100103153847 [0,1,0,0,0,0|2,0,0]=3 1286 B14R1.148 CC(=O)NCCNc1cccc(c1)C 2230a_100000188690_100000189650 [0,1,0,0,0,0|3,0,0]=4 1287 B14R1.148 CC(=O)NCCOc1cccc(c1)Br 11a_100000743521_100015343762 [0,1,0,0,0,0|3,0,0]=4 1288 B14R1.148 CC(=O)NCCOc1cccc(c1)Br 1626a_100000743521_100015343762 [0,1,0,0,0,0|3,0,0]=4 1289 B14R1.148 CC(=O)NCCOc1cccc(c1)Br 240690a_100000743521_100015343762 [0,1,0,0,0,0|3,0,0]=4 1290 B14R1.148 CC(=O)NCCOc1cccc(c1)Br 527a_100000743521_100103153847 [0,1,0,0,0,0|3,0,0]=4 1291 B14R1.148 CC(=O)NCCOc1cccc(c1)Br 7a_100000210342_100000189650 [0,1,0,0,0,0|3,0,0]=4 1292 B14R1.148 CC(=O)NCCOc1cccc(c1)C 11a_100015185188_100015343762 [0,1,0,0,0,0|3,0,0]=4 1293 B14R1.148 CC(=O)NCCOc1cccc(c1)C 1626a_100015185188_100015343762 [0,1,0,0,0,0|3,0,0]=4 1294 B14R1.148 CC(=O)NCCOc1cccc(c1)C 240690a_100015185188_100015343762 [0,1,0,0,0,0|3,0,0]=4 1295 B14R1.148 CC(=O)NCCOc1cccc(c1)C 527a_100015185188_100103153847 [0,1,0,0,0,0|3,0,0]=4 1296 B14R1.148 CC(=O)NCCOc1cccc(c1)C 7a_100000210337_100000189650 [0,1,0,0,0,0|3,0,0]=4 1297 B14R1.148 CC(=O)NCCOc1cccc(c1)Cl 11a_100000740232_100015343762 [0,1,0,0,0,0|3,0,0]=4 1298 B14R1.148 CC(=O)NCCOc1cccc(c1)Cl 1626a_100000740232_100015343762 [0,1,0,0,0,0|3,0,0]=4 1299 B14R1.148 CC(=O)NCCOc1cccc(c1)Cl 240690a_100000740232_100015343762 [0,1,0,0,0,0|3,0,0]=4 1300 B14R1.148 CC(=O)NCCOc1cccc(c1)Cl 527a_100000740232_100103153847 [0,1,0,0,0,0|3,0,0]=4 1301 B14R1.148 CC(=O)NCCOc1cccc(c1)Cl 7a_100000210295_100000189650 [0,1,0,0,0,0|3,0,0]=4 1302 B14R1.148 CC(=O)NCCOc1cccc(c1)F 11a_100000738948_100015343762 [0,1,0,0,0,0|3,0,0]=4 1303 B14R1.148 CC(=O)NCCOc1cccc(c1)F 1626a_100000738948_100015343762 [0,1,0,0,0,0|3,0,0]=4 1304 B14R1.148 CC(=O)NCCOc1cccc(c1)F 240690a_100000738948_100015343762 [0,1,0,0,0,0|3,0,0]=4 1305 B14R1.148 CC(=O)NCCOc1cccc(c1)F 527a_100000738948_100103153847 [0,1,0,0,0,0|3,0,0]=4 1306 B14R1.148 CC(=O)NCCOc1cccc(c1)F 7a_100000210426_100000189650 [0,1,0,0,0,0|3,0,0]=4 1307 B14R1.148 CC(=O)NCCOc1cccc(c1)I 7a_100000211634_100000189650 [0,1,0,0,0,0|3,0,0]=4 1308 B14R1.148 CC(=O)NCCSc1cccc(c1)Br 62a_100000189650_100000691529 [0,1,0,0,0,0|3,0,0]=4 1309 B14R1.148 CC(=O)NCCSc1cccc(c1)Br 62a_100000691529_100000189650 [0,1,0,0,0,0|3,0,0]=4 1310 B14R1.148 CC(=O)NCCSc1cccc(c1)C 62a_100000189650_100011215228 [0,1,0,0,0,0|3,0,0]=4 1311 B14R1.148 CC(=O)NCCSc1cccc(c1)C 62a_100011215228_100000189650 [0,1,0,0,0,0|3,0,0]=4 1312 B14R1.148 CC(=O)NCCSc1cccc(c1)Cl 62a_100000189650_100000699651 [0,1,0,0,0,0|3,0,0]=4 1313 B14R1.148 CC(=O)NCCSc1cccc(c1)Cl 62a_100000699651_100000189650 [0,1,0,0,0,0|3,0,0]=4 1314 B14R1.148 CC(=O)NCCSc1cccc(c1)F 62a_100000189650_100000685547 [0,1,0,0,0,0|3,0,0]=4 1315 B14R1.148 CC(=O)NCCSc1cccc(c1)F 62a_100000685547_100000189650 [0,1,0,0,0,0|3,0,0]=4 1316 B14R1.148 CC(=O)NCCSc1cccc(c1)N 62a_100000189650_100000210019 [0,1,0,0,0,0|3,0,0]=4 1317 B14R1.148 CC(=O)NCCSc1cccc(c1)N 62a_100000210019_100000189650 [0,1,0,0,0,0|3,0,0]=4 1318 B14R1.148 CC(=O)NCCSc1cccc(c1)O 62a_100000189650_100000211634 [0,1,0,0,0,0|3,0,0]=4 1319 B14R1.148 CC(=O)NCCSc1cccc(c1)[S] 62a_100000189650_114929384022 [0,1,0,0,0,0|3,0,0]=4 1320 B14R1.148 CC(=O)NCCSc1cccc(c1)[S] 62a_114929384022_100000189650 [0,1,0,0,0,0|3,0,0]=4 1321 B14R1.148 CC(=O)OCCNc1cccc(c1)Br 34a_100000210019_100009814007 [0,1,0,0,0,0|3,0,0]=4 1322 B14R1.148 CC(=O)OCCNc1cccc(c1)C 34a_100000188690_100009814007 [0,1,0,0,0,0|3,0,0]=4 1323 B14R1.148 CC(=O)OCCNc1cccc(c1)Cl 34a_100000185859_100009814007 [0,1,0,0,0,0|3,0,0]=4 1324 B14R1.148 CC(=O)OCCNc1cccc(c1)F 34a_100000210047_100009814007 [0,1,0,0,0,0|3,0,0]=4 1325 B14R1.148 CC(=O)OCCNc1cccc(c1)I 34a_100000211102_100009814007 [0,1,0,0,0,0|3,0,0]=4 1326 B14R1.148 CC(=O)OCCNc1cccc(c1)O 34a_100000210217_100009814007 [0,1,0,0,0,0|3,0,0]=4 1327 B14R1.148 CC(=O)OCCOc1cccc(c1)Br 34a_100000210342_100009814007 [0,1,0,0,0,0|3,0,0]=4 1328 B14R1.148 CC(=O)OCCOc1cccc(c1)Br 7a_100000210342_100009814007 [0,1,0,0,0,0|3,0,0]=4 1329 B14R1.148 CC(=O)OCCOc1cccc(c1)C 34a_100000210337_100009814007 [0,1,0,0,0,0|3,0,0]=4 1330 B14R1.148 CC(=O)OCCOc1cccc(c1)C 7a_100000210337_100009814007 [0,1,0,0,0,0|3,0,0]=4 1331 B14R1.148 CC(=O)OCCOc1cccc(c1)Cl 34a_100000210295_100009814007 [0,1,0,0,0,0|3,0,0]=4 1332 B14R1.148 CC(=O)OCCOc1cccc(c1)Cl 7a_100000210295_100009814007 [0,1,0,0,0,0|3,0,0]=4 1333 B14R1.148 CC(=O)OCCOc1cccc(c1)F 34a_100000210426_100009814007 [0,1,0,0,0,0|3,0,0]=4 1334 B14R1.148 CC(=O)OCCOc1cccc(c1)F 7a_100000210426_100009814007 [0,1,0,0,0,0|3,0,0]=4 1335 B14R1.148 CC(=O)OCCOc1cccc(c1)I 34a_100000211634_100009814007 [0,1,0,0,0,0|3,0,0]=4 1336 B14R1.148 CC(=O)OCCOc1cccc(c1)I 7a_100000211634_100009814007 [0,1,0,0,0,0|3,0,0]=4 1337 B14R1.148 CC(=O)OCCOc1cccc(c1)N 34a_100000210217_100009814007 [0,1,0,0,0,0|3,0,0]=4 1338 B14R1.148 CC(=O)OCCSc1cccc(c1)Br 62a_100000691529_100009814007 [0,1,0,0,0,0|3,0,0]=4 1339 B14R1.148 CC(=O)OCCSc1cccc(c1)Br 62a_100009814007_100000691529 [0,1,0,0,0,0|3,0,0]=4 1340 B14R1.148 CC(=O)OCCSc1cccc(c1)C 62a_100009814007_100011215228 [0,1,0,0,0,0|3,0,0]=4 1341 B14R1.148 CC(=O)OCCSc1cccc(c1)C 62a_100011215228_100009814007 [0,1,0,0,0,0|3,0,0]=4 1342 B14R1.148 CC(=O)OCCSc1cccc(c1)Cl 62a_100000699651_100009814007 [0,1,0,0,0,0|3,0,0]=4 1343 B14R1.148 CC(=O)OCCSc1cccc(c1)Cl 62a_100009814007_100000699651 [0,1,0,0,0,0|3,0,0]=4 1344 B14R1.148 CC(=O)OCCSc1cccc(c1)F 62a_100000685547_100009814007 [0,1,0,0,0,0|3,0,0]=4 1345 B14R1.148 CC(=O)OCCSc1cccc(c1)F 62a_100009814007_100000685547 [0,1,0,0,0,0|3,0,0]=4 1346 B14R1.148 CC(=O)OCCSc1cccc(c1)N 62a_100000210019_100009814007 [0,1,0,0,0,0|3,0,0]=4 1347 B14R1.148 CC(=O)OCCSc1cccc(c1)N 62a_100009814007_100000210019 [0,1,0,0,0,0|3,0,0]=4 1348 B14R1.148 CC(=O)OCCSc1cccc(c1)O 62a_100009814007_100000211634 [0,1,0,0,0,0|3,0,0]=4 1349 B14R1.148 CC(=O)OCCSc1cccc(c1)[S] 62a_100009814007_114929384022 [0,1,0,0,0,0|3,0,0]=4 1350 B14R1.148 CC(=O)OCCSc1cccc(c1)[S] 62a_114929384022_100009814007 [0,1,0,0,0,0|3,0,0]=4 1351 B14R1.148 CC(=O)OCNCc1cccc(c1)Br 34a_100000174977_100009813279 [0,1,0,0,0,0|3,0,0]=4 1352 B14R1.148 CC(=O)OCNCc1cccc(c1)C 34a_100000185548_100009813279 [0,1,0,0,0,0|3,0,0]=4 1353 B14R1.148 CC(=O)OCNCc1cccc(c1)Cl 34a_100000174878_100009813279 [0,1,0,0,0,0|3,0,0]=4 1354 B14R1.148 CC(=O)OCNCc1cccc(c1)F 34a_100000174948_100009813279 [0,1,0,0,0,0|3,0,0]=4 1355 B14R1.148 CC(=O)OCNCc1cccc(c1)I 34a_100000106179_100009813279 [0,1,0,0,0,0|3,0,0]=4 1356 B14R1.148 CC(=O)OCNCc1cccc(c1)O 34a_100000743036_100009813279 [0,1,0,0,0,0|3,0,0]=4 1357 B14R1.148 CC(=O)OCOCc1cccc(c1)Br 34a_100000687537_100009813279 [0,1,0,0,0,0|3,0,0]=4 1358 B14R1.148 CC(=O)OCOCc1cccc(c1)C 34a_100011217746_100009813279 [0,1,0,0,0,0|3,0,0]=4 1359 B14R1.148 CC(=O)OCOCc1cccc(c1)Cl 34a_100000241301_100009813279 [0,1,0,0,0,0|3,0,0]=4 1360 B14R1.148 CC(=O)OCOCc1cccc(c1)F 34a_100000210976_100009813279 [0,1,0,0,0,0|3,0,0]=4 1361 B14R1.148 CC(=O)OCOCc1cccc(c1)I 34a_100011215336_100009813279 [0,1,0,0,0,0|3,0,0]=4 1362 B14R1.148 CC(=O)OCOCc1cccc(c1)N 34a_100000211919_100009813279 [0,1,0,0,0,0|3,0,0]=4 1363 B14R1.148 CC(=O)OCSCc1cccc(c1)Br 62a_100000076356_100000211773 [0,1,0,0,0,0|3,0,0]=4 1364 B14R1.148 CC(=O)OCSCc1cccc(c1)Br 62a_100000211773_100000076356 [0,1,0,0,0,0|3,0,0]=4 1365 B14R1.148 CC(=O)OCSCc1cccc(c1)C 62a_100000076356_100000211840 [0,1,0,0,0,0|3,0,0]=4 1366 B14R1.148 CC(=O)OCSCc1cccc(c1)C 62a_100000211840_100000076356 [0,1,0,0,0,0|3,0,0]=4 1367 B14R1.148 CC(=O)OCSCc1cccc(c1)Cl 62a_100000076356_100000187163 [0,1,0,0,0,0|3,0,0]=4 1368 B14R1.148 CC(=O)OCSCc1cccc(c1)Cl 62a_100000187163_100000076356 [0,1,0,0,0,0|3,0,0]=4 1369 B14R1.148 CC(=O)OCSCc1cccc(c1)F 62a_100000076356_100000230114 [0,1,0,0,0,0|3,0,0]=4 1370 B14R1.148 CC(=O)OCSCc1cccc(c1)F 62a_100000230114_100000076356 [0,1,0,0,0,0|3,0,0]=4 1371 B14R1.148 CC(=O)OCSCc1cccc(c1)I 62a_100000076356_100011218688 [0,1,0,0,0,0|3,0,0]=4 1372 B14R1.148 CC(=O)OCSCc1cccc(c1)I 62a_100011218688_100000076356 [0,1,0,0,0,0|3,0,0]=4 1373 B14R1.148 CC(=O)OCSCc1cccc(c1)O 62a_100000076356_100011660834 [0,1,0,0,0,0|3,0,0]=4 1374 B14R1.148 CC(=O)OCSCc1cccc(c1)O 62a_100011660834_100000076356 [0,1,0,0,0,0|3,0,0]=4 1375 B14R1.148 CC(O)CCCNc1cccc(c1)Br 34a_100000210019_200000718107 [0,1,0,0,0,0|2,0,1]=4 1376 B14R1.148 CC(O)CCCNc1cccc(c1)Cl 34a_100000185859_200000718107 [0,1,0,0,0,0|2,0,1]=4 1377 B14R1.148 CC(O)CCCNc1cccc(c1)F 34a_100000210047_200000718107 [0,1,0,0,0,0|2,0,1]=4 1378 B14R1.148 CC(O)CCCNc1cccc(c1)I 34a_100000211102_200000718107 [0,1,0,0,0,0|2,0,1]=4 1379 B14R1.148 CC(O)CCCNc1cccc(c1)O 34a_100000210217_200000718107 [0,1,0,0,0,0|2,0,1]=4 1380 B14R1.148 CC(O)CCCOc1cccc(c1)Br 34a_100000210342_200000718107 [0,1,0,0,0,0|2,0,1]=4 1381 B14R1.148 CC(O)CCCOc1cccc(c1)Br 7a_100000210342_200000718107 [0,1,0,0,0,0|2,0,1]=4 1382 B14R1.148 CC(O)CCCOc1cccc(c1)Cl 34a_100000210295_200000718107 [0,1,0,0,0,0|2,0,1]=4 1383 B14R1.148 CC(O)CCCOc1cccc(c1)Cl 7a_100000210295_200000718107 [0,1,0,0,0,0|2,0,1]=4 1384 B14R1.148 CC(O)CCCOc1cccc(c1)F 34a_100000210426_200000718107 [0,1,0,0,0,0|2,0,1]=4 1385 B14R1.148 CC(O)CCCOc1cccc(c1)F 7a_100000210426_200000718107 [0,1,0,0,0,0|2,0,1]=4 1386 B14R1.148 CC(O)CCCOc1cccc(c1)I 34a_100000211634_200000718107 [0,1,0,0,0,0|2,0,1]=4 1387 B14R1.148 CC(O)CCCOc1cccc(c1)I 7a_100000211634_200000718107 [0,1,0,0,0,0|2,0,1]=4 1388 B14R1.148 CC(O)CCCOc1cccc(c1)N 34a_100000210217_200000718107 [0,1,0,0,0,0|2,0,1]=4 1389 B14R1.148 CC(O)CCCSc1cccc(c1)Br 62a_100000691529_200000718107 [0,1,0,0,0,0|2,0,1]=4 1390 B14R1.148 CC(O)CCCSc1cccc(c1)Br 62a_200000718107_100000691529 [0,1,0,0,0,0|2,0,1]=4 1391 B14R1.148 CC(O)CCCSc1cccc(c1)Cl 62a_100000699651_200000718107 [0,1,0,0,0,0|2,0,1]=4 1392 B14R1.148 CC(O)CCCSc1cccc(c1)Cl 62a_200000718107_100000699651 [0,1,0,0,0,0|2,0,1]=4 1393 B14R1.148 CC(O)CCCSc1cccc(c1)F 62a_100000685547_200000718107 [0,1,0,0,0,0|2,0,1]=4 1394 B14R1.148 CC(O)CCCSc1cccc(c1)F 62a_200000718107_100000685547 [0,1,0,0,0,0|2,0,1]=4 1395 B14R1.148 CC(O)CCCSc1cccc(c1)N 62a_100000210019_200000718107 [0,1,0,0,0,0|2,0,1]=4 1396 B14R1.148 CC(O)CCCSc1cccc(c1)N 62a_200000718107_100000210019 [0,1,0,0,0,0|2,0,1]=4 1397 B14R1.148 CC(O)CCCSc1cccc(c1)O 62a_200000718107_100000211634 [0,1,0,0,0,0|2,0,1]=4 1398 B14R1.148 CC(O)CCCSc1cccc(c1)[S] 62a_114929384022_200000718107 [0,1,0,0,0,0|2,0,1]=4 1399 B14R1.148 CC(O)CCCSc1cccc(c1)[S] 62a_200000718107_114929384022 [0,1,0,0,0,0|2,0,1]=4 1400 B14R1.148 CC(O)CCNCc1cccc(c1)Br 207a_200000755665_100000210085 [0,1,0,0,0,0|2,0,1]=4 1401 B14R1.148 CC(O)CCNCc1cccc(c1)Br 2230a_100000174977_100012276601 [0,1,0,0,0,0|2,0,1]=4 1402 B14R1.148 CC(O)CCNCc1cccc(c1)Br 2230a_200000755665_100000698116 [0,1,0,0,0,0|2,0,1]=4 1403 B14R1.148 CC(O)CCNCc1cccc(c1)Br 270004a_200000755665_100000210085 [0,1,0,0,0,0|2,0,1]=4 1404 B14R1.148 CC(O)CCNCc1cccc(c1)Br 34a_100000174977_100012276601 [0,1,0,0,0,0|2,0,1]=4 1405 B14R1.148 CC(O)CCNCc1cccc(c1)Cl 207a_200000755665_100000210801 [0,1,0,0,0,0|2,0,1]=4 1406 B14R1.148 CC(O)CCNCc1cccc(c1)Cl 2230a_100000174878_100012276601 [0,1,0,0,0,0|2,0,1]=4 1407 B14R1.148 CC(O)CCNCc1cccc(c1)Cl 2230a_200000755665_100000181238 [0,1,0,0,0,0|2,0,1]=4 1408 B14R1.148 CC(O)CCNCc1cccc(c1)Cl 270004a_200000755665_100000210801 [0,1,0,0,0,0|2,0,1]=4 1409 B14R1.148 CC(O)CCNCc1cccc(c1)Cl 34a_100000174878_100012276601 [0,1,0,0,0,0|2,0,1]=4 1410 B14R1.148 CC(O)CCNCc1cccc(c1)F 207a_200000755665_100000210812 [0,1,0,0,0,0|2,0,1]=4 1411 B14R1.148 CC(O)CCNCc1cccc(c1)F 2230a_100000174948_100012276601 [0,1,0,0,0,0|2,0,1]=4 1412 B14R1.148 CC(O)CCNCc1cccc(c1)F 2230a_200000755665_100000230114 [0,1,0,0,0,0|2,0,1]=4 1413 B14R1.148 CC(O)CCNCc1cccc(c1)F 270004a_200000755665_100000210812 [0,1,0,0,0,0|2,0,1]=4 1414 B14R1.148 CC(O)CCNCc1cccc(c1)F 34a_100000174948_100012276601 [0,1,0,0,0,0|2,0,1]=4 1415 B14R1.148 CC(O)CCNCc1cccc(c1)I 207a_200000755665_100000014684 [0,1,0,0,0,0|2,0,1]=4 1416 B14R1.148 CC(O)CCNCc1cccc(c1)I 2230a_100000106179_100012276601 [0,1,0,0,0,0|2,0,1]=4 1417 B14R1.148 CC(O)CCNCc1cccc(c1)I 2230a_200000755665_100011218688 [0,1,0,0,0,0|2,0,1]=4 1418 B14R1.148 CC(O)CCNCc1cccc(c1)I 270004a_200000755665_100000014684 [0,1,0,0,0,0|2,0,1]=4 1419 B14R1.148 CC(O)CCNCc1cccc(c1)I 34a_100000106179_100012276601 [0,1,0,0,0,0|2,0,1]=4 1420 B14R1.148 CC(O)CCNCc1cccc(c1)O 207a_200000755665_100000188321 [0,1,0,0,0,0|2,0,1]=4 1421 B14R1.148 CC(O)CCNCc1cccc(c1)O 2230a_100000743036_100012276601 [0,1,0,0,0,0|2,0,1]=4 1422 B14R1.148 CC(O)CCNCc1cccc(c1)O 2230a_200000755665_100011660834 [0,1,0,0,0,0|2,0,1]=4 1423 B14R1.148 CC(O)CCNCc1cccc(c1)O 270004a_200000755665_100000188321 [0,1,0,0,0,0|2,0,1]=4 1424 B14R1.148 CC(O)CCNCc1cccc(c1)O 34a_100000743036_100012276601 [0,1,0,0,0,0|2,0,1]=4 1425 B14R1.148 CC(O)CCOCc1cccc(c1)Br 34a_100000687537_100012276601 [0,1,0,0,0,0|2,0,1]=4 1426 B14R1.148 CC(O)CCOCc1cccc(c1)Br 7a_100000687537_100012276601 [0,1,0,0,0,0|2,0,1]=4 1427 B14R1.148 CC(O)CCOCc1cccc(c1)Cl 34a_100000241301_100012276601 [0,1,0,0,0,0|2,0,1]=4 1428 B14R1.148 CC(O)CCOCc1cccc(c1)Cl 7a_100000241301_100012276601 [0,1,0,0,0,0|2,0,1]=4 1429 B14R1.148 CC(O)CCOCc1cccc(c1)F 34a_100000210976_100012276601 [0,1,0,0,0,0|2,0,1]=4 1430 B14R1.148 CC(O)CCOCc1cccc(c1)F 7a_100000210976_100012276601 [0,1,0,0,0,0|2,0,1]=4 1431 B14R1.148 CC(O)CCOCc1cccc(c1)I 34a_100011215336_100012276601 [0,1,0,0,0,0|2,0,1]=4 1432 B14R1.148 CC(O)CCOCc1cccc(c1)I 7a_100011215336_100012276601 [0,1,0,0,0,0|2,0,1]=4 1433 B14R1.148 CC(O)CCOCc1cccc(c1)N 34a_100000211919_100012276601 [0,1,0,0,0,0|2,0,1]=4 1434 B14R1.148 CC(O)CCSCc1cccc(c1)Br 62a_100000211773_100012276601 [0,1,0,0,0,0|2,0,1]=4 1435 B14R1.148 CC(O)CCSCc1cccc(c1)Br 62a_100012276601_100000211773 [0,1,0,0,0,0|2,0,1]=4 1436 B14R1.148 CC(O)CCSCc1cccc(c1)Cl 62a_100000187163_100012276601 [0,1,0,0,0,0|2,0,1]=4 1437 B14R1.148 CC(O)CCSCc1cccc(c1)Cl 62a_100012276601_100000187163 [0,1,0,0,0,0|2,0,1]=4 1438 B14R1.148 CC(O)CCSCc1cccc(c1)F 62a_100000230114_100012276601 [0,1,0,0,0,0|2,0,1]=4 1439 B14R1.148 CC(O)CCSCc1cccc(c1)F 62a_100012276601_100000230114 [0,1,0,0,0,0|2,0,1]=4 1440 B14R1.148 CC(O)CCSCc1cccc(c1)I 62a_100011218688_100012276601 [0,1,0,0,0,0|2,0,1]=4 1441 B14R1.148 CC(O)CCSCc1cccc(c1)I 62a_100012276601_100011218688 [0,1,0,0,0,0|2,0,1]=4 1442 B14R1.148 CC(O)CCSCc1cccc(c1)O 62a_100011660834_100012276601 [0,1,0,0,0,0|2,0,1]=4 1443 B14R1.148 CC(O)CCSCc1cccc(c1)O 62a_100012276601_100011660834 [0,1,0,0,0,0|2,0,1]=4 1444 B14R1.148 CC(O)CNCCc1cccc(c1)Br 2230a_100000210904_100011740638 [0,1,0,0,0,0|2,0,1]=4 1445 B14R1.148 CC(O)CNCCc1cccc(c1)Br 2230a_100011207229_100011218427 [0,1,0,0,0,0|2,0,1]=4 1446 B14R1.148 CC(O)CNCCc1cccc(c1)Br 34a_100000210904_100011740638 [0,1,0,0,0,0|2,0,1]=4 1447 B14R1.148 CC(O)CNCCc1cccc(c1)Br 34a_100011207229_100011218427 [0,1,0,0,0,0|2,0,1]=4 1448 B14R1.148 CC(O)CNCCc1cccc(c1)Cl 2230a_100000185263_100011218427 [0,1,0,0,0,0|2,0,1]=4 1449 B14R1.148 CC(O)CNCCc1cccc(c1)Cl 2230a_100000210904_100011713710 [0,1,0,0,0,0|2,0,1]=4 1450 B14R1.148 CC(O)CNCCc1cccc(c1)Cl 34a_100000185263_100011218427 [0,1,0,0,0,0|2,0,1]=4 1451 B14R1.148 CC(O)CNCCc1cccc(c1)Cl 34a_100000210904_100011713710 [0,1,0,0,0,0|2,0,1]=4 1452 B14R1.148 CC(O)CNCCc1cccc(c1)F 2230a_100000205154_100011218427 [0,1,0,0,0,0|2,0,1]=4 1453 B14R1.148 CC(O)CNCCc1cccc(c1)F 2230a_100000210904_100011217235 [0,1,0,0,0,0|2,0,1]=4 1454 B14R1.148 CC(O)CNCCc1cccc(c1)F 34a_100000205154_100011218427 [0,1,0,0,0,0|2,0,1]=4 1455 B14R1.148 CC(O)CNCCc1cccc(c1)F 34a_100000210904_100011217235 [0,1,0,0,0,0|2,0,1]=4 1456 B14R1.148 CC(O)CNCCc1cccc(c1)O 2230a_100000747277_100011218427 [0,1,0,0,0,0|2,0,1]=4 1457 B14R1.148 CC(O)CNCCc1cccc(c1)O 34a_100000747277_100011218427 [0,1,0,0,0,0|2,0,1]=4 1458 B14R1.148 CC(O)COCCc1cccc(c1)Br 34a_100011217444_100011218427 [0,1,0,0,0,0|2,0,1]=4 1459 B14R1.148 CC(O)COCCc1cccc(c1)Br 7a_100011217444_100011218427 [0,1,0,0,0,0|2,0,1]=4 1460 B14R1.148 CC(O)COCCc1cccc(c1)Cl 34a_100000754733_100011218427 [0,1,0,0,0,0|2,0,1]=4 1461 B14R1.148 CC(O)COCCc1cccc(c1)Cl 7a_100000754733_100011218427 [0,1,0,0,0,0|2,0,1]=4 1462 B14R1.148 CC(O)COCCc1cccc(c1)F 34a_100000763591_100011218427 [0,1,0,0,0,0|2,0,1]=4 1463 B14R1.148 CC(O)COCCc1cccc(c1)F 7a_100000763591_100011218427 [0,1,0,0,0,0|2,0,1]=4 1464 B14R1.148 CC(O)COCCc1cccc(c1)N 34a_100011996697_100011218427 [0,1,0,0,0,0|2,0,1]=4 1465 B14R1.148 CC(O)CSCCc1cccc(c1)Br 62a_100011218427_100011740638 [0,1,0,0,0,0|2,0,1]=4 1466 B14R1.148 CC(O)CSCCc1cccc(c1)Br 62a_100011740638_100011218427 [0,1,0,0,0,0|2,0,1]=4 1467 B14R1.148 CC(O)CSCCc1cccc(c1)Cl 62a_100011218427_100011713710 [0,1,0,0,0,0|2,0,1]=4 1468 B14R1.148 CC(O)CSCCc1cccc(c1)Cl 62a_100011713710_100011218427 [0,1,0,0,0,0|2,0,1]=4 1469 B14R1.148 CC(O)CSCCc1cccc(c1)F 62a_100011217235_100011218427 [0,1,0,0,0,0|2,0,1]=4 1470 B14R1.148 CC(O)CSCCc1cccc(c1)F 62a_100011218427_100011217235 [0,1,0,0,0,0|2,0,1]=4 1471 B14R1.148 C[C@@H](O)CNCCc1cccc(c1)Br 2230a_100011207229_100009817552 [0,1,0,0,0,0|2,0,1]=4 1472 B14R1.148 C[C@@H](O)CNCCc1cccc(c1)Br 34a_100011207229_100009817552 [0,1,0,0,0,0|2,0,1]=4 1473 B14R1.148 C[C@@H](O)CNCCc1cccc(c1)Cl 2230a_100000185263_100009817552 [0,1,0,0,0,0|2,0,1]=4 1474 B14R1.148 C[C@@H](O)CNCCc1cccc(c1)Cl 34a_100000185263_100009817552 [0,1,0,0,0,0|2,0,1]=4 1475 B14R1.148 C[C@@H](O)CNCCc1cccc(c1)F 2230a_100000205154_100009817552 [0,1,0,0,0,0|2,0,1]=4 1476 B14R1.148 C[C@@H](O)CNCCc1cccc(c1)F 34a_100000205154_100009817552 [0,1,0,0,0,0|2,0,1]=4 1477 B14R1.148 C[C@@H](O)CNCCc1cccc(c1)O 2230a_100000747277_100009817552 [0,1,0,0,0,0|2,0,1]=4 1478 B14R1.148 C[C@@H](O)CNCCc1cccc(c1)O 34a_100000747277_100009817552 [0,1,0,0,0,0|2,0,1]=4 1479 B14R1.148 C[C@@H](O)COCCc1cccc(c1)Br 34a_100011217444_100009817552 [0,1,0,0,0,0|2,0,1]=4 1480 B14R1.148 C[C@@H](O)COCCc1cccc(c1)Br 7a_100011217444_100009817552 [0,1,0,0,0,0|2,0,1]=4 1481 B14R1.148 C[C@@H](O)COCCc1cccc(c1)Cl 34a_100000754733_100009817552 [0,1,0,0,0,0|2,0,1]=4 1482 B14R1.148 C[C@@H](O)COCCc1cccc(c1)Cl 7a_100000754733_100009817552 [0,1,0,0,0,0|2,0,1]=4 1483 B14R1.148 C[C@@H](O)COCCc1cccc(c1)F 34a_100000763591_100009817552 [0,1,0,0,0,0|2,0,1]=4 1484 B14R1.148 C[C@@H](O)COCCc1cccc(c1)F 7a_100000763591_100009817552 [0,1,0,0,0,0|2,0,1]=4 1485 B14R1.148 C[C@@H](O)COCCc1cccc(c1)N 34a_100011996697_100009817552 [0,1,0,0,0,0|2,0,1]=4 1486 B14R1.148 C[C@@H](O)CSCCc1cccc(c1)Br 62a_100009817552_100011740638 [0,1,0,0,0,0|2,0,1]=4 1487 B14R1.148 C[C@@H](O)CSCCc1cccc(c1)Br 62a_100011740638_100009817552 [0,1,0,0,0,0|2,0,1]=4 1488 B14R1.148 C[C@@H](O)CSCCc1cccc(c1)Cl 62a_100009817552_100011713710 [0,1,0,0,0,0|2,0,1]=4 1489 B14R1.148 C[C@@H](O)CSCCc1cccc(c1)Cl 62a_100011713710_100009817552 [0,1,0,0,0,0|2,0,1]=4 1490 B14R1.148 C[C@@H](O)CSCCc1cccc(c1)F 62a_100009817552_100011217235 [0,1,0,0,0,0|2,0,1]=4 1491 B14R1.148 C[C@@H](O)CSCCc1cccc(c1)F 62a_100011217235_100009817552 [0,1,0,0,0,0|2,0,1]=4 1492 B14R1.148 C[n+]1cccc(c1)SCCCC(=O)N 62a_100009996589_100102525003 [0,1,0,0,0,0|3,0,0]=4 1493 B14R1.148 C[n+]1cccc(c1)SCCCC(=O)N 62a_100102525003_100009996589 [0,1,0,0,0,0|3,0,0]=4 1494 B14R1.148 Cc1cc(ccn1)CNCCC(=O)N 207a_100000740010_100011361630 [0,1,0,0,0,0|3,0,0]=4 1495 B14R1.148 Cc1cc(ccn1)CNCCC(=O)N 34a_100011934566_100000731001 [0,1,0,0,0,0|3,0,0]=4 1496 B14R1.148 Cc1cc(ccn1)CNOCC(=O)O 269956a_100000106656_200020672517 [0,1,0,0,0,0|3,0,0]=4 1497 B14R1.148 Cc1cc(ccn1)COCCC(=O)N 34a_100000757172_200020672517 [0,1,0,0,0,0|3,0,0]=4 1498 B14R1.148 Cc1cc(ccn1)COCCC(=O)N 34a_100011998630_100000731001 [0,1,0,0,0,0|3,0,0]=4 1499 B14R1.148 Cc1cc(ccn1)COCCC(=O)N 7a_100000757172_200020672517 [0,1,0,0,0,0|3,0,0]=4 1500 B14R1.148 Cc1cc(ccn1)CSCCC(=O)N 62a_100000744528_200020672517 [0,1,0,0,0,0|3,0,0]=4 1501 B14R1.148 Cc1cc(ccn1)CSCCC(=O)N 62a_200020672517_100000744528 [0,1,0,0,0,0|3,0,0]=4 1502 B14R1.148 Cc1cc(ccn1)NCCCC(=O)N 27a_100000739312_100000758586 [0,1,0,0,0,0|3,0,0]=4 1503 B14R1.148 Cc1cc(ccn1)OCCCC(=O)N 34a_100000688365_100102525003 [0,1,0,0,0,0|3,0,0]=4 1504 B14R1.148 Cc1cc(ccn1)SCCCC(=O)N 62a_100000758586_100102525003 [0,1,0,0,0,0|3,0,0]=4 1505 B14R1.148 Cc1cc(ccn1)SCCCC(=O)N 62a_100102525003_100000758586 [0,1,0,0,0,0|3,0,0]=4 1506 B14R1.148 Cc1cccc(c1)CCNCC(=O)N 2230a_100000711301_100011713685 [0,1,0,0,0,0|2,0,0]=3 1507 B14R1.148 Cc1cccc(c1)CCNCC(=O)N 2230a_100000749837_100000747473 [0,1,0,0,0,0|2,0,0]=3 1508 B14R1.148 Cc1cccc(c1)CCNCC(=O)N 34a_100000749837_100000187820 [0,1,0,0,0,0|2,0,0]=3 1509 B14R1.148 Cc1cccc(c1)CCNCC(=O)O 269956a_100016091260_100011713685 [0,1,0,0,0,0|1,0,0]=2 1510 B14R1.148 Cc1cccc(c1)CCNCC(=O)[O-] 34a_100000749837_100020667443 [0,1,0,0,0,0|1,0,1]=3 1511 B14R1.148 Cc1cccc(c1)CCNCC(C)O 2230a_100000210904_100011713685 [0,1,0,0,0,0|2,0,1]=4 1512 B14R1.148 Cc1cccc(c1)CCNCC(C)O 2230a_100000749837_100011218427 [0,1,0,0,0,0|2,0,1]=4 1513 B14R1.148 Cc1cccc(c1)CCNCC(C)O 34a_100000210904_100011713685 [0,1,0,0,0,0|2,0,1]=4 1514 B14R1.148 Cc1cccc(c1)CCNCC(C)O 34a_100000749837_100011218427 [0,1,0,0,0,0|2,0,1]=4 1515 B14R1.148 Cc1cccc(c1)CCNC[C@@H](C)O 2230a_100000749837_100009817552 [0,1,0,0,0,0|2,0,1]=4 1516 B14R1.148 Cc1cccc(c1)CCNC[C@@H](C)O 34a_100000749837_100009817552 [0,1,0,0,0,0|2,0,1]=4 1517 B14R1.148 Cc1cccc(c1)CCNC[N+](=O)[O-] 34a_100000749837_100000761209 [0,1,0,0,0,0|2,0,1]=4 1518 B14R1.148 Cc1cccc(c1)CCOCC(=O)N 34a_100011217157_100000187820 [0,1,0,0,0,0|2,0,0]=3 1519 B14R1.148 Cc1cccc(c1)CCOCC(=O)N 7a_100011217157_100000187820 [0,1,0,0,0,0|2,0,0]=3 1520 B14R1.148 Cc1cccc(c1)CCOCC(=O)[O-] 34a_100011217157_100020667443 [0,1,0,0,0,0|1,0,1]=3 1521 B14R1.148 Cc1cccc(c1)CCOCC(C)O 34a_100011217157_100011218427 [0,1,0,0,0,0|2,0,1]=4 1522 B14R1.148 Cc1cccc(c1)CCOCC(C)O 7a_100011217157_100011218427 [0,1,0,0,0,0|2,0,1]=4 1523 B14R1.148 Cc1cccc(c1)CCOC[C@@H](C)O 34a_100011217157_100009817552 [0,1,0,0,0,0|2,0,1]=4 1524 B14R1.148 Cc1cccc(c1)CCOC[C@@H](C)O 7a_100011217157_100009817552 [0,1,0,0,0,0|2,0,1]=4 1525 B14R1.148 Cc1cccc(c1)CCOC[N+](=O)[O-] 34a_100011217157_100000761209 [0,1,0,0,0,0|2,0,1]=4 1526 B14R1.148 Cc1cccc(c1)CCSCC(=O)N 62a_100000747473_100011713685 [0,1,0,0,0,0|2,0,0]=3 1527 B14R1.148 Cc1cccc(c1)CCSCC(=O)N 62a_100011713685_100000747473 [0,1,0,0,0,0|2,0,0]=3 1528 B14R1.148 Cc1cccc(c1)CCSCC(=O)[O-] 62a_100011713685_100020667443 [0,1,0,0,0,0|1,0,1]=3 1529 B14R1.148 Cc1cccc(c1)CCSCC(=O)[O-] 62a_100020667443_100011713685 [0,1,0,0,0,0|1,0,1]=3 1530 B14R1.148 Cc1cccc(c1)CCSCC(C)O 62a_100011218427_100011713685 [0,1,0,0,0,0|2,0,1]=4 1531 B14R1.148 Cc1cccc(c1)CCSCC(C)O 62a_100011713685_100011218427 [0,1,0,0,0,0|2,0,1]=4 1532 B14R1.148 Cc1cccc(c1)CCSC[C@@H](C)O 62a_100009817552_100011713685 [0,1,0,0,0,0|2,0,1]=4 1533 B14R1.148 Cc1cccc(c1)CCSC[C@@H](C)O 62a_100011713685_100009817552 [0,1,0,0,0,0|2,0,1]=4 1534 B14R1.148 Cc1cccc(c1)CCSC[N+](=O)[O-] 62a_100011713685_100000761209 [0,1,0,0,0,0|2,0,1]=4 1535 B14R1.148 Cc1cccc(c1)CNCCC(=O)N 207a_100000740010_100000211157 [0,1,0,0,0,0|2,0,0]=3 1536 B14R1.148 Cc1cccc(c1)CNCCC(=O)N 2230a_100000185548_100000744528 [0,1,0,0,0,0|2,0,0]=3 1537 B14R1.148 Cc1cccc(c1)CNCCC(=O)N 34a_100000185548_100000731001 [0,1,0,0,0,0|2,0,0]=3 1538 B14R1.148 Cc1cccc(c1)CNCCC(C)O 207a_200000755665_100000211157 [0,1,0,0,0,0|2,0,1]=4 1539 B14R1.148 Cc1cccc(c1)CNCCC(C)O 2230a_100000185548_100012276601 [0,1,0,0,0,0|2,0,1]=4 1540 B14R1.148 Cc1cccc(c1)CNCCC(C)O 2230a_200000755665_100000211840 [0,1,0,0,0,0|2,0,1]=4 1541 B14R1.148 Cc1cccc(c1)CNCCC(C)O 270004a_200000755665_100000211157 [0,1,0,0,0,0|2,0,1]=4 1542 B14R1.148 Cc1cccc(c1)CNCCC(C)O 34a_100000185548_100012276601 [0,1,0,0,0,0|2,0,1]=4 1543 B14R1.148 Cc1cccc(c1)CNOCC(=O)O 269956a_100000106656_100000005736 [0,1,0,0,0,0|2,0,0]=3 1544 B14R1.148 Cc1cccc(c1)COCCC(=O)N 34a_100000757172_100000211840 [0,1,0,0,0,0|2,0,0]=3 1545 B14R1.148 Cc1cccc(c1)COCCC(=O)N 34a_100011217746_100000731001 [0,1,0,0,0,0|2,0,0]=3 1546 B14R1.148 Cc1cccc(c1)COCCC(=O)N 7a_100000757172_100000211840 [0,1,0,0,0,0|2,0,0]=3 1547 B14R1.148 Cc1cccc(c1)COCCC(=O)N 7a_100011217746_100000744528 [0,1,0,0,0,0|2,0,0]=3 1548 B14R1.148 Cc1cccc(c1)COCCC(C)O 34a_100011217746_100012276601 [0,1,0,0,0,0|2,0,1]=4 1549 B14R1.148 Cc1cccc(c1)COCCC(C)O 7a_100011217746_100012276601 [0,1,0,0,0,0|2,0,1]=4 1550 B14R1.148 Cc1cccc(c1)CSCCC(=O)N 62a_100000211840_100000744528 [0,1,0,0,0,0|2,0,0]=3 1551 B14R1.148 Cc1cccc(c1)CSCCC(=O)N 62a_100000744528_100000211840 [0,1,0,0,0,0|2,0,0]=3 1552 B14R1.148 Cc1cccc(c1)CSCCC(C)O 62a_100000211840_100012276601 [0,1,0,0,0,0|2,0,1]=4 1553 B14R1.148 Cc1cccc(c1)CSCCC(C)O 62a_100012276601_100000211840 [0,1,0,0,0,0|2,0,1]=4 1554 B14R1.148 Cc1cccc(c1)NCCCC(=O)N 34a_100000188690_100102525003 [0,1,0,0,0,0|2,0,0]=3 1555 B14R1.148 Cc1cccc(c1)NCCCC(C)O 2230a_100000188690_200000718107 [0,1,0,0,0,0|2,0,1]=4 1556 B14R1.148 Cc1cccc(c1)NCCCC(C)O 34a_100000188690_200000718107 [0,1,0,0,0,0|2,0,1]=4 1557 B14R1.148 Cc1cccc(c1)NCCNC(=O)N 2230a_100000188690_200000034859 [0,1,0,0,0,0|3,0,0]=4 1558 B14R1.148 Cc1cccc(c1)NCCOC(=O)N 34a_100000188690_200011214921 [0,1,0,0,0,0|3,0,0]=4 1559 B14R1.148 Cc1cccc(c1)OCCCC(=O)N 34a_100000210337_100102525003 [0,1,0,0,0,0|2,0,0]=3 1560 B14R1.148 Cc1cccc(c1)OCCCC(=O)N 7a_100000210337_100102525003 [0,1,0,0,0,0|2,0,0]=3 1561 B14R1.148 Cc1cccc(c1)OCCCC(=O)[13CH3] 1458a_100000183260_200025704644 [0,1,0,0,0,0|2,0,0]=3 1562 B14R1.148 Cc1cccc(c1)OCCCC(C)O 34a_100000210337_200000718107 [0,1,0,0,0,0|2,0,1]=4 1563 B14R1.148 Cc1cccc(c1)OCCCC(C)O 7a_100000210337_200000718107 [0,1,0,0,0,0|2,0,1]=4 1564 B14R1.148 Cc1cccc(c1)OCCNC(=O)N 7a_100000210337_200000034859 [0,1,0,0,0,0|3,0,0]=4 1565 B14R1.148 Cc1cccc(c1)OCCOC(=O)N 34a_100000210337_200011214921 [0,1,0,0,0,0|3,0,0]=4 1566 B14R1.148 Cc1cccc(c1)OCCOC(=O)N 7a_100000210337_200011214921 [0,1,0,0,0,0|3,0,0]=4 1567 B14R1.148 Cc1cccc(c1)SCCCC(=O)N 62a_100011215228_100102525003 [0,1,0,0,0,0|2,0,0]=3 1568 B14R1.148 Cc1cccc(c1)SCCCC(=O)N 62a_100102525003_100011215228 [0,1,0,0,0,0|2,0,0]=3 1569 B14R1.148 Cc1cccc(c1)SCCCC(C)O 62a_100011215228_200000718107 [0,1,0,0,0,0|2,0,1]=4 1570 B14R1.148 Cc1cccc(c1)SCCCC(C)O 62a_200000718107_100011215228 [0,1,0,0,0,0|2,0,1]=4 1571 B14R1.148 Cc1cccc(c1)SCCNC(=O)N 62a_100011215228_200000034859 [0,1,0,0,0,0|3,0,0]=4 1572 B14R1.148 Cc1cccc(c1)SCCNC(=O)N 62a_200000034859_100011215228 [0,1,0,0,0,0|3,0,0]=4 1573 B14R1.148 Cc1cccc(c1)SCCOC(=O)N 62a_100011215228_200011214921 [0,1,0,0,0,0|3,0,0]=4 1574 B14R1.148 Cc1cccc(c1)SCCOC(=O)N 62a_200011214921_100011215228 [0,1,0,0,0,0|3,0,0]=4 1575 B14R1.148 Cc1cccc(n1)CCNCC(=O)N 2230a_100011824523_100000747473 [0,1,0,0,0,0|3,0,0]=4 1576 B14R1.148 Cc1cccc(n1)CCNCC(=O)N 34a_100011824523_100000187820 [0,1,0,0,0,0|3,0,0]=4 1577 B14R1.148 Cc1cccc(n1)CCNCC(=O)[O-] 34a_100011824523_100020667443 [0,1,0,0,0,0|2,0,1]=4 1578 B14R1.148 Cc1cccc(n1)CNCCC(=O)N 207a_100000740010_100011215050 [0,1,0,0,0,0|3,0,0]=4 1579 B14R1.148 Cc1cccc(n1)CNCCC(=O)N 34a_100000701342_100000731001 [0,1,0,0,0,0|3,0,0]=4 1580 B14R1.148 Cc1cccc(n1)CNOCC(=O)O 269956a_100000106656_100000757606 [0,1,0,0,0,0|3,0,0]=4 1581 B14R1.148 Cc1cccc(n1)COCCC(=O)N 34a_100000690600_100000731001 [0,1,0,0,0,0|3,0,0]=4 1582 B14R1.148 Cc1cccc(n1)COCCC(=O)N 34a_100000757172_100000757606 [0,1,0,0,0,0|3,0,0]=4 1583 B14R1.148 Cc1cccc(n1)COCCC(=O)N 7a_100000757172_100000757606 [0,1,0,0,0,0|3,0,0]=4 1584 B14R1.148 Cc1cccc(n1)CSCCC(=O)N 62a_100000744528_100000757606 [0,1,0,0,0,0|3,0,0]=4 1585 B14R1.148 Cc1cccc(n1)CSCCC(=O)N 62a_100000757606_100000744528 [0,1,0,0,0,0|3,0,0]=4 1586 B14R1.148 Cc1cccc(n1)SCCCC(=O)N 62a_100000742759_100102525003 [0,1,0,0,0,0|3,0,0]=4 1587 B14R1.148 Cc1cccc(n1)SCCCC(=O)N 62a_100102525003_100000742759 [0,1,0,0,0,0|3,0,0]=4 1588 B14R1.148 Cc1ccnc(c1)CNCCC(=O)N 207a_100000740010_100011361488 [0,1,0,0,0,0|3,0,0]=4 1589 B14R1.148 Cc1ccnc(c1)CNOCC(=O)O 269956a_100000106656_100000718516 [0,1,0,0,0,0|3,0,0]=4 1590 B14R1.148 Cc1ccnc(c1)COCCC(=O)N 34a_100000757172_100000718516 [0,1,0,0,0,0|3,0,0]=4 1591 B14R1.148 Cc1ccnc(c1)COCCC(=O)N 34a_100011998357_100000731001 [0,1,0,0,0,0|3,0,0]=4 1592 B14R1.148 Cc1ccnc(c1)COCCC(=O)N 7a_100000757172_100000718516 [0,1,0,0,0,0|3,0,0]=4 1593 B14R1.148 Cc1ccnc(c1)CSCCC(=O)N 62a_100000718516_100000744528 [0,1,0,0,0,0|3,0,0]=4 1594 B14R1.148 Cc1ccnc(c1)CSCCC(=O)N 62a_100000744528_100000718516 [0,1,0,0,0,0|3,0,0]=4 1595 B14R1.148 Cc1ccnc(c1)SCCCC(=O)N 62a_100000750283_100102525003 [0,1,0,0,0,0|3,0,0]=4 1596 B14R1.148 Cc1ccnc(c1)SCCCC(=O)N 62a_100102525003_100000750283 [0,1,0,0,0,0|3,0,0]=4 1597 B14R1.148 Cc1cncc(c1)CNCCC(=O)N 207a_100000740010_100011998712 [0,1,0,0,0,0|3,0,0]=4 1598 B14R1.148 Cc1cncc(c1)CNCCC(=O)N 2230a_100000692839_100000744528 [0,1,0,0,0,0|3,0,0]=4 1599 B14R1.148 Cc1cncc(c1)CNCCC(=O)N 34a_100000692839_100000731001 [0,1,0,0,0,0|3,0,0]=4 1600 B14R1.148 Cc1cncc(c1)CNOCC(=O)O 269956a_100000106656_100016988603 [0,1,0,0,0,0|3,0,0]=4 1601 B14R1.148 Cc1cncc(c1)COCCC(=O)N 34a_100000757172_100000716715 [0,1,0,0,0,0|3,0,0]=4 1602 B14R1.148 Cc1cncc(c1)COCCC(=O)N 34a_100011998709_100000731001 [0,1,0,0,0,0|3,0,0]=4 1603 B14R1.148 Cc1cncc(c1)COCCC(=O)N 7a_100000757172_100000716715 [0,1,0,0,0,0|3,0,0]=4 1604 B14R1.148 Cc1cncc(c1)COCCC(=O)N 7a_100011998709_100000744528 [0,1,0,0,0,0|3,0,0]=4 1605 B14R1.148 Cc1cncc(c1)CSCCC(=O)N 62a_100000716715_100000744528 [0,1,0,0,0,0|3,0,0]=4 1606 B14R1.148 Cc1cncc(c1)CSCCC(=O)N 62a_100000744528_100000716715 [0,1,0,0,0,0|3,0,0]=4 1607 B14R1.148 Cc1cncc(c1)OCCCC(=O)N 34a_100011830280_100102525003 [0,1,0,0,0,0|3,0,0]=4 1608 B14R1.148 Cc1cncc(c1)OCCCC(=O)N 7a_100011830280_100102525003 [0,1,0,0,0,0|3,0,0]=4 1609 B14R1.148 Cc1cncc(c1)SCCCC(=O)N 62a_100000760492_100102525003 [0,1,0,0,0,0|3,0,0]=4 1610 B14R1.148 Cc1cncc(c1)SCCCC(=O)N 62a_100102525003_100000760492 [0,1,0,0,0,0|3,0,0]=4 1611 B14R1.148 NC(=O)CCCNc1cc(ccn1)F 27a_100000739312_100000764206 [0,1,0,0,0,0|3,0,0]=4 1612 B14R1.148 NC(=O)CCCNc1cc[nH]c(=O)c1 27a_100000739312_100000061649 [0,1,0,0,0,0|3,0,0]=4 1613 B14R1.148 NC(=O)CCCNc1cccc(c1)Br 34a_100000210019_100102525003 [0,1,0,0,0,0|2,0,0]=3 1614 B14R1.148 NC(=O)CCCNc1cccc(c1)Cl 34a_100000185859_100102525003 [0,1,0,0,0,0|2,0,0]=3 1615 B14R1.148 NC(=O)CCCNc1cccc(c1)F 34a_100000210047_100102525003 [0,1,0,0,0,0|2,0,0]=3 1616 B14R1.148 NC(=O)CCCNc1cccc(c1)I 34a_100000211102_100102525003 [0,1,0,0,0,0|2,0,0]=3 1617 B14R1.148 NC(=O)CCCNc1cccc(c1)O 34a_100000210217_100102525003 [0,1,0,0,0,0|2,0,0]=3 1618 B14R1.148 NC(=O)CCCNc1cccc(n1)F 27a_100000739312_100009815982 [0,1,0,0,0,0|3,0,0]=4 1619 B14R1.148 NC(=O)CCCNc1ccnc(c1)F 27a_100000739312_100009816116 [0,1,0,0,0,0|3,0,0]=4 1620 B14R1.148 NC(=O)CCCOc1cc[nH]c(=O)c1 34a_100000032262_100102525003 [0,1,0,0,0,0|3,0,0]=4 1621 B14R1.148 NC(=O)CCCOc1ccc[n+](c1)[O-] 34a_100000039713_100102525003 [0,1,0,0,0,0|3,0,0]=4 1622 B14R1.148 NC(=O)CCCOc1ccc[n+](c1)[O-] 7a_100000039713_100102525003 [0,1,0,0,0,0|3,0,0]=4 1623 B14R1.148 NC(=O)CCCOc1cccc(=O)[nH]1 34a_100000033347_100102525003 [0,1,0,0,0,0|3,0,0]=4 1624 B14R1.148 NC(=O)CCCOc1cccc(c1)Br 34a_100000210342_100102525003 [0,1,0,0,0,0|2,0,0]=3 1625 B14R1.148 NC(=O)CCCOc1cccc(c1)Br 7a_100000210342_100102525003 [0,1,0,0,0,0|2,0,0]=3 1626 B14R1.148 NC(=O)CCCOc1cccc(c1)Cl 34a_100000210295_100102525003 [0,1,0,0,0,0|2,0,0]=3 1627 B14R1.148 NC(=O)CCCOc1cccc(c1)Cl 7a_100000210295_100102525003 [0,1,0,0,0,0|2,0,0]=3 1628 B14R1.148 NC(=O)CCCOc1cccc(c1)F 34a_100000210426_100102525003 [0,1,0,0,0,0|2,0,0]=3 1629 B14R1.148 NC(=O)CCCOc1cccc(c1)F 7a_100000210426_100102525003 [0,1,0,0,0,0|2,0,0]=3 1630 B14R1.148 NC(=O)CCCOc1cccc(c1)I 34a_100000211634_100102525003 [0,1,0,0,0,0|2,0,0]=3 1631 B14R1.148 NC(=O)CCCOc1cccc(c1)I 7a_100000211634_100102525003 [0,1,0,0,0,0|2,0,0]=3 1632 B14R1.148 NC(=O)CCCOc1cccc(c1)N 34a_100000210217_100102525003 [0,1,0,0,0,0|2,0,0]=3 1633 B14R1.148 NC(=O)CCCOc1cccc(n1)F 34a_100011432558_100102525003 [0,1,0,0,0,0|3,0,0]=4 1634 B14R1.148 NC(=O)CCCOc1ccnc(c1)Cl 34a_100000762945_100102525003 [0,1,0,0,0,0|3,0,0]=4 1635 B14R1.148 NC(=O)CCCOc1ccnc(c1)F 34a_100000732698_100102525003 [0,1,0,0,0,0|3,0,0]=4 1636 B14R1.148 NC(=O)CCCOc1ccnc(c1)N 34a_100011834064_100102525003 [0,1,0,0,0,0|3,0,0]=4 1637 B14R1.148 NC(=O)CCCOc1cncc(c1)Br 34a_100000754920_100102525003 [0,1,0,0,0,0|3,0,0]=4 1638 B14R1.148 NC(=O)CCCOc1cncc(c1)Br 7a_100000754920_100102525003 [0,1,0,0,0,0|3,0,0]=4 1639 B14R1.148 NC(=O)CCCOc1cncc(c1)Cl 7a_100000032511_100102525003 [0,1,0,0,0,0|3,0,0]=4 1640 B14R1.148 NC(=O)CCCOc1cncc(c1)F 34a_100011830296_100102525003 [0,1,0,0,0,0|3,0,0]=4 1641 B14R1.148 NC(=O)CCCOc1cncc(c1)F 7a_100011830296_100102525003 [0,1,0,0,0,0|3,0,0]=4 1642 B14R1.148 NC(=O)CCCOc1cncc(c1)N 34a_100011997051_100102525003 [0,1,0,0,0,0|3,0,0]=4 1643 B14R1.148 NC(=O)CCCSc1cc(=O)cc[nH]1 62a_100009817434_100102525003 [0,1,0,0,0,0|3,0,0]=4 1644 B14R1.148 NC(=O)CCCSc1cc(ccn1)Cl 62a_100010167805_100102525003 [0,1,0,0,0,0|3,0,0]=4 1645 B14R1.148 NC(=O)CCCSc1cc(ccn1)Cl 62a_100102525003_100010167805 [0,1,0,0,0,0|3,0,0]=4 1646 B14R1.148 NC(=O)CCCSc1cc(ccn1)F 62a_100000764206_100102525003 [0,1,0,0,0,0|3,0,0]=4 1647 B14R1.148 NC(=O)CCCSc1cc(ccn1)F 62a_100102525003_100000764206 [0,1,0,0,0,0|3,0,0]=4 1648 B14R1.148 NC(=O)CCCSc1cc(ccn1)N 62a_100009814236_100102525003 [0,1,0,0,0,0|3,0,0]=4 1649 B14R1.148 NC(=O)CCCSc1cc(ccn1)N 62a_100102525003_100009814236 [0,1,0,0,0,0|3,0,0]=4 1650 B14R1.148 NC(=O)CCCSc1cc(ccn1)O 62a_100102525003_100000762945 [0,1,0,0,0,0|3,0,0]=4 1651 B14R1.148 NC(=O)CCCSc1cc[nH]c(=O)c1 62a_100009816521_100102525003 [0,1,0,0,0,0|3,0,0]=4 1652 B14R1.148 NC(=O)CCCSc1cc[nH]c(=O)c1 62a_100102525003_100009816521 [0,1,0,0,0,0|3,0,0]=4 1653 B14R1.148 NC(=O)CCCSc1ccc[n+](c1)[O-] 62a_100102525003_100009815978 [0,1,0,0,0,0|3,0,0]=4 1654 B14R1.148 NC(=O)CCCSc1cccc(=O)[nH]1 62a_100102525003_100000752884 [0,1,0,0,0,0|3,0,0]=4 1655 B14R1.148 NC(=O)CCCSc1cccc(c1)Br 62a_100000691529_100102525003 [0,1,0,0,0,0|2,0,0]=3 1656 B14R1.148 NC(=O)CCCSc1cccc(c1)Br 62a_100102525003_100000691529 [0,1,0,0,0,0|2,0,0]=3 1657 B14R1.148 NC(=O)CCCSc1cccc(c1)Cl 62a_100000699651_100102525003 [0,1,0,0,0,0|2,0,0]=3 1658 B14R1.148 NC(=O)CCCSc1cccc(c1)Cl 62a_100102525003_100000699651 [0,1,0,0,0,0|2,0,0]=3 1659 B14R1.148 NC(=O)CCCSc1cccc(c1)F 62a_100000685547_100102525003 [0,1,0,0,0,0|2,0,0]=3 1660 B14R1.148 NC(=O)CCCSc1cccc(c1)F 62a_100102525003_100000685547 [0,1,0,0,0,0|2,0,0]=3 1661 B14R1.148 NC(=O)CCCSc1cccc(c1)N 62a_100000210019_100102525003 [0,1,0,0,0,0|2,0,0]=3 1662 B14R1.148 NC(=O)CCCSc1cccc(c1)N 62a_100102525003_100000210019 [0,1,0,0,0,0|2,0,0]=3 1663 B14R1.148 NC(=O)CCCSc1cccc(c1)O 62a_100102525003_100000211634 [0,1,0,0,0,0|2,0,0]=3 1664 B14R1.148 NC(=O)CCCSc1cccc(c1)[S] 62a_100102525003_114929384022 [0,1,0,0,0,0|2,0,0]=3 1665 B14R1.148 NC(=O)CCCSc1cccc(c1)[S] 62a_114929384022_100102525003 [0,1,0,0,0,0|2,0,0]=3 1666 B14R1.148 NC(=O)CCCSc1cccc(n1)Br 62a_100000684672_100102525003 [0,1,0,0,0,0|3,0,0]=4 1667 B14R1.148 NC(=O)CCCSc1cccc(n1)Br 62a_100102525003_100000684672 [0,1,0,0,0,0|3,0,0]=4 1668 B14R1.148 NC(=O)CCCSc1cccc(n1)Cl 62a_100000051397_100102525003 [0,1,0,0,0,0|3,0,0]=4 1669 B14R1.148 NC(=O)CCCSc1cccc(n1)Cl 62a_100102525003_100000051397 [0,1,0,0,0,0|3,0,0]=4 1670 B14R1.148 NC(=O)CCCSc1cccc(n1)F 62a_100009815982_100102525003 [0,1,0,0,0,0|3,0,0]=4 1671 B14R1.148 NC(=O)CCCSc1cccc(n1)F 62a_100102525003_100009815982 [0,1,0,0,0,0|3,0,0]=4 1672 B14R1.148 NC(=O)CCCSc1cccc(n1)N 62a_100000740741_100102525003 [0,1,0,0,0,0|3,0,0]=4 1673 B14R1.148 NC(=O)CCCSc1cccc(n1)N 62a_100102525003_100000740741 [0,1,0,0,0,0|3,0,0]=4 1674 B14R1.148 NC(=O)CCCSc1ccnc(c1)Br 62a_100009814637_100102525003 [0,1,0,0,0,0|3,0,0]=4 1675 B14R1.148 NC(=O)CCCSc1ccnc(c1)Br 62a_100102525003_100009814637 [0,1,0,0,0,0|3,0,0]=4 1676 B14R1.148 NC(=O)CCCSc1ccnc(c1)Cl 62a_100000035001_100102525003 [0,1,0,0,0,0|3,0,0]=4 1677 B14R1.148 NC(=O)CCCSc1ccnc(c1)Cl 62a_100102525003_100000035001 [0,1,0,0,0,0|3,0,0]=4 1678 B14R1.148 NC(=O)CCCSc1ccnc(c1)F 62a_100009816116_100102525003 [0,1,0,0,0,0|3,0,0]=4 1679 B14R1.148 NC(=O)CCCSc1ccnc(c1)F 62a_100102525003_100009816116 [0,1,0,0,0,0|3,0,0]=4 1680 B14R1.148 NC(=O)CCCSc1ccnc(c1)N 62a_100000049665_100102525003 [0,1,0,0,0,0|3,0,0]=4 1681 B14R1.148 NC(=O)CCCSc1ccnc(c1)N 62a_100102525003_100000049665 [0,1,0,0,0,0|3,0,0]=4 1682 B14R1.148 NC(=O)CCCSc1cncc(c1)Br 62a_100000728054_100102525003 [0,1,0,0,0,0|3,0,0]=4 1683 B14R1.148 NC(=O)CCCSc1cncc(c1)Br 62a_100102525003_100000728054 [0,1,0,0,0,0|3,0,0]=4 1684 B14R1.148 NC(=O)CCCSc1cncc(c1)Cl 62a_100000049639_100102525003 [0,1,0,0,0,0|3,0,0]=4 1685 B14R1.148 NC(=O)CCCSc1cncc(c1)Cl 62a_100102525003_100000049639 [0,1,0,0,0,0|3,0,0]=4 1686 B14R1.148 NC(=O)CCCSc1cncc(c1)F 62a_100000744099_100102525003 [0,1,0,0,0,0|3,0,0]=4 1687 B14R1.148 NC(=O)CCCSc1cncc(c1)F 62a_100102525003_100000744099 [0,1,0,0,0,0|3,0,0]=4 1688 B14R1.148 NC(=O)CCCSc1cncc(c1)N 62a_100000687067_100102525003 [0,1,0,0,0,0|3,0,0]=4 1689 B14R1.148 NC(=O)CCCSc1cncc(c1)N 62a_100102525003_100000687067 [0,1,0,0,0,0|3,0,0]=4 1690 B14R1.148 NC(=O)CCCSc1cncc(c1)O 62a_100000754920_100102525003 [0,1,0,0,0,0|3,0,0]=4 1691 B14R1.148 NC(=O)CCCSc1cncc(c1)O 62a_100102525003_100000754920 [0,1,0,0,0,0|3,0,0]=4 1692 B14R1.148 NC(=O)CCNCc1cccc(=O)[nH]1 207a_100000740010_100011935257 [0,1,0,0,0,0|3,0,0]=4 1693 B14R1.148 NC(=O)CCNCc1cccc(=O)[nH]1 2230a_100000696482_100000744528 [0,1,0,0,0,0|3,0,0]=4 1694 B14R1.148 NC(=O)CCNCc1cccc(c1)Br 207a_100000740010_100000210085 [0,1,0,0,0,0|2,0,0]=3 1695 B14R1.148 NC(=O)CCNCc1cccc(c1)Br 2230a_100000174977_100000744528 [0,1,0,0,0,0|2,0,0]=3 1696 B14R1.148 NC(=O)CCNCc1cccc(c1)Br 34a_100000174977_100000731001 [0,1,0,0,0,0|2,0,0]=3 1697 B14R1.148 NC(=O)CCNCc1cccc(c1)Cl 207a_100000740010_100000210801 [0,1,0,0,0,0|2,0,0]=3 1698 B14R1.148 NC(=O)CCNCc1cccc(c1)Cl 2230a_100000174878_100000744528 [0,1,0,0,0,0|2,0,0]=3 1699 B14R1.148 NC(=O)CCNCc1cccc(c1)Cl 34a_100000174878_100000731001 [0,1,0,0,0,0|2,0,0]=3 1700 B14R1.148 NC(=O)CCNCc1cccc(c1)F 207a_100000740010_100000210812 [0,1,0,0,0,0|2,0,0]=3 1701 B14R1.148 NC(=O)CCNCc1cccc(c1)F 2230a_100000174948_100000744528 [0,1,0,0,0,0|2,0,0]=3 1702 B14R1.148 NC(=O)CCNCc1cccc(c1)F 34a_100000174948_100000731001 [0,1,0,0,0,0|2,0,0]=3 1703 B14R1.148 NC(=O)CCNCc1cccc(c1)I 207a_100000740010_100000014684 [0,1,0,0,0,0|2,0,0]=3 1704 B14R1.148 NC(=O)CCNCc1cccc(c1)I 2230a_100000106179_100000744528 [0,1,0,0,0,0|2,0,0]=3 1705 B14R1.148 NC(=O)CCNCc1cccc(c1)I 34a_100000106179_100000731001 [0,1,0,0,0,0|2,0,0]=3 1706 B14R1.148 NC(=O)CCNCc1cccc(c1)O 207a_100000740010_100000188321 [0,1,0,0,0,0|2,0,0]=3 1707 B14R1.148 NC(=O)CCNCc1cccc(c1)O 2230a_100000743036_100000744528 [0,1,0,0,0,0|2,0,0]=3 1708 B14R1.148 NC(=O)CCNCc1cccc(c1)O 34a_100000743036_100000731001 [0,1,0,0,0,0|2,0,0]=3 1709 B14R1.148 NC(=O)CCNCc1cccc(n1)Br 2230a_100016987751_100000744528 [0,1,0,0,0,0|3,0,0]=4 1710 B14R1.148 NC(=O)CCNCc1cccc(n1)Cl 2230a_100016990191_100000744528 [0,1,0,0,0,0|3,0,0]=4 1711 B14R1.148 NC(=O)CCNCc1cccc(n1)F 2230a_100015188798_100000744528 [0,1,0,0,0,0|3,0,0]=4 1712 B14R1.148 NC(=O)CCNCc1cccc(n1)F 34a_100015188798_100000731001 [0,1,0,0,0,0|3,0,0]=4 1713 B14R1.148 NC(=O)CCNCc1ccnc(c1)Br 2230a_100025757509_100000744528 [0,1,0,0,0,0|3,0,0]=4 1714 B14R1.148 NC(=O)CCNCc1ccnc(c1)Br 34a_100025757509_100000731001 [0,1,0,0,0,0|3,0,0]=4 1715 B14R1.148 NC(=O)CCNCc1ccnc(c1)Cl 2230a_100015205668_100000744528 [0,1,0,0,0,0|3,0,0]=4 1716 B14R1.148 NC(=O)CCNCc1ccnc(c1)Cl 34a_100015205668_100000731001 [0,1,0,0,0,0|3,0,0]=4 1717 B14R1.148 NC(=O)CCNCc1ccnc(c1)F 2230a_100015188774_100000744528 [0,1,0,0,0,0|3,0,0]=4 1718 B14R1.148 NC(=O)CCNCc1ccnc(c1)F 34a_100015188774_100000731001 [0,1,0,0,0,0|3,0,0]=4 1719 B14R1.148 NC(=O)CCNCc1ccnc(c1)O 207a_100000740010_100000688113 [0,1,0,0,0,0|3,0,0]=4 1720 B14R1.148 NC(=O)CCNCc1cncc(c1)Br 207a_100000740010_100000687066 [0,1,0,0,0,0|3,0,0]=4 1721 B14R1.148 NC(=O)CCNCc1cncc(c1)Cl 207a_100000740010_100000088910 [0,1,0,0,0,0|3,0,0]=4 1722 B14R1.148 NC(=O)CCNCc1cncc(c1)Cl 2230a_200020614424_100000744528 [0,1,0,0,0,0|3,0,0]=4 1723 B14R1.148 NC(=O)CCNCc1cncc(c1)F 207a_100000740010_100011361476 [0,1,0,0,0,0|3,0,0]=4 1724 B14R1.148 NC(=O)CCNCc1cncc(c1)F 2230a_100011962886_100000744528 [0,1,0,0,0,0|3,0,0]=4 1725 B14R1.148 NC(=O)CCNCc1cncc(c1)F 34a_100011962886_100000731001 [0,1,0,0,0,0|3,0,0]=4 1726 B14R1.148 NC(=O)CCNCc1cncc(c1)O 207a_100000740010_100012187055 [0,1,0,0,0,0|3,0,0]=4 1727 B14R1.148 NC(=O)CCOCc1cc(ccn1)Br 34a_100000757172_100010173614 [0,1,0,0,0,0|3,0,0]=4 1728 B14R1.148 NC(=O)CCOCc1cc(ccn1)Br 7a_100000757172_100010173614 [0,1,0,0,0,0|3,0,0]=4 1729 B14R1.148 NC(=O)CCOCc1cc(ccn1)Cl 34a_100000748867_100000731001 [0,1,0,0,0,0|3,0,0]=4 1730 B14R1.148 NC(=O)CCOCc1cc(ccn1)Cl 34a_100000757172_100016988179 [0,1,0,0,0,0|3,0,0]=4 1731 B14R1.148 NC(=O)CCOCc1cc(ccn1)Cl 7a_100000757172_100016988179 [0,1,0,0,0,0|3,0,0]=4 1732 B14R1.148 NC(=O)CCOCc1cc(ccn1)N 34a_100000692640_100000731001 [0,1,0,0,0,0|3,0,0]=4 1733 B14R1.148 NC(=O)CCOCc1ccc[n+](c1)[O-] 34a_100000037817_100000731001 [0,1,0,0,0,0|3,0,0]=4 1734 B14R1.148 NC(=O)CCOCc1ccc[n+](c1)[O-] 7a_100000037817_100000744528 [0,1,0,0,0,0|3,0,0]=4 1735 B14R1.148 NC(=O)CCOCc1cccc(c1)Br 34a_100000687537_100000731001 [0,1,0,0,0,0|2,0,0]=3 1736 B14R1.148 NC(=O)CCOCc1cccc(c1)Br 34a_100000757172_100000698116 [0,1,0,0,0,0|2,0,0]=3 1737 B14R1.148 NC(=O)CCOCc1cccc(c1)Br 7a_100000687537_100000744528 [0,1,0,0,0,0|2,0,0]=3 1738 B14R1.148 NC(=O)CCOCc1cccc(c1)Br 7a_100000757172_100000211773 [0,1,0,0,0,0|2,0,0]=3 1739 B14R1.148 NC(=O)CCOCc1cccc(c1)Cl 34a_100000241301_100000731001 [0,1,0,0,0,0|2,0,0]=3 1740 B14R1.148 NC(=O)CCOCc1cccc(c1)Cl 34a_100000757172_100000187163 [0,1,0,0,0,0|2,0,0]=3 1741 B14R1.148 NC(=O)CCOCc1cccc(c1)Cl 7a_100000241301_100000744528 [0,1,0,0,0,0|2,0,0]=3 1742 B14R1.148 NC(=O)CCOCc1cccc(c1)Cl 7a_100000757172_100000187163 [0,1,0,0,0,0|2,0,0]=3 1743 B14R1.148 NC(=O)CCOCc1cccc(c1)F 34a_100000210976_100000731001 [0,1,0,0,0,0|2,0,0]=3 1744 B14R1.148 NC(=O)CCOCc1cccc(c1)F 34a_100000757172_100000187166 [0,1,0,0,0,0|2,0,0]=3 1745 B14R1.148 NC(=O)CCOCc1cccc(c1)F 7a_100000210976_100000744528 [0,1,0,0,0,0|2,0,0]=3 1746 B14R1.148 NC(=O)CCOCc1cccc(c1)F 7a_100000757172_100000230114 [0,1,0,0,0,0|2,0,0]=3 1747 B14R1.148 NC(=O)CCOCc1cccc(c1)I 34a_100000757172_100011218688 [0,1,0,0,0,0|2,0,0]=3 1748 B14R1.148 NC(=O)CCOCc1cccc(c1)I 34a_100011215336_100000731001 [0,1,0,0,0,0|2,0,0]=3 1749 B14R1.148 NC(=O)CCOCc1cccc(c1)I 7a_100000757172_100011218688 [0,1,0,0,0,0|2,0,0]=3 1750 B14R1.148 NC(=O)CCOCc1cccc(c1)I 7a_100011215336_100000744528 [0,1,0,0,0,0|2,0,0]=3 1751 B14R1.148 NC(=O)CCOCc1cccc(c1)N 34a_100000211919_100000731001 [0,1,0,0,0,0|2,0,0]=3 1752 B14R1.148 NC(=O)CCOCc1cccc(c1)O 34a_100000757172_100011660834 [0,1,0,0,0,0|2,0,0]=3 1753 B14R1.148 NC(=O)CCOCc1cccc(c1)O 7a_100000757172_100000084143 [0,1,0,0,0,0|2,0,0]=3 1754 B14R1.148 NC(=O)CCOCc1cccc(n1)Br 34a_100000694195_100000731001 [0,1,0,0,0,0|3,0,0]=4 1755 B14R1.148 NC(=O)CCOCc1cccc(n1)Br 34a_100000757172_100009889011 [0,1,0,0,0,0|3,0,0]=4 1756 B14R1.148 NC(=O)CCOCc1cccc(n1)Br 7a_100000757172_100009889011 [0,1,0,0,0,0|3,0,0]=4 1757 B14R1.148 NC(=O)CCOCc1cccc(n1)Cl 34a_100000757172_100000086093 [0,1,0,0,0,0|3,0,0]=4 1758 B14R1.148 NC(=O)CCOCc1cccc(n1)Cl 34a_100011998359_100000731001 [0,1,0,0,0,0|3,0,0]=4 1759 B14R1.148 NC(=O)CCOCc1cccc(n1)Cl 7a_100000757172_100000086093 [0,1,0,0,0,0|3,0,0]=4 1760 B14R1.148 NC(=O)CCOCc1cccc(n1)F 34a_100000086748_100000731001 [0,1,0,0,0,0|3,0,0]=4 1761 B14R1.148 NC(=O)CCOCc1cccc(n1)F 34a_100000757172_100009819644 [0,1,0,0,0,0|3,0,0]=4 1762 B14R1.148 NC(=O)CCOCc1cccc(n1)F 7a_100000757172_100009819644 [0,1,0,0,0,0|3,0,0]=4 1763 B14R1.148 NC(=O)CCOCc1ccnc(c1)Br 34a_100000757172_100010243470 [0,1,0,0,0,0|3,0,0]=4 1764 B14R1.148 NC(=O)CCOCc1ccnc(c1)Br 34a_100009814636_100000731001 [0,1,0,0,0,0|3,0,0]=4 1765 B14R1.148 NC(=O)CCOCc1ccnc(c1)Br 7a_100000757172_100010254460 [0,1,0,0,0,0|3,0,0]=4 1766 B14R1.148 NC(=O)CCOCc1ccnc(c1)Br 7a_100009814636_100000744528 [0,1,0,0,0,0|3,0,0]=4 1767 B14R1.148 NC(=O)CCOCc1ccnc(c1)Cl 34a_100000748751_100000731001 [0,1,0,0,0,0|3,0,0]=4 1768 B14R1.148 NC(=O)CCOCc1ccnc(c1)Cl 34a_100000757172_100000764220 [0,1,0,0,0,0|3,0,0]=4 1769 B14R1.148 NC(=O)CCOCc1ccnc(c1)Cl 7a_100000757172_100000764220 [0,1,0,0,0,0|3,0,0]=4 1770 B14R1.148 NC(=O)CCOCc1ccnc(c1)F 34a_100000082451_100000731001 [0,1,0,0,0,0|3,0,0]=4 1771 B14R1.148 NC(=O)CCOCc1cncc(c1)Br 34a_100000757172_100000738771 [0,1,0,0,0,0|3,0,0]=4 1772 B14R1.148 NC(=O)CCOCc1cncc(c1)Br 34a_100011259137_100000731001 [0,1,0,0,0,0|3,0,0]=4 1773 B14R1.148 NC(=O)CCOCc1cncc(c1)Br 7a_100000757172_100000738771 [0,1,0,0,0,0|3,0,0]=4 1774 B14R1.148 NC(=O)CCOCc1cncc(c1)Br 7a_100011259137_100000744528 [0,1,0,0,0,0|3,0,0]=4 1775 B14R1.148 NC(=O)CCOCc1cncc(c1)Cl 34a_100000092867_100000731001 [0,1,0,0,0,0|3,0,0]=4 1776 B14R1.148 NC(=O)CCOCc1cncc(c1)Cl 34a_100000757172_100016992070 [0,1,0,0,0,0|3,0,0]=4 1777 B14R1.148 NC(=O)CCOCc1cncc(c1)Cl 7a_100000092867_100000744528 [0,1,0,0,0,0|3,0,0]=4 1778 B14R1.148 NC(=O)CCOCc1cncc(c1)Cl 7a_100000757172_100016992070 [0,1,0,0,0,0|3,0,0]=4 1779 B14R1.148 NC(=O)CCOCc1cncc(c1)F 34a_100000757172_100000725299 [0,1,0,0,0,0|3,0,0]=4 1780 B14R1.148 NC(=O)CCOCc1cncc(c1)F 34a_100011962875_100000731001 [0,1,0,0,0,0|3,0,0]=4 1781 B14R1.148 NC(=O)CCOCc1cncc(c1)F 7a_100000757172_100000725299 [0,1,0,0,0,0|3,0,0]=4 1782 B14R1.148 NC(=O)CCOCc1cncc(c1)F 7a_100011962875_100000744528 [0,1,0,0,0,0|3,0,0]=4 1783 B14R1.148 NC(=O)CCOCc1cncc(c1)N 34a_100000085308_100000731001 [0,1,0,0,0,0|3,0,0]=4 1784 B14R1.148 NC(=O)CCSCc1cc(ccn1)Br 62a_100000744528_100010173614 [0,1,0,0,0,0|3,0,0]=4 1785 B14R1.148 NC(=O)CCSCc1cc(ccn1)Br 62a_100010173614_100000744528 [0,1,0,0,0,0|3,0,0]=4 1786 B14R1.148 NC(=O)CCSCc1cc(ccn1)Cl 62a_100000744528_100016988179 [0,1,0,0,0,0|3,0,0]=4 1787 B14R1.148 NC(=O)CCSCc1cc(ccn1)Cl 62a_100016988179_100000744528 [0,1,0,0,0,0|3,0,0]=4 1788 B14R1.148 NC(=O)CCSCc1cccc(c1)Br 62a_100000211773_100000744528 [0,1,0,0,0,0|2,0,0]=3 1789 B14R1.148 NC(=O)CCSCc1cccc(c1)Br 62a_100000744528_100000211773 [0,1,0,0,0,0|2,0,0]=3 1790 B14R1.148 NC(=O)CCSCc1cccc(c1)Cl 62a_100000187163_100000744528 [0,1,0,0,0,0|2,0,0]=3 1791 B14R1.148 NC(=O)CCSCc1cccc(c1)Cl 62a_100000744528_100000187163 [0,1,0,0,0,0|2,0,0]=3 1792 B14R1.148 NC(=O)CCSCc1cccc(c1)F 62a_100000230114_100000744528 [0,1,0,0,0,0|2,0,0]=3 1793 B14R1.148 NC(=O)CCSCc1cccc(c1)F 62a_100000744528_100000230114 [0,1,0,0,0,0|2,0,0]=3 1794 B14R1.148 NC(=O)CCSCc1cccc(c1)I 62a_100000744528_100011218688 [0,1,0,0,0,0|2,0,0]=3 1795 B14R1.148 NC(=O)CCSCc1cccc(c1)I 62a_100011218688_100000744528 [0,1,0,0,0,0|2,0,0]=3 1796 B14R1.148 NC(=O)CCSCc1cccc(c1)O 62a_100000744528_100011660834 [0,1,0,0,0,0|2,0,0]=3 1797 B14R1.148 NC(=O)CCSCc1cccc(c1)O 62a_100011660834_100000744528 [0,1,0,0,0,0|2,0,0]=3 1798 B14R1.148 NC(=O)CCSCc1cccc(n1)Br 62a_100000744528_100009889011 [0,1,0,0,0,0|3,0,0]=4 1799 B14R1.148 NC(=O)CCSCc1cccc(n1)Br 62a_100009889011_100000744528 [0,1,0,0,0,0|3,0,0]=4 1800 B14R1.148 NC(=O)CCSCc1cccc(n1)Cl 62a_100000086093_100000744528 [0,1,0,0,0,0|3,0,0]=4 1801 B14R1.148 NC(=O)CCSCc1cccc(n1)Cl 62a_100000744528_100000086093 [0,1,0,0,0,0|3,0,0]=4 1802 B14R1.148 NC(=O)CCSCc1cccc(n1)F 62a_100000744528_100009819644 [0,1,0,0,0,0|3,0,0]=4 1803 B14R1.148 NC(=O)CCSCc1cccc(n1)F 62a_100009819644_100000744528 [0,1,0,0,0,0|3,0,0]=4 1804 B14R1.148 NC(=O)CCSCc1ccnc(c1)Br 62a_100000744528_100010243470 [0,1,0,0,0,0|3,0,0]=4 1805 B14R1.148 NC(=O)CCSCc1ccnc(c1)Br 62a_100010254460_100000744528 [0,1,0,0,0,0|3,0,0]=4 1806 B14R1.148 NC(=O)CCSCc1ccnc(c1)Cl 62a_100000744528_100000764220 [0,1,0,0,0,0|3,0,0]=4 1807 B14R1.148 NC(=O)CCSCc1ccnc(c1)Cl 62a_100000764220_100000744528 [0,1,0,0,0,0|3,0,0]=4 1808 B14R1.148 NC(=O)CCSCc1cncc(c1)Br 62a_100000738771_100000744528 [0,1,0,0,0,0|3,0,0]=4 1809 B14R1.148 NC(=O)CCSCc1cncc(c1)Br 62a_100000744528_100000738771 [0,1,0,0,0,0|3,0,0]=4 1810 B14R1.148 NC(=O)CCSCc1cncc(c1)Cl 62a_100000744528_100016992070 [0,1,0,0,0,0|3,0,0]=4 1811 B14R1.148 NC(=O)CCSCc1cncc(c1)Cl 62a_100016992070_100000744528 [0,1,0,0,0,0|3,0,0]=4 1812 B14R1.148 NC(=O)CCSCc1cncc(c1)F 62a_100000725299_100000744528 [0,1,0,0,0,0|3,0,0]=4 1813 B14R1.148 NC(=O)CCSCc1cncc(c1)F 62a_100000744528_100000725299 [0,1,0,0,0,0|3,0,0]=4 1814 B14R1.148 NC(=O)CNCCc1cccc(c1)Br 2230a_100000711301_100011740638 [0,1,0,0,0,0|2,0,0]=3 1815 B14R1.148 NC(=O)CNCCc1cccc(c1)Br 2230a_100011207229_100000747473 [0,1,0,0,0,0|2,0,0]=3 1816 B14R1.148 NC(=O)CNCCc1cccc(c1)Br 34a_100011207229_100000187820 [0,1,0,0,0,0|2,0,0]=3 1817 B14R1.148 NC(=O)CNCCc1cccc(c1)Cl 2230a_100000185263_100000747473 [0,1,0,0,0,0|2,0,0]=3 1818 B14R1.148 NC(=O)CNCCc1cccc(c1)Cl 2230a_100000711301_100011713710 [0,1,0,0,0,0|2,0,0]=3 1819 B14R1.148 NC(=O)CNCCc1cccc(c1)Cl 34a_100000185263_100000187820 [0,1,0,0,0,0|2,0,0]=3 1820 B14R1.148 NC(=O)CNCCc1cccc(c1)F 2230a_100000205154_100000747473 [0,1,0,0,0,0|2,0,0]=3 1821 B14R1.148 NC(=O)CNCCc1cccc(c1)F 2230a_100000711301_100011217235 [0,1,0,0,0,0|2,0,0]=3 1822 B14R1.148 NC(=O)CNCCc1cccc(c1)F 34a_100000205154_100000187820 [0,1,0,0,0,0|2,0,0]=3 1823 B14R1.148 NC(=O)CNCCc1cccc(c1)O 2230a_100000747277_100000747473 [0,1,0,0,0,0|2,0,0]=3 1824 B14R1.148 NC(=O)CNCCc1cccc(c1)O 34a_100000747277_100000187820 [0,1,0,0,0,0|2,0,0]=3 1825 B14R1.148 NC(=O)COCCc1cccc(c1)Br 34a_100011217444_100000187820 [0,1,0,0,0,0|2,0,0]=3 1826 B14R1.148 NC(=O)COCCc1cccc(c1)Br 7a_100011217444_100000187820 [0,1,0,0,0,0|2,0,0]=3 1827 B14R1.148 NC(=O)COCCc1cccc(c1)Cl 34a_100000754733_100000187820 [0,1,0,0,0,0|2,0,0]=3 1828 B14R1.148 NC(=O)COCCc1cccc(c1)Cl 7a_100000754733_100000187820 [0,1,0,0,0,0|2,0,0]=3 1829 B14R1.148 NC(=O)COCCc1cccc(c1)F 34a_100000763591_100000187820 [0,1,0,0,0,0|2,0,0]=3 1830 B14R1.148 NC(=O)COCCc1cccc(c1)F 7a_100000763591_100000187820 [0,1,0,0,0,0|2,0,0]=3 1831 B14R1.148 NC(=O)COCCc1cccc(c1)N 34a_100011996697_100000187820 [0,1,0,0,0,0|2,0,0]=3 1832 B14R1.148 NC(=O)COCCc1cccc(n1)Br 34a_100010221043_100000187820 [0,1,0,0,0,0|3,0,0]=4 1833 B14R1.148 NC(=O)COCCc1cccc(n1)Br 7a_100010221043_100000187820 [0,1,0,0,0,0|3,0,0]=4 1834 B14R1.148 NC(=O)CSCCc1cccc(c1)Br 62a_100000747473_100011740638 [0,1,0,0,0,0|2,0,0]=3 1835 B14R1.148 NC(=O)CSCCc1cccc(c1)Br 62a_100011740638_100000747473 [0,1,0,0,0,0|2,0,0]=3 1836 B14R1.148 NC(=O)CSCCc1cccc(c1)Cl 62a_100000747473_100011713710 [0,1,0,0,0,0|2,0,0]=3 1837 B14R1.148 NC(=O)CSCCc1cccc(c1)Cl 62a_100011713710_100000747473 [0,1,0,0,0,0|2,0,0]=3 1838 B14R1.148 NC(=O)CSCCc1cccc(c1)F 62a_100000747473_100011217235 [0,1,0,0,0,0|2,0,0]=3 1839 B14R1.148 NC(=O)CSCCc1cccc(c1)F 62a_100011217235_100000747473 [0,1,0,0,0,0|2,0,0]=3 1840 B14R1.148 NC(=O)NCCOc1cccc(c1)Br 7a_100000210342_200000034859 [0,1,0,0,0,0|3,0,0]=4 1841 B14R1.148 NC(=O)NCCOc1cccc(c1)Cl 7a_100000210295_200000034859 [0,1,0,0,0,0|3,0,0]=4 1842 B14R1.148 NC(=O)NCCOc1cccc(c1)F 7a_100000210426_200000034859 [0,1,0,0,0,0|3,0,0]=4 1843 B14R1.148 NC(=O)NCCOc1cccc(c1)I 7a_100000211634_200000034859 [0,1,0,0,0,0|3,0,0]=4 1844 B14R1.148 NC(=O)NCCSc1cccc(c1)Br 62a_100000691529_200000034859 [0,1,0,0,0,0|3,0,0]=4 1845 B14R1.148 NC(=O)NCCSc1cccc(c1)Br 62a_200000034859_100000691529 [0,1,0,0,0,0|3,0,0]=4 1846 B14R1.148 NC(=O)NCCSc1cccc(c1)Cl 62a_100000699651_200000034859 [0,1,0,0,0,0|3,0,0]=4 1847 B14R1.148 NC(=O)NCCSc1cccc(c1)Cl 62a_200000034859_100000699651 [0,1,0,0,0,0|3,0,0]=4 1848 B14R1.148 NC(=O)NCCSc1cccc(c1)F 62a_100000685547_200000034859 [0,1,0,0,0,0|3,0,0]=4 1849 B14R1.148 NC(=O)NCCSc1cccc(c1)F 62a_200000034859_100000685547 [0,1,0,0,0,0|3,0,0]=4 1850 B14R1.148 NC(=O)NCCSc1cccc(c1)N 62a_100000210019_200000034859 [0,1,0,0,0,0|3,0,0]=4 1851 B14R1.148 NC(=O)NCCSc1cccc(c1)N 62a_200000034859_100000210019 [0,1,0,0,0,0|3,0,0]=4 1852 B14R1.148 NC(=O)NCCSc1cccc(c1)O 62a_200000034859_100000211634 [0,1,0,0,0,0|3,0,0]=4 1853 B14R1.148 NC(=O)NCCSc1cccc(c1)[S] 62a_114929384022_200000034859 [0,1,0,0,0,0|3,0,0]=4 1854 B14R1.148 NC(=O)NCCSc1cccc(c1)[S] 62a_200000034859_114929384022 [0,1,0,0,0,0|3,0,0]=4 1855 B14R1.148 NC(=O)OCCNc1cccc(c1)Br 34a_100000210019_200011214921 [0,1,0,0,0,0|3,0,0]=4 1856 B14R1.148 NC(=O)OCCNc1cccc(c1)Cl 34a_100000185859_200011214921 [0,1,0,0,0,0|3,0,0]=4 1857 B14R1.148 NC(=O)OCCNc1cccc(c1)F 34a_100000210047_200011214921 [0,1,0,0,0,0|3,0,0]=4 1858 B14R1.148 NC(=O)OCCNc1cccc(c1)I 34a_100000211102_200011214921 [0,1,0,0,0,0|3,0,0]=4 1859 B14R1.148 NC(=O)OCCNc1cccc(c1)O 34a_100000210217_200011214921 [0,1,0,0,0,0|3,0,0]=4 1860 B14R1.148 NC(=O)OCCOc1cccc(c1)Br 34a_100000210342_200011214921 [0,1,0,0,0,0|3,0,0]=4 1861 B14R1.148 NC(=O)OCCOc1cccc(c1)Br 7a_100000210342_200011214921 [0,1,0,0,0,0|3,0,0]=4 1862 B14R1.148 NC(=O)OCCOc1cccc(c1)Cl 34a_100000210295_200011214921 [0,1,0,0,0,0|3,0,0]=4 1863 B14R1.148 NC(=O)OCCOc1cccc(c1)Cl 7a_100000210295_200011214921 [0,1,0,0,0,0|3,0,0]=4 1864 B14R1.148 NC(=O)OCCOc1cccc(c1)F 34a_100000210426_200011214921 [0,1,0,0,0,0|3,0,0]=4 1865 B14R1.148 NC(=O)OCCOc1cccc(c1)F 7a_100000210426_200011214921 [0,1,0,0,0,0|3,0,0]=4 1866 B14R1.148 NC(=O)OCCOc1cccc(c1)I 34a_100000211634_200011214921 [0,1,0,0,0,0|3,0,0]=4 1867 B14R1.148 NC(=O)OCCOc1cccc(c1)I 7a_100000211634_200011214921 [0,1,0,0,0,0|3,0,0]=4 1868 B14R1.148 NC(=O)OCCOc1cccc(c1)N 34a_100000210217_200011214921 [0,1,0,0,0,0|3,0,0]=4 1869 B14R1.148 NC(=O)OCCSc1cccc(c1)Br 62a_100000691529_200011214921 [0,1,0,0,0,0|3,0,0]=4 1870 B14R1.148 NC(=O)OCCSc1cccc(c1)Br 62a_200011214921_100000691529 [0,1,0,0,0,0|3,0,0]=4 1871 B14R1.148 NC(=O)OCCSc1cccc(c1)Cl 62a_100000699651_200011214921 [0,1,0,0,0,0|3,0,0]=4 1872 B14R1.148 NC(=O)OCCSc1cccc(c1)Cl 62a_200011214921_100000699651 [0,1,0,0,0,0|3,0,0]=4 1873 B14R1.148 NC(=O)OCCSc1cccc(c1)F 62a_100000685547_200011214921 [0,1,0,0,0,0|3,0,0]=4 1874 B14R1.148 NC(=O)OCCSc1cccc(c1)F 62a_200011214921_100000685547 [0,1,0,0,0,0|3,0,0]=4 1875 B14R1.148 NC(=O)OCCSc1cccc(c1)N 62a_100000210019_200011214921 [0,1,0,0,0,0|3,0,0]=4 1876 B14R1.148 NC(=O)OCCSc1cccc(c1)N 62a_200011214921_100000210019 [0,1,0,0,0,0|3,0,0]=4 1877 B14R1.148 NC(=O)OCCSc1cccc(c1)O 62a_200011214921_100000211634 [0,1,0,0,0,0|3,0,0]=4 1878 B14R1.148 NC(=O)OCCSc1cccc(c1)[S] 62a_114929384022_200011214921 [0,1,0,0,0,0|3,0,0]=4 1879 B14R1.148 NC(=O)OCCSc1cccc(c1)[S] 62a_200011214921_114929384022 [0,1,0,0,0,0|3,0,0]=4 1880 B14R1.148 Nc1cccc(c1)CCOCC(=O)[O-] 34a_100011996697_100020667443 [0,1,0,0,0,0|1,0,1]=3 1881 B14R1.148 Nc1cccc(c1)CCOC[N+](=O)[O-] 34a_100011996697_100000761209 [0,1,0,0,0,0|2,0,1]=4 1882 B14R1.148 O=C(O)CNCCc1cccc(c1)Br 269956a_100016091260_100011740638 [0,1,0,0,0,0|1,0,0]=2 1883 B14R1.148 O=C(O)CNCCc1cccc(c1)Cl 269956a_100016091260_100011713710 [0,1,0,0,0,0|1,0,0]=2 1884 B14R1.148 O=C(O)CNCCc1cccc(c1)F 269956a_100016091260_100011217235 [0,1,0,0,0,0|1,0,0]=2 1885 B14R1.148 O=C(O)CONCc1cc(ccn1)Br 269956a_100000106656_100010173614 [0,1,0,0,0,0|3,0,0]=4 1886 B14R1.148 O=C(O)CONCc1cc(ccn1)Cl 269956a_100000106656_100016988179 [0,1,0,0,0,0|3,0,0]=4 1887 B14R1.148 O=C(O)CONCc1cccc(c1)Br 269956a_100000106656_100000211773 [0,1,0,0,0,0|2,0,0]=3 1888 B14R1.148 O=C(O)CONCc1cccc(c1)Cl 269956a_100000106656_100000187163 [0,1,0,0,0,0|2,0,0]=3 1889 B14R1.148 O=C(O)CONCc1cccc(c1)F 269956a_100000106656_100000230114 [0,1,0,0,0,0|2,0,0]=3 1890 B14R1.148 O=C(O)CONCc1cccc(c1)I 269956a_100000106656_100011218688 [0,1,0,0,0,0|2,0,0]=3 1891 B14R1.148 O=C(O)CONCc1cccc(c1)O 269956a_100000106656_100011660834 [0,1,0,0,0,0|2,0,0]=3 1892 B14R1.148 O=C(O)CONCc1cccc(n1)Br 269956a_100000106656_100009889011 [0,1,0,0,0,0|3,0,0]=4 1893 B14R1.148 O=C(O)CONCc1cccc(n1)Cl 269956a_100000106656_100000086093 [0,1,0,0,0,0|3,0,0]=4 1894 B14R1.148 O=C(O)CONCc1cccc(n1)F 269956a_100000106656_100009819644 [0,1,0,0,0,0|3,0,0]=4 1895 B14R1.148 O=C(O)CONCc1ccnc(c1)Br 269956a_100000106656_100010254460 [0,1,0,0,0,0|3,0,0]=4 1896 B14R1.148 O=C(O)CONCc1ccnc(c1)Cl 269956a_100000106656_100000764220 [0,1,0,0,0,0|3,0,0]=4 1897 B14R1.148 O=C(O)CONCc1cncc(c1)Br 269956a_100000106656_100000738771 [0,1,0,0,0,0|3,0,0]=4 1898 B14R1.148 O=C(O)CONCc1cncc(c1)Cl 269956a_100000106656_100016992070 [0,1,0,0,0,0|3,0,0]=4 1899 B14R1.148 O=C(O)CONCc1cncc(c1)F 269956a_100000106656_100000725299 [0,1,0,0,0,0|3,0,0]=4 1900 B14R1.148 O=C([O-])CNCCc1cccc(c1)Br 34a_100011207229_100020667443 [0,1,0,0,0,0|1,0,1]=3 1901 B14R1.148 O=C([O-])CNCCc1cccc(c1)Cl 34a_100000185263_100020667443 [0,1,0,0,0,0|1,0,1]=3 1902 B14R1.148 O=C([O-])CNCCc1cccc(c1)F 34a_100000205154_100020667443 [0,1,0,0,0,0|1,0,1]=3 1903 B14R1.148 O=C([O-])CNCCc1cccc(c1)O 34a_100000747277_100020667443 [0,1,0,0,0,0|1,0,1]=3 1904 B14R1.148 O=C([O-])COCCc1cccc(c1)Br 34a_100011217444_100020667443 [0,1,0,0,0,0|1,0,1]=3 1905 B14R1.148 O=C([O-])COCCc1cccc(c1)Cl 34a_100000754733_100020667443 [0,1,0,0,0,0|1,0,1]=3 1906 B14R1.148 O=C([O-])COCCc1cccc(c1)F 34a_100000763591_100020667443 [0,1,0,0,0,0|1,0,1]=3 1907 B14R1.148 O=C([O-])COCCc1cccc(n1)Br 34a_100010221043_100020667443 [0,1,0,0,0,0|2,0,1]=4 1908 B14R1.148 O=C([O-])CSCCc1cccc(c1)Br 62a_100011740638_100020667443 [0,1,0,0,0,0|1,0,1]=3 1909 B14R1.148 O=C([O-])CSCCc1cccc(c1)Br 62a_100020667443_100011740638 [0,1,0,0,0,0|1,0,1]=3 1910 B14R1.148 O=C([O-])CSCCc1cccc(c1)Cl 62a_100011713710_100020667443 [0,1,0,0,0,0|1,0,1]=3 1911 B14R1.148 O=C([O-])CSCCc1cccc(c1)Cl 62a_100020667443_100011713710 [0,1,0,0,0,0|1,0,1]=3 1912 B14R1.148 O=C([O-])CSCCc1cccc(c1)F 62a_100011217235_100020667443 [0,1,0,0,0,0|1,0,1]=3 1913 B14R1.148 O=C([O-])CSCCc1cccc(c1)F 62a_100020667443_100011217235 [0,1,0,0,0,0|1,0,1]=3 1914 B14R1.148 O=[N+]([O-])CNCCc1cccc(c1)Br 34a_100011207229_100000761209 [0,1,0,0,0,0|2,0,1]=4 1915 B14R1.148 O=[N+]([O-])CNCCc1cccc(c1)Cl 34a_100000185263_100000761209 [0,1,0,0,0,0|2,0,1]=4 1916 B14R1.148 O=[N+]([O-])CNCCc1cccc(c1)F 34a_100000205154_100000761209 [0,1,0,0,0,0|2,0,1]=4 1917 B14R1.148 O=[N+]([O-])CNCCc1cccc(c1)O 34a_100000747277_100000761209 [0,1,0,0,0,0|2,0,1]=4 1918 B14R1.148 O=[N+]([O-])COCCc1cccc(c1)Br 34a_100011217444_100000761209 [0,1,0,0,0,0|2,0,1]=4 1919 B14R1.148 O=[N+]([O-])COCCc1cccc(c1)Cl 34a_100000754733_100000761209 [0,1,0,0,0,0|2,0,1]=4 1920 B14R1.148 O=[N+]([O-])COCCc1cccc(c1)F 34a_100000763591_100000761209 [0,1,0,0,0,0|2,0,1]=4 1921 B14R1.148 O=[N+]([O-])CSCCc1cccc(c1)Br 62a_100011740638_100000761209 [0,1,0,0,0,0|2,0,1]=4 1922 B14R1.148 O=[N+]([O-])CSCCc1cccc(c1)Cl 62a_100011713710_100000761209 [0,1,0,0,0,0|2,0,1]=4 1923 B14R1.148 O=[N+]([O-])CSCCc1cccc(c1)F 62a_100011217235_100000761209 [0,1,0,0,0,0|2,0,1]=4 1924 B14R1.148 [13CH3]C(=O)CCCCc1cccc(c1)Br 1458a_200010160685_200025704644 [0,1,0,0,0,0|1,0,0]=2 1925 B14R1.148 [13CH3]C(=O)CCCOc1cccc(c1)O 1458a_200009913207_200025704644 [0,1,0,0,0,0|2,0,0]=3 1926 B14R1.159 C=C(Br)CCOCc1ccccc1Br 34a_100009813270_100000184730 [0,1,0,0,0,0|3,0,0]=4 1927 B14R1.159 C=C(Br)CCOCc1ccccc1C 34a_100009813270_100000211839 [0,1,0,0,0,0|3,0,0]=4 1928 B14R1.159 C=C(Br)CCOCc1ccccc1Cl 34a_100009813270_100000187162 [0,1,0,0,0,0|3,0,0]=4 1929 B14R1.159 C=C(Br)CCOCc1ccccc1F 34a_100009813270_100000211605 [0,1,0,0,0,0|3,0,0]=4 1930 B14R1.159 C=C(Br)CCOCc1ccccc1I 34a_100009813270_100011215278 [0,1,0,0,0,0|3,0,0]=4 1931 B14R1.159 C=C(C)CCNCc1ccccc1Br 2230a_100000689332_100000730704 [0,1,0,0,0,0|3,0,0]=4 1932 B14R1.159 C=C(C)CCNCc1ccccc1Br 34a_100000689332_100000730704 [0,1,0,0,0,0|3,0,0]=4 1933 B14R1.159 C=C(C)CCNCc1ccccc1C 34a_100000174972_100000730704 [0,1,0,0,0,0|3,0,0]=4 1934 B14R1.159 C=C(C)CCNCc1ccccc1Cl 2230a_100000174879_100000730704 [0,1,0,0,0,0|3,0,0]=4 1935 B14R1.159 C=C(C)CCNCc1ccccc1Cl 34a_100000174879_100000730704 [0,1,0,0,0,0|3,0,0]=4 1936 B14R1.159 C=C(C)CCNCc1ccccc1F 34a_100000174869_100000730704 [0,1,0,0,0,0|3,0,0]=4 1937 B14R1.159 C=C(C)CCNCc1ccccc1O 34a_100000185550_100000730704 [0,1,0,0,0,0|3,0,0]=4 1938 B14R1.159 C=C(C)CCOCc1ccccc1Br 34a_100000756307_100000730704 [0,1,0,0,0,0|3,0,0]=4 1939 B14R1.159 C=C(C)CCOCc1ccccc1Br 34a_100000764851_100000184730 [0,1,0,0,0,0|3,0,0]=4 1940 B14R1.159 C=C(C)CCOCc1ccccc1Br 7a_100000756307_100000730704 [0,1,0,0,0,0|3,0,0]=4 1941 B14R1.159 C=C(C)CCOCc1ccccc1C 34a_100000698903_100000730704 [0,1,0,0,0,0|3,0,0]=4 1942 B14R1.159 C=C(C)CCOCc1ccccc1C 34a_100000764851_100000211839 [0,1,0,0,0,0|3,0,0]=4 1943 B14R1.159 C=C(C)CCOCc1ccccc1C 7a_100000698903_100000730704 [0,1,0,0,0,0|3,0,0]=4 1944 B14R1.159 C=C(C)CCOCc1ccccc1Cl 34a_100000210847_100000730704 [0,1,0,0,0,0|3,0,0]=4 1945 B14R1.159 C=C(C)CCOCc1ccccc1Cl 34a_100000764851_100000187162 [0,1,0,0,0,0|3,0,0]=4 1946 B14R1.159 C=C(C)CCOCc1ccccc1Cl 7a_100000210847_100000730704 [0,1,0,0,0,0|3,0,0]=4 1947 B14R1.159 C=C(C)CCOCc1ccccc1F 34a_100000211962_100000730704 [0,1,0,0,0,0|3,0,0]=4 1948 B14R1.159 C=C(C)CCOCc1ccccc1F 34a_100000764851_100000211605 [0,1,0,0,0,0|3,0,0]=4 1949 B14R1.159 C=C(C)CCOCc1ccccc1F 7a_100000211962_100000730704 [0,1,0,0,0,0|3,0,0]=4 1950 B14R1.159 C=C(C)CCOCc1ccccc1I 34a_100000187465_100000730704 [0,1,0,0,0,0|3,0,0]=4 1951 B14R1.159 C=C(C)CCOCc1ccccc1I 34a_100000764851_100011215278 [0,1,0,0,0,0|3,0,0]=4 1952 B14R1.159 C=C(C)CCOCc1ccccc1I 7a_100000187465_100000730704 [0,1,0,0,0,0|3,0,0]=4 1953 B14R1.159 C=C(C)CCOCc1ccccc1N 34a_100000212039_100000730704 [0,1,0,0,0,0|3,0,0]=4 1954 B14R1.159 C=C(C)CCSCc1ccccc1Br 62a_100000184730_100000730704 [0,1,0,0,0,0|3,0,0]=4 1955 B14R1.159 C=C(C)CCSCc1ccccc1Br 62a_100000730704_100000184730 [0,1,0,0,0,0|3,0,0]=4 1956 B14R1.159 C=C(C)CCSCc1ccccc1C 62a_100000211839_100000730704 [0,1,0,0,0,0|3,0,0]=4 1957 B14R1.159 C=C(C)CCSCc1ccccc1C 62a_100000730704_100000211839 [0,1,0,0,0,0|3,0,0]=4 1958 B14R1.159 C=C(C)CCSCc1ccccc1Cl 62a_100000187162_100000730704 [0,1,0,0,0,0|3,0,0]=4 1959 B14R1.159 C=C(C)CCSCc1ccccc1Cl 62a_100000730704_100000187162 [0,1,0,0,0,0|3,0,0]=4 1960 B14R1.159 C=C(C)CCSCc1ccccc1F 62a_100000211605_100000730704 [0,1,0,0,0,0|3,0,0]=4 1961 B14R1.159 C=C(C)CCSCc1ccccc1F 62a_100000730704_100000211605 [0,1,0,0,0,0|3,0,0]=4 1962 B14R1.159 C=C(C)CCSCc1ccccc1I 62a_100000730704_100011216222 [0,1,0,0,0,0|3,0,0]=4 1963 B14R1.159 C=C(C)CCSCc1ccccc1I 62a_100011216222_100000730704 [0,1,0,0,0,0|3,0,0]=4 1964 B14R1.159 C=C(C)CNCCc1ccccc1Br 2230a_100000747383_100000748629 [0,1,0,0,0,0|3,0,0]=4 1965 B14R1.159 C=C(C)CNCCc1ccccc1Br 34a_100000747383_100000748629 [0,1,0,0,0,0|3,0,0]=4 1966 B14R1.159 C=C(C)CNCCc1ccccc1C 2230a_100000685071_100000748629 [0,1,0,0,0,0|3,0,0]=4 1967 B14R1.159 C=C(C)CNCCc1ccccc1C 34a_100000685071_100000748629 [0,1,0,0,0,0|3,0,0]=4 1968 B14R1.159 C=C(C)CNCCc1ccccc1Cl 2230a_100011207228_100000748629 [0,1,0,0,0,0|3,0,0]=4 1969 B14R1.159 C=C(C)CNCCc1ccccc1Cl 34a_100011207228_100000748629 [0,1,0,0,0,0|3,0,0]=4 1970 B14R1.159 C=C(C)CNCCc1ccccc1F 2230a_100000185272_100000748629 [0,1,0,0,0,0|3,0,0]=4 1971 B14R1.159 C=C(C)CNCCc1ccccc1F 34a_100000185272_100000748629 [0,1,0,0,0,0|3,0,0]=4 1972 B14R1.159 C=C(C)CNCCc1ccccc1O 34a_100011207237_100000748629 [0,1,0,0,0,0|3,0,0]=4 1973 B14R1.159 C=C(C)COCCc1ccccc1Br 34a_100000210245_100012161201 [0,1,0,0,0,0|3,0,0]=4 1974 B14R1.159 C=C(C)COCCc1ccccc1Br 34a_100000731337_100000748629 [0,1,0,0,0,0|3,0,0]=4 1975 B14R1.159 C=C(C)COCCc1ccccc1Br 7a_100000731337_100000748629 [0,1,0,0,0,0|3,0,0]=4 1976 B14R1.159 C=C(C)COCCc1ccccc1C 34a_100000210245_100011713688 [0,1,0,0,0,0|3,0,0]=4 1977 B14R1.159 C=C(C)COCCc1ccccc1C 34a_100011220023_100000748629 [0,1,0,0,0,0|3,0,0]=4 1978 B14R1.159 C=C(C)COCCc1ccccc1C 7a_100011220023_100000748629 [0,1,0,0,0,0|3,0,0]=4 1979 B14R1.159 C=C(C)COCCc1ccccc1Cl 34a_100000210245_100011713703 [0,1,0,0,0,0|3,0,0]=4 1980 B14R1.159 C=C(C)COCCc1ccccc1Cl 34a_100011215284_100000748629 [0,1,0,0,0,0|3,0,0]=4 1981 B14R1.159 C=C(C)COCCc1ccccc1Cl 7a_100011215284_100000748629 [0,1,0,0,0,0|3,0,0]=4 1982 B14R1.159 C=C(C)COCCc1ccccc1F 34a_100000210245_100000720011 [0,1,0,0,0,0|3,0,0]=4 1983 B14R1.159 C=C(C)COCCc1ccccc1F 34a_100000753711_100000748629 [0,1,0,0,0,0|3,0,0]=4 1984 B14R1.159 C=C(C)COCCc1ccccc1F 7a_100000753711_100000748629 [0,1,0,0,0,0|3,0,0]=4 1985 B14R1.159 C=C(C)COCCc1ccccc1I 34a_100010255290_100000748629 [0,1,0,0,0,0|3,0,0]=4 1986 B14R1.159 C=C(C)COCCc1ccccc1I 7a_100010255290_100000748629 [0,1,0,0,0,0|3,0,0]=4 1987 B14R1.159 C=C(C)COCCc1ccccc1N 34a_100011215289_100000748629 [0,1,0,0,0,0|3,0,0]=4 1988 B14R1.159 C=C(C)COCCc1ccccc1O 34a_100000210245_100000722297 [0,1,0,0,0,0|3,0,0]=4 1989 B14R1.159 C=C(C)CSCCc1ccccc1Br 62a_100000748629_100012161201 [0,1,0,0,0,0|3,0,0]=4 1990 B14R1.159 C=C(C)CSCCc1ccccc1Br 62a_100012161201_100000211660 [0,1,0,0,0,0|3,0,0]=4 1991 B14R1.159 C=C(C)CSCCc1ccccc1C 62a_100000748629_100011713688 [0,1,0,0,0,0|3,0,0]=4 1992 B14R1.159 C=C(C)CSCCc1ccccc1C 62a_100011713688_100000211660 [0,1,0,0,0,0|3,0,0]=4 1993 B14R1.159 C=C(C)CSCCc1ccccc1Cl 62a_100000748629_100011713703 [0,1,0,0,0,0|3,0,0]=4 1994 B14R1.159 C=C(C)CSCCc1ccccc1Cl 62a_100011713703_100000211660 [0,1,0,0,0,0|3,0,0]=4 1995 B14R1.159 C=C(C)CSCCc1ccccc1F 62a_100000748629_100011713696 [0,1,0,0,0,0|3,0,0]=4 1996 B14R1.159 C=C(C)CSCCc1ccccc1F 62a_100011713696_100000211660 [0,1,0,0,0,0|3,0,0]=4 1997 B14R1.159 C=C(C)CSCCc1ccccc1O 62a_100000722297_100000211660 [0,1,0,0,0,0|3,0,0]=4 1998 B14R1.159 C=C(C)CSCCc1ccccc1O 62a_100000748629_100000722297 [0,1,0,0,0,0|3,0,0]=4 1999 B14R1.159 C=C(F)CNCCc1ccccc1Br 2230a_100000747383_100009893438 [0,1,0,0,0,0|3,0,0]=4 2000 B14R1.159 C=C(F)CNCCc1ccccc1Br 34a_100000747383_100009893438 [0,1,0,0,0,0|3,0,0]=4 2001 B14R1.159 C=C(F)CNCCc1ccccc1C 2230a_100000685071_100009893438 [0,1,0,0,0,0|3,0,0]=4 2002 B14R1.159 C=C(F)CNCCc1ccccc1C 34a_100000685071_100009893438 [0,1,0,0,0,0|3,0,0]=4 2003 B14R1.159 C=C(F)CNCCc1ccccc1Cl 2230a_100011207228_100009893438 [0,1,0,0,0,0|3,0,0]=4 2004 B14R1.159 C=C(F)CNCCc1ccccc1Cl 34a_100011207228_100009893438 [0,1,0,0,0,0|3,0,0]=4 2005 B14R1.159 C=C(F)CNCCc1ccccc1F 2230a_100000185272_100009893438 [0,1,0,0,0,0|3,0,0]=4 2006 B14R1.159 C=C(F)CNCCc1ccccc1F 34a_100000185272_100009893438 [0,1,0,0,0,0|3,0,0]=4 2007 B14R1.159 C=C(F)CNCCc1ccccc1O 34a_100011207237_100009893438 [0,1,0,0,0,0|3,0,0]=4 2008 B14R1.159 C=C(F)COCCc1ccccc1Br 34a_100000731337_100009893438 [0,1,0,0,0,0|3,0,0]=4 2009 B14R1.159 C=C(F)COCCc1ccccc1Br 34a_200010262243_100012161201 [0,1,0,0,0,0|3,0,0]=4 2010 B14R1.159 C=C(F)COCCc1ccccc1Br 7a_100000731337_100000042424 [0,1,0,0,0,0|3,0,0]=4 2011 B14R1.159 C=C(F)COCCc1ccccc1C 34a_100011220023_100009893438 [0,1,0,0,0,0|3,0,0]=4 2012 B14R1.159 C=C(F)COCCc1ccccc1C 34a_200010262243_100011713688 [0,1,0,0,0,0|3,0,0]=4 2013 B14R1.159 C=C(F)COCCc1ccccc1C 7a_100011220023_100000042424 [0,1,0,0,0,0|3,0,0]=4 2014 B14R1.159 C=C(F)COCCc1ccccc1Cl 34a_100011215284_100009893438 [0,1,0,0,0,0|3,0,0]=4 2015 B14R1.159 C=C(F)COCCc1ccccc1Cl 34a_200010262243_100011713703 [0,1,0,0,0,0|3,0,0]=4 2016 B14R1.159 C=C(F)COCCc1ccccc1Cl 7a_100011215284_100000042424 [0,1,0,0,0,0|3,0,0]=4 2017 B14R1.159 C=C(F)COCCc1ccccc1F 34a_100000753711_100009893438 [0,1,0,0,0,0|3,0,0]=4 2018 B14R1.159 C=C(F)COCCc1ccccc1F 34a_200010262243_100000720011 [0,1,0,0,0,0|3,0,0]=4 2019 B14R1.159 C=C(F)COCCc1ccccc1F 7a_100000753711_100000042424 [0,1,0,0,0,0|3,0,0]=4 2020 B14R1.159 C=C(F)COCCc1ccccc1I 34a_100010255290_100009893438 [0,1,0,0,0,0|3,0,0]=4 2021 B14R1.159 C=C(F)COCCc1ccccc1I 7a_100010255290_100000042424 [0,1,0,0,0,0|3,0,0]=4 2022 B14R1.159 C=C(F)COCCc1ccccc1N 34a_100011215289_100009893438 [0,1,0,0,0,0|3,0,0]=4 2023 B14R1.159 C=C(F)COCCc1ccccc1O 34a_200010262243_100000722297 [0,1,0,0,0,0|3,0,0]=4 2024 B14R1.159 C=C(F)CSCCc1ccccc1Br 62a_100000042424_100012161201 [0,1,0,0,0,0|3,0,0]=4 2025 B14R1.159 C=C(F)CSCCc1ccccc1Br 62a_100012161201_100000042424 [0,1,0,0,0,0|3,0,0]=4 2026 B14R1.159 C=C(F)CSCCc1ccccc1C 62a_100000042424_100011713688 [0,1,0,0,0,0|3,0,0]=4 2027 B14R1.159 C=C(F)CSCCc1ccccc1C 62a_100011713688_100000042424 [0,1,0,0,0,0|3,0,0]=4 2028 B14R1.159 C=C(F)CSCCc1ccccc1Cl 62a_100000042424_100011713703 [0,1,0,0,0,0|3,0,0]=4 2029 B14R1.159 C=C(F)CSCCc1ccccc1Cl 62a_100011713703_100000042424 [0,1,0,0,0,0|3,0,0]=4 2030 B14R1.159 C=C(F)CSCCc1ccccc1F 62a_100000042424_100011713696 [0,1,0,0,0,0|3,0,0]=4 2031 B14R1.159 C=C(F)CSCCc1ccccc1F 62a_100011713696_100000042424 [0,1,0,0,0,0|3,0,0]=4 2032 B14R1.159 C=C(F)CSCCc1ccccc1O 62a_100000042424_100000722297 [0,1,0,0,0,0|3,0,0]=4 2033 B14R1.159 C=C(F)CSCCc1ccccc1O 62a_100000722297_100000042424 [0,1,0,0,0,0|3,0,0]=4 2034 B14R1.159 CC(=O)CCCNc1ccccc1Br 34a_100000210017_100000685027 [0,1,0,0,0,0|2,0,0]=3 2035 B14R1.159 CC(=O)CCCNc1ccccc1C 34a_100015192222_100000685027 [0,1,0,0,0,0|2,0,0]=3 2036 B14R1.159 CC(=O)CCCNc1ccccc1Cl 34a_100000185783_100000685027 [0,1,0,0,0,0|2,0,0]=3 2037 B14R1.159 CC(=O)CCCNc1ccccc1F 34a_100000210422_100000685027 [0,1,0,0,0,0|2,0,0]=3 2038 B14R1.159 CC(=O)CCCNc1ccccc1I 34a_100000210053_100000685027 [0,1,0,0,0,0|2,0,0]=3 2039 B14R1.159 CC(=O)CCCNc1ccccc1O 34a_100000185747_100000685027 [0,1,0,0,0,0|2,0,0]=3 2040 B14R1.159 CC(=O)CCCOc1cccc[n+]1[O-] 7a_100000211761_100011215641 [0,1,0,0,0,0|3,0,0]=4 2041 B14R1.159 CC(=O)CCCOc1ccccc1Br 1458a_100000070787_200011259276 [0,1,0,0,0,0|2,0,0]=3 2042 B14R1.159 CC(=O)CCCOc1ccccc1Br 34a_100000181306_100000685027 [0,1,0,0,0,0|2,0,0]=3 2043 B14R1.159 CC(=O)CCCOc1ccccc1Br 7a_100000181306_100011215641 [0,1,0,0,0,0|2,0,0]=3 2044 B14R1.159 CC(=O)CCCOc1ccccc1C 1458a_100000070787_100000742659 [0,1,0,0,0,0|2,0,0]=3 2045 B14R1.159 CC(=O)CCCOc1ccccc1C 1458a_100000735866_200000210301 [0,1,0,0,0,0|2,0,0]=3 2046 B14R1.159 CC(=O)CCCOc1ccccc1C 34a_100000210338_100000685027 [0,1,0,0,0,0|2,0,0]=3 2047 B14R1.159 CC(=O)CCCOc1ccccc1C 7a_100000210338_100011215641 [0,1,0,0,0,0|2,0,0]=3 2048 B14R1.159 CC(=O)CCCOc1ccccc1Cl 1458a_100000747900_200000210301 [0,1,0,0,0,0|2,0,0]=3 2049 B14R1.159 CC(=O)CCCOc1ccccc1Cl 34a_100000210172_100000685027 [0,1,0,0,0,0|2,0,0]=3 2050 B14R1.159 CC(=O)CCCOc1ccccc1Cl 7a_100000210172_100011215641 [0,1,0,0,0,0|2,0,0]=3 2051 B14R1.159 CC(=O)CCCOc1ccccc1F 1458a_100000070787_100011203253 [0,1,0,0,0,0|2,0,0]=3 2052 B14R1.159 CC(=O)CCCOc1ccccc1F 34a_100000210171_100000685027 [0,1,0,0,0,0|2,0,0]=3 2053 B14R1.159 CC(=O)CCCOc1ccccc1F 7a_100000210171_100011215641 [0,1,0,0,0,0|2,0,0]=3 2054 B14R1.159 CC(=O)CCCOc1ccccc1I 34a_100000739446_100000685027 [0,1,0,0,0,0|2,0,0]=3 2055 B14R1.159 CC(=O)CCCOc1ccccc1I 7a_100000739446_100011215641 [0,1,0,0,0,0|2,0,0]=3 2056 B14R1.159 CC(=O)CCCOc1ccccc1N 34a_100000185747_100000685027 [0,1,0,0,0,0|2,0,0]=3 2057 B14R1.159 CC(=O)CCCOc1ccccc1N 7a_100000185747_100011215641 [0,1,0,0,0,0|2,0,0]=3 2058 B14R1.159 CC(=O)CCCOc1cccnc1Br 34a_100000744436_100000685027 [0,1,0,0,0,0|3,0,0]=4 2059 B14R1.159 CC(=O)CCCOc1cccnc1Br 7a_100000744436_100011215641 [0,1,0,0,0,0|3,0,0]=4 2060 B14R1.159 CC(=O)CCCOc1cccnc1C 34a_100000745507_100000685027 [0,1,0,0,0,0|3,0,0]=4 2061 B14R1.159 CC(=O)CCCOc1cccnc1C 7a_100000745507_100011215641 [0,1,0,0,0,0|3,0,0]=4 2062 B14R1.159 CC(=O)CCCOc1cccnc1Cl 34a_100000757616_100000685027 [0,1,0,0,0,0|3,0,0]=4 2063 B14R1.159 CC(=O)CCCOc1cccnc1Cl 7a_100000757616_100011215641 [0,1,0,0,0,0|3,0,0]=4 2064 B14R1.159 CC(=O)CCCOc1cccnc1F 34a_100000061740_100000685027 [0,1,0,0,0,0|3,0,0]=4 2065 B14R1.159 CC(=O)CCCOc1cccnc1F 7a_100000061740_100011215641 [0,1,0,0,0,0|3,0,0]=4 2066 B14R1.159 CC(=O)CCCOc1cccnc1I 34a_100000034122_100000685027 [0,1,0,0,0,0|3,0,0]=4 2067 B14R1.159 CC(=O)CCCOc1cccnc1I 7a_100000034122_100011215641 [0,1,0,0,0,0|3,0,0]=4 2068 B14R1.159 CC(=O)CCCOc1cccnc1N 34a_100000211975_100000685027 [0,1,0,0,0,0|3,0,0]=4 2069 B14R1.159 CC(=O)CCCOc1cccnc1N 7a_100000211975_100011215641 [0,1,0,0,0,0|3,0,0]=4 2070 B14R1.159 CC(=O)CCCOc1cccoc1=O 34a_100000077404_100000685027 [0,1,0,0,0,0|3,0,0]=4 2071 B14R1.159 CC(=O)CCCOc1cccoc1=O 7a_100000077404_100011215641 [0,1,0,0,0,0|3,0,0]=4 2072 B14R1.159 CC(=O)CCCOc1ccncc1Br 34a_100011996408_100000685027 [0,1,0,0,0,0|3,0,0]=4 2073 B14R1.159 CC(=O)CCCOc1ccncc1C 34a_100000694293_100000685027 [0,1,0,0,0,0|3,0,0]=4 2074 B14R1.159 CC(=O)CCCOc1ccncc1Cl 34a_100011997054_100000685027 [0,1,0,0,0,0|3,0,0]=4 2075 B14R1.159 CC(=O)CCCOc1ccncc1F 34a_200000081243_100000685027 [0,1,0,0,0,0|3,0,0]=4 2076 B14R1.159 CC(=O)CCCOc1cnccc1C 34a_100011997053_100000685027 [0,1,0,0,0,0|3,0,0]=4 2077 B14R1.159 CC(=O)CCCOc1cnccc1C 7a_100011997053_100011215641 [0,1,0,0,0,0|3,0,0]=4 2078 B14R1.159 CC(=O)CCCOc1cnccc1Cl 34a_100011996695_100000685027 [0,1,0,0,0,0|3,0,0]=4 2079 B14R1.159 CC(=O)CCCOc1cnccc1I 34a_100000050107_100000685027 [0,1,0,0,0,0|3,0,0]=4 2080 B14R1.159 CC(=O)CCCOc1cnccc1N 34a_100000753702_100000685027 [0,1,0,0,0,0|3,0,0]=4 2081 B14R1.159 CC(=O)CCCOc1coccc1=O 34a_100000060831_100000685027 [0,1,0,0,0,0|3,0,0]=4 2082 B14R1.159 CC(=O)CCCOc1ncccc1Cl 34a_100011290957_100000685027 [0,1,0,0,0,0|3,0,0]=4 2083 B14R1.159 CC(=O)CCCOc1ncccc1F 34a_100011219419_100000685027 [0,1,0,0,0,0|3,0,0]=4 2084 B14R1.159 CC(=O)CCCOc1ncccc1N 34a_100000746358_100000685027 [0,1,0,0,0,0|3,0,0]=4 2085 B14R1.159 CC(=O)CCCSc1c[nH]ccc1=O 62a_100009998708_100011215641 [0,1,0,0,0,0|3,0,0]=4 2086 B14R1.159 CC(=O)CCCSc1c[nH]ccc1=O 62a_100011215641_100009998708 [0,1,0,0,0,0|3,0,0]=4 2087 B14R1.159 CC(=O)CCCSc1c[nH]ccc1=S 62a_100011215641_200012280681 [0,1,0,0,0,0|3,0,0]=4 2088 B14R1.159 CC(=O)CCCSc1c[nH]ccc1=S 62a_200012280681_100011215641 [0,1,0,0,0,0|3,0,0]=4 2089 B14R1.159 CC(=O)CCCSc1cccc[n+]1C 62a_100011215641_100000212160 [0,1,0,0,0,0|3,0,0]=4 2090 B14R1.159 CC(=O)CCCSc1cccc[n+]1[O-] 62a_100011215641_200000042595 [0,1,0,0,0,0|3,0,0]=4 2091 B14R1.159 CC(=O)CCCSc1ccccc1Br 62a_100000695589_100011215641 [0,1,0,0,0,0|2,0,0]=3 2092 B14R1.159 CC(=O)CCCSc1ccccc1Br 62a_100011215641_100000695589 [0,1,0,0,0,0|2,0,0]=3 2093 B14R1.159 CC(=O)CCCSc1ccccc1C 62a_100000210755_100011215641 [0,1,0,0,0,0|2,0,0]=3 2094 B14R1.159 CC(=O)CCCSc1ccccc1C 62a_100011215641_100000210755 [0,1,0,0,0,0|2,0,0]=3 2095 B14R1.159 CC(=O)CCCSc1ccccc1Cl 1458a_100000070787_100000750589 [0,1,0,0,0,0|2,0,0]=3 2096 B14R1.159 CC(=O)CCCSc1ccccc1Cl 62a_100000764095_100011215641 [0,1,0,0,0,0|2,0,0]=3 2097 B14R1.159 CC(=O)CCCSc1ccccc1Cl 62a_100011215641_100000764095 [0,1,0,0,0,0|2,0,0]=3 2098 B14R1.159 CC(=O)CCCSc1ccccc1F 62a_100011215641_100011215700 [0,1,0,0,0,0|2,0,0]=3 2099 B14R1.159 CC(=O)CCCSc1ccccc1F 62a_100011215700_100011215641 [0,1,0,0,0,0|2,0,0]=3 2100 B14R1.159 CC(=O)CCCSc1ccccc1N 62a_100000210017_100011215641 [0,1,0,0,0,0|2,0,0]=3 2101 B14R1.159 CC(=O)CCCSc1ccccc1N 62a_100011215641_100000210017 [0,1,0,0,0,0|2,0,0]=3 2102 B14R1.159 CC(=O)CCCSc1ccccc1O 62a_100000739446_100011215641 [0,1,0,0,0,0|2,0,0]=3 2103 B14R1.159 CC(=O)CCCSc1ccccc1O 62a_100011215641_100000739446 [0,1,0,0,0,0|2,0,0]=3 2104 B14R1.159 CC(=O)CCCSc1cccnc1Br 62a_100010202626_100011215641 [0,1,0,0,0,0|3,0,0]=4 2105 B14R1.159 CC(=O)CCCSc1cccnc1Br 62a_100011215641_100010202626 [0,1,0,0,0,0|3,0,0]=4 2106 B14R1.159 CC(=O)CCCSc1cccnc1C 62a_100000751574_100011215641 [0,1,0,0,0,0|3,0,0]=4 2107 B14R1.159 CC(=O)CCCSc1cccnc1C 62a_100011215641_100000751574 [0,1,0,0,0,0|3,0,0]=4 2108 B14R1.159 CC(=O)CCCSc1cccnc1Cl 62a_100000036424_100011215641 [0,1,0,0,0,0|3,0,0]=4 2109 B14R1.159 CC(=O)CCCSc1cccnc1Cl 62a_100011215641_100000036424 [0,1,0,0,0,0|3,0,0]=4 2110 B14R1.159 CC(=O)CCCSc1cccnc1F 62a_100009816115_100011215641 [0,1,0,0,0,0|3,0,0]=4 2111 B14R1.159 CC(=O)CCCSc1cccnc1F 62a_100011215641_100009816115 [0,1,0,0,0,0|3,0,0]=4 2112 B14R1.159 CC(=O)CCCSc1cccnc1N 62a_100000045569_100011215641 [0,1,0,0,0,0|3,0,0]=4 2113 B14R1.159 CC(=O)CCCSc1cccnc1N 62a_100011215641_100000045569 [0,1,0,0,0,0|3,0,0]=4 2114 B14R1.159 CC(=O)CCCSc1cccnc1O 62a_100000760158_100011215641 [0,1,0,0,0,0|3,0,0]=4 2115 B14R1.159 CC(=O)CCCSc1cccnc1O 62a_100011215641_100000760158 [0,1,0,0,0,0|3,0,0]=4 2116 B14R1.159 CC(=O)CCCSc1ccncc1Br 62a_100000726257_100011215641 [0,1,0,0,0,0|3,0,0]=4 2117 B14R1.159 CC(=O)CCCSc1ccncc1Br 62a_100011215641_100000726257 [0,1,0,0,0,0|3,0,0]=4 2118 B14R1.159 CC(=O)CCCSc1ccncc1C 62a_100000765111_100011215641 [0,1,0,0,0,0|3,0,0]=4 2119 B14R1.159 CC(=O)CCCSc1ccncc1C 62a_100011215641_100000765111 [0,1,0,0,0,0|3,0,0]=4 2120 B14R1.159 CC(=O)CCCSc1ccncc1Cl 62a_100000708259_100011215641 [0,1,0,0,0,0|3,0,0]=4 2121 B14R1.159 CC(=O)CCCSc1ccncc1Cl 62a_100011215641_100000708259 [0,1,0,0,0,0|3,0,0]=4 2122 B14R1.159 CC(=O)CCCSc1ccncc1F 62a_100000047030_100011215641 [0,1,0,0,0,0|3,0,0]=4 2123 B14R1.159 CC(=O)CCCSc1ccncc1F 62a_100011215641_100000047030 [0,1,0,0,0,0|3,0,0]=4 2124 B14R1.159 CC(=O)CCCSc1ccncc1N 62a_100000756074_100011215641 [0,1,0,0,0,0|3,0,0]=4 2125 B14R1.159 CC(=O)CCCSc1ccncc1N 62a_100011215641_100000756074 [0,1,0,0,0,0|3,0,0]=4 2126 B14R1.159 CC(=O)CCCSc1ccncc1O 62a_100009817591_100011215641 [0,1,0,0,0,0|3,0,0]=4 2127 B14R1.159 CC(=O)CCCSc1ccncc1O 62a_100011215641_100009817591 [0,1,0,0,0,0|3,0,0]=4 2128 B14R1.159 CC(=O)CCCSc1cnccc1Br 62a_100010138639_100011215641 [0,1,0,0,0,0|3,0,0]=4 2129 B14R1.159 CC(=O)CCCSc1cnccc1Br 62a_100011215641_100010138639 [0,1,0,0,0,0|3,0,0]=4 2130 B14R1.159 CC(=O)CCCSc1cnccc1C 62a_100000761580_100011215641 [0,1,0,0,0,0|3,0,0]=4 2131 B14R1.159 CC(=O)CCCSc1cnccc1C 62a_100011215641_100000761580 [0,1,0,0,0,0|3,0,0]=4 2132 B14R1.159 CC(=O)CCCSc1cnccc1Cl 62a_100009995489_100011215641 [0,1,0,0,0,0|3,0,0]=4 2133 B14R1.159 CC(=O)CCCSc1cnccc1Cl 62a_100011215641_100009995489 [0,1,0,0,0,0|3,0,0]=4 2134 B14R1.159 CC(=O)CCCSc1cnccc1F 62a_100009820683_100011215641 [0,1,0,0,0,0|3,0,0]=4 2135 B14R1.159 CC(=O)CCCSc1cnccc1F 62a_100011215641_100009820683 [0,1,0,0,0,0|3,0,0]=4 2136 B14R1.159 CC(=O)CCCSc1cnccc1N 62a_100000047001_100011215641 [0,1,0,0,0,0|3,0,0]=4 2137 B14R1.159 CC(=O)CCCSc1cnccc1N 62a_100011215641_100000047001 [0,1,0,0,0,0|3,0,0]=4 2138 B14R1.159 CC(=O)CCCSc1ncccc1Br 62a_100000696092_100011215641 [0,1,0,0,0,0|3,0,0]=4 2139 B14R1.159 CC(=O)CCCSc1ncccc1Br 62a_100011215641_100000696092 [0,1,0,0,0,0|3,0,0]=4 2140 B14R1.159 CC(=O)CCCSc1ncccc1C 62a_100000751373_100011215641 [0,1,0,0,0,0|3,0,0]=4 2141 B14R1.159 CC(=O)CCCSc1ncccc1C 62a_100011215641_100000751373 [0,1,0,0,0,0|3,0,0]=4 2142 B14R1.159 CC(=O)CCCSc1ncccc1Cl 62a_100011215641_100011356963 [0,1,0,0,0,0|3,0,0]=4 2143 B14R1.159 CC(=O)CCCSc1ncccc1Cl 62a_100011356963_100011215641 [0,1,0,0,0,0|3,0,0]=4 2144 B14R1.159 CC(=O)CCCSc1ncccc1F 62a_100000685392_100011215641 [0,1,0,0,0,0|3,0,0]=4 2145 B14R1.159 CC(=O)CCCSc1ncccc1F 62a_100011215641_100000685392 [0,1,0,0,0,0|3,0,0]=4 2146 B14R1.159 CC(=O)CCCSc1ncccc1N 62a_100000688686_100011215641 [0,1,0,0,0,0|3,0,0]=4 2147 B14R1.159 CC(=O)CCCSc1ncccc1N 62a_100011215641_100000688686 [0,1,0,0,0,0|3,0,0]=4 2148 B14R1.159 CC(=O)CCCSc1ncccc1O 62a_100000034122_100011215641 [0,1,0,0,0,0|3,0,0]=4 2149 B14R1.159 CC(=O)CCCSc1ncccc1O 62a_100011215641_100000034122 [0,1,0,0,0,0|3,0,0]=4 2150 B14R1.159 CC(=O)CCOCc1ccccc1Br 34a_100000759926_100000184730 [0,1,0,0,0,0|2,0,0]=3 2151 B14R1.159 CC(=O)CCOCc1ccccc1Br 7a_100000756307_100000053229 [0,1,0,0,0,0|2,0,0]=3 2152 B14R1.159 CC(=O)CCOCc1ccccc1Br 7a_100000759926_100000184730 [0,1,0,0,0,0|2,0,0]=3 2153 B14R1.159 CC(=O)CCOCc1ccccc1C 34a_100000759926_100000211839 [0,1,0,0,0,0|2,0,0]=3 2154 B14R1.159 CC(=O)CCOCc1ccccc1C 7a_100000698903_100000053229 [0,1,0,0,0,0|2,0,0]=3 2155 B14R1.159 CC(=O)CCOCc1ccccc1C 7a_100000759926_100000211839 [0,1,0,0,0,0|2,0,0]=3 2156 B14R1.159 CC(=O)CCOCc1ccccc1Cl 34a_100000759926_100000187162 [0,1,0,0,0,0|2,0,0]=3 2157 B14R1.159 CC(=O)CCOCc1ccccc1Cl 7a_100000210847_100000053229 [0,1,0,0,0,0|2,0,0]=3 2158 B14R1.159 CC(=O)CCOCc1ccccc1Cl 7a_100000759926_100000187162 [0,1,0,0,0,0|2,0,0]=3 2159 B14R1.159 CC(=O)CCOCc1ccccc1F 34a_100000759926_100000211605 [0,1,0,0,0,0|2,0,0]=3 2160 B14R1.159 CC(=O)CCOCc1ccccc1F 7a_100000211962_100000053229 [0,1,0,0,0,0|2,0,0]=3 2161 B14R1.159 CC(=O)CCOCc1ccccc1F 7a_100000759926_100000211605 [0,1,0,0,0,0|2,0,0]=3 2162 B14R1.159 CC(=O)CCOCc1ccccc1I 34a_100000759926_100011215278 [0,1,0,0,0,0|2,0,0]=3 2163 B14R1.159 CC(=O)CCOCc1ccccc1I 7a_100000187465_100000053229 [0,1,0,0,0,0|2,0,0]=3 2164 B14R1.159 CC(=O)CCOCc1ccccc1I 7a_100000759926_100011215278 [0,1,0,0,0,0|2,0,0]=3 2165 B14R1.159 CC(=O)CCOCc1cccnc1Br 34a_100000759926_100010140945 [0,1,0,0,0,0|3,0,0]=4 2166 B14R1.159 CC(=O)CCOCc1cccnc1Br 7a_100000719692_100000053229 [0,1,0,0,0,0|3,0,0]=4 2167 B14R1.159 CC(=O)CCOCc1cccnc1Br 7a_100000759926_100010140945 [0,1,0,0,0,0|3,0,0]=4 2168 B14R1.159 CC(=O)CCOCc1cccnc1C 34a_100000759926_100000732876 [0,1,0,0,0,0|3,0,0]=4 2169 B14R1.159 CC(=O)CCOCc1cccnc1C 7a_100000729262_100000053229 [0,1,0,0,0,0|3,0,0]=4 2170 B14R1.159 CC(=O)CCOCc1cccnc1C 7a_100000759926_100000732876 [0,1,0,0,0,0|3,0,0]=4 2171 B14R1.159 CC(=O)CCOCc1cccnc1Cl 34a_100000759926_100000045678 [0,1,0,0,0,0|3,0,0]=4 2172 B14R1.159 CC(=O)CCOCc1cccnc1Cl 7a_100000748726_100000053229 [0,1,0,0,0,0|3,0,0]=4 2173 B14R1.159 CC(=O)CCOCc1cccnc1Cl 7a_100000759926_100000045678 [0,1,0,0,0,0|3,0,0]=4 2174 B14R1.159 CC(=O)CCOCc1cccnc1F 34a_100000759926_100000099810 [0,1,0,0,0,0|3,0,0]=4 2175 B14R1.159 CC(=O)CCOCc1cccnc1F 7a_100000079888_100000053229 [0,1,0,0,0,0|3,0,0]=4 2176 B14R1.159 CC(=O)CCOCc1cccnc1F 7a_100000759926_100000099810 [0,1,0,0,0,0|3,0,0]=4 2177 B14R1.159 CC(=O)CCOCc1ccncc1C 34a_100000759926_100020672809 [0,1,0,0,0,0|3,0,0]=4 2178 B14R1.159 CC(=O)CCOCc1ccncc1C 7a_100000759926_100020672808 [0,1,0,0,0,0|3,0,0]=4 2179 B14R1.159 CC(=O)CCOCc1ccncc1Cl 7a_100000759926_100000763264 [0,1,0,0,0,0|3,0,0]=4 2180 B14R1.159 CC(=O)CCOCc1cnccc1C 34a_100000759926_100000690890 [0,1,0,0,0,0|3,0,0]=4 2181 B14R1.159 CC(=O)CCOCc1cnccc1C 7a_100000759926_100000690890 [0,1,0,0,0,0|3,0,0]=4 2182 B14R1.159 CC(=O)CCOCc1ncccc1Br 34a_100000759926_100025702911 [0,1,0,0,0,0|3,0,0]=4 2183 B14R1.159 CC(=O)CCOCc1ncccc1Br 7a_100000759926_100025702911 [0,1,0,0,0,0|3,0,0]=4 2184 B14R1.159 CC(=O)CCOCc1ncccc1C 34a_100000759926_100000696600 [0,1,0,0,0,0|3,0,0]=4 2185 B14R1.159 CC(=O)CCOCc1ncccc1C 7a_100000759926_100000696600 [0,1,0,0,0,0|3,0,0]=4 2186 B14R1.159 CC(=O)CCOCc1ncccc1Cl 7a_100000759926_100000099807 [0,1,0,0,0,0|3,0,0]=4 2187 B14R1.159 CC(=O)CCOCc1ncccc1F 34a_100000759926_100000104219 [0,1,0,0,0,0|3,0,0]=4 2188 B14R1.159 CC(=O)CCOCc1ncccc1F 7a_100000759926_100000104219 [0,1,0,0,0,0|3,0,0]=4 2189 B14R1.159 CC(=O)CCOCc1ncccc1O 34a_100000759926_200020655725 [0,1,0,0,0,0|3,0,0]=4 2190 B14R1.159 CC(=O)CCOCc1ncccc1O 7a_100000759926_200020655725 [0,1,0,0,0,0|3,0,0]=4 2191 B14R1.159 CC(=O)CCSCc1ccccc1Br 62a_100000053229_100000184730 [0,1,0,0,0,0|2,0,0]=3 2192 B14R1.159 CC(=O)CCSCc1ccccc1Br 62a_100000184730_100000053229 [0,1,0,0,0,0|2,0,0]=3 2193 B14R1.159 CC(=O)CCSCc1ccccc1C 62a_100000053229_100000211839 [0,1,0,0,0,0|2,0,0]=3 2194 B14R1.159 CC(=O)CCSCc1ccccc1C 62a_100000211839_100000053229 [0,1,0,0,0,0|2,0,0]=3 2195 B14R1.159 CC(=O)CCSCc1ccccc1Cl 62a_100000053229_100000187162 [0,1,0,0,0,0|2,0,0]=3 2196 B14R1.159 CC(=O)CCSCc1ccccc1Cl 62a_100000187162_100000053229 [0,1,0,0,0,0|2,0,0]=3 2197 B14R1.159 CC(=O)CCSCc1ccccc1F 62a_100000053229_100000211605 [0,1,0,0,0,0|2,0,0]=3 2198 B14R1.159 CC(=O)CCSCc1ccccc1F 62a_100000211605_100000053229 [0,1,0,0,0,0|2,0,0]=3 2199 B14R1.159 CC(=O)CCSCc1ccccc1I 62a_100000053229_100011216222 [0,1,0,0,0,0|2,0,0]=3 2200 B14R1.159 CC(=O)CCSCc1ccccc1I 62a_100011216222_100000053229 [0,1,0,0,0,0|2,0,0]=3 2201 B14R1.159 CC(=O)CCSCc1cccnc1Br 62a_100000053229_100010140945 [0,1,0,0,0,0|3,0,0]=4 2202 B14R1.159 CC(=O)CCSCc1cccnc1Br 62a_100010140945_100000053229 [0,1,0,0,0,0|3,0,0]=4 2203 B14R1.159 CC(=O)CCSCc1cccnc1C 62a_100000053229_100000732876 [0,1,0,0,0,0|3,0,0]=4 2204 B14R1.159 CC(=O)CCSCc1cccnc1C 62a_100000732876_100000053229 [0,1,0,0,0,0|3,0,0]=4 2205 B14R1.159 CC(=O)CCSCc1cccnc1Cl 62a_100000045678_100000053229 [0,1,0,0,0,0|3,0,0]=4 2206 B14R1.159 CC(=O)CCSCc1cccnc1Cl 62a_100000053229_100000045678 [0,1,0,0,0,0|3,0,0]=4 2207 B14R1.159 CC(=O)CCSCc1cccnc1F 62a_100000053229_100000099810 [0,1,0,0,0,0|3,0,0]=4 2208 B14R1.159 CC(=O)CCSCc1cccnc1F 62a_100000099810_100000053229 [0,1,0,0,0,0|3,0,0]=4 2209 B14R1.159 CC(=O)CCSCc1ccncc1C 62a_100000053229_100020672808 [0,1,0,0,0,0|3,0,0]=4 2210 B14R1.159 CC(=O)CCSCc1ccncc1C 62a_100020672808_100000053229 [0,1,0,0,0,0|3,0,0]=4 2211 B14R1.159 CC(=O)CCSCc1ccncc1Cl 62a_100000053229_100000763264 [0,1,0,0,0,0|3,0,0]=4 2212 B14R1.159 CC(=O)CCSCc1ccncc1Cl 62a_100000763264_100000053229 [0,1,0,0,0,0|3,0,0]=4 2213 B14R1.159 CC(=O)CCSCc1cnccc1C 62a_100000053229_100000690890 [0,1,0,0,0,0|3,0,0]=4 2214 B14R1.159 CC(=O)CCSCc1cnccc1C 62a_100000690890_100000053229 [0,1,0,0,0,0|3,0,0]=4 2215 B14R1.159 CC(=O)CCSCc1ncccc1Br 62a_100000053229_100025702911 [0,1,0,0,0,0|3,0,0]=4 2216 B14R1.159 CC(=O)CCSCc1ncccc1Br 62a_100025702911_100000053229 [0,1,0,0,0,0|3,0,0]=4 2217 B14R1.159 CC(=O)CCSCc1ncccc1C 62a_100000053229_100000696600 [0,1,0,0,0,0|3,0,0]=4 2218 B14R1.159 CC(=O)CCSCc1ncccc1C 62a_100000696600_100000053229 [0,1,0,0,0,0|3,0,0]=4 2219 B14R1.159 CC(=O)CCSCc1ncccc1Cl 62a_100000053229_100000099807 [0,1,0,0,0,0|3,0,0]=4 2220 B14R1.159 CC(=O)CCSCc1ncccc1Cl 62a_100000099807_100000053229 [0,1,0,0,0,0|3,0,0]=4 2221 B14R1.159 CC(=O)CCSCc1ncccc1F 62a_100000053229_100000104219 [0,1,0,0,0,0|3,0,0]=4 2222 B14R1.159 CC(=O)CCSCc1ncccc1F 62a_100000104219_100000053229 [0,1,0,0,0,0|3,0,0]=4 2223 B14R1.159 CC(=O)CCSCc1ncccc1O 62a_100000053229_200020655725 [0,1,0,0,0,0|3,0,0]=4 2224 B14R1.159 CC(=O)CCSCc1ncccc1O 62a_200020655725_100000053229 [0,1,0,0,0,0|3,0,0]=4 2225 B14R1.159 CC(=O)COCCc1ccccc1Br 34a_100000211253_100012161201 [0,1,0,0,0,0|2,0,0]=3 2226 B14R1.159 CC(=O)COCCc1ccccc1C 34a_100000211253_100011713688 [0,1,0,0,0,0|2,0,0]=3 2227 B14R1.159 CC(=O)COCCc1ccccc1Cl 34a_100000211253_100011713703 [0,1,0,0,0,0|2,0,0]=3 2228 B14R1.159 CC(=O)COCCc1ccccc1F 34a_100000211253_100000720011 [0,1,0,0,0,0|2,0,0]=3 2229 B14R1.159 CC(=O)COCCc1ccccc1O 34a_100000211253_100000722297 [0,1,0,0,0,0|2,0,0]=3 2230 B14R1.159 CC(=O)NCCCc1ccccc1F 11a_100000724733_100015343762 [0,1,0,0,0,0|2,0,0]=3 2231 B14R1.159 CC(=O)NCCCc1ccccc1F 1626a_100000724733_100015343762 [0,1,0,0,0,0|2,0,0]=3 2232 B14R1.159 CC(=O)NCCCc1ccccc1F 240690a_100000724733_100015343762 [0,1,0,0,0,0|2,0,0]=3 2233 B14R1.159 CC(=O)NCCCc1ccccc1F 527a_100000724733_100103153847 [0,1,0,0,0,0|2,0,0]=3 2234 B14R1.159 CC(=O)NCCOc1ccccc1Br 11a_100000744007_100015343762 [0,1,0,0,0,0|3,0,0]=4 2235 B14R1.159 CC(=O)NCCOc1ccccc1Br 1626a_100000744007_100015343762 [0,1,0,0,0,0|3,0,0]=4 2236 B14R1.159 CC(=O)NCCOc1ccccc1Br 240690a_100000744007_100015343762 [0,1,0,0,0,0|3,0,0]=4 2237 B14R1.159 CC(=O)NCCOc1ccccc1Br 527a_100000744007_100103153847 [0,1,0,0,0,0|3,0,0]=4 2238 B14R1.159 CC(=O)NCCOc1ccccc1Br 7a_100000181306_100000189650 [0,1,0,0,0,0|3,0,0]=4 2239 B14R1.159 CC(=O)NCCOc1ccccc1C 11a_100000743344_100015343762 [0,1,0,0,0,0|3,0,0]=4 2240 B14R1.159 CC(=O)NCCOc1ccccc1C 1626a_100000743344_100015343762 [0,1,0,0,0,0|3,0,0]=4 2241 B14R1.159 CC(=O)NCCOc1ccccc1C 240690a_100000743344_100015343762 [0,1,0,0,0,0|3,0,0]=4 2242 B14R1.159 CC(=O)NCCOc1ccccc1C 527a_100000743344_100103153847 [0,1,0,0,0,0|3,0,0]=4 2243 B14R1.159 CC(=O)NCCOc1ccccc1C 7a_100000210338_100000189650 [0,1,0,0,0,0|3,0,0]=4 2244 B14R1.159 CC(=O)NCCOc1ccccc1Cl 11a_100000174932_100015343762 [0,1,0,0,0,0|3,0,0]=4 2245 B14R1.159 CC(=O)NCCOc1ccccc1Cl 1626a_100000174932_100015343762 [0,1,0,0,0,0|3,0,0]=4 2246 B14R1.159 CC(=O)NCCOc1ccccc1Cl 240690a_100000174932_100015343762 [0,1,0,0,0,0|3,0,0]=4 2247 B14R1.159 CC(=O)NCCOc1ccccc1Cl 527a_100000174932_100103153847 [0,1,0,0,0,0|3,0,0]=4 2248 B14R1.159 CC(=O)NCCOc1ccccc1Cl 7a_100000210172_100000189650 [0,1,0,0,0,0|3,0,0]=4 2249 B14R1.159 CC(=O)NCCOc1ccccc1F 11a_100000683764_100015343762 [0,1,0,0,0,0|3,0,0]=4 2250 B14R1.159 CC(=O)NCCOc1ccccc1F 1626a_100000683764_100015343762 [0,1,0,0,0,0|3,0,0]=4 2251 B14R1.159 CC(=O)NCCOc1ccccc1F 240690a_100000683764_100015343762 [0,1,0,0,0,0|3,0,0]=4 2252 B14R1.159 CC(=O)NCCOc1ccccc1F 527a_100000683764_100103153847 [0,1,0,0,0,0|3,0,0]=4 2253 B14R1.159 CC(=O)NCCOc1ccccc1F 7a_100000210171_100000189650 [0,1,0,0,0,0|3,0,0]=4 2254 B14R1.159 CC(=O)NCCOc1ccccc1I 7a_100000739446_100000189650 [0,1,0,0,0,0|3,0,0]=4 2255 B14R1.159 CC(=O)NCCOc1ccccc1N 7a_100000185747_100000189650 [0,1,0,0,0,0|3,0,0]=4 2256 B14R1.159 CC(=O)NCCSc1ccccc1Br 62a_100000189650_100000695589 [0,1,0,0,0,0|3,0,0]=4 2257 B14R1.159 CC(=O)NCCSc1ccccc1Br 62a_100000695589_100000189650 [0,1,0,0,0,0|3,0,0]=4 2258 B14R1.159 CC(=O)NCCSc1ccccc1C 62a_100000189650_100000210755 [0,1,0,0,0,0|3,0,0]=4 2259 B14R1.159 CC(=O)NCCSc1ccccc1C 62a_100000210755_100000189650 [0,1,0,0,0,0|3,0,0]=4 2260 B14R1.159 CC(=O)NCCSc1ccccc1Cl 62a_100000189650_100000764095 [0,1,0,0,0,0|3,0,0]=4 2261 B14R1.159 CC(=O)NCCSc1ccccc1Cl 62a_100000764095_100000189650 [0,1,0,0,0,0|3,0,0]=4 2262 B14R1.159 CC(=O)NCCSc1ccccc1F 62a_100000189650_100011215700 [0,1,0,0,0,0|3,0,0]=4 2263 B14R1.159 CC(=O)NCCSc1ccccc1F 62a_100011215700_100000189650 [0,1,0,0,0,0|3,0,0]=4 2264 B14R1.159 CC(=O)NCCSc1ccccc1N 62a_100000189650_100000210017 [0,1,0,0,0,0|3,0,0]=4 2265 B14R1.159 CC(=O)NCCSc1ccccc1N 62a_100000210017_100000189650 [0,1,0,0,0,0|3,0,0]=4 2266 B14R1.159 CC(=O)NCCSc1ccccc1O 62a_100000189650_100000739446 [0,1,0,0,0,0|3,0,0]=4 2267 B14R1.159 CC(=O)NCCSc1ccccc1O 62a_100000739446_100000189650 [0,1,0,0,0,0|3,0,0]=4 2268 B14R1.159 CC(=O)OCCNc1ccccc1Br 34a_100000210017_100009814007 [0,1,0,0,0,0|3,0,0]=4 2269 B14R1.159 CC(=O)OCCNc1ccccc1C 34a_100015192222_100009814007 [0,1,0,0,0,0|3,0,0]=4 2270 B14R1.159 CC(=O)OCCNc1ccccc1Cl 34a_100000185783_100009814007 [0,1,0,0,0,0|3,0,0]=4 2271 B14R1.159 CC(=O)OCCNc1ccccc1F 34a_100000210422_100009814007 [0,1,0,0,0,0|3,0,0]=4 2272 B14R1.159 CC(=O)OCCNc1ccccc1I 34a_100000210053_100009814007 [0,1,0,0,0,0|3,0,0]=4 2273 B14R1.159 CC(=O)OCCNc1ccccc1O 34a_100000185747_100009814007 [0,1,0,0,0,0|3,0,0]=4 2274 B14R1.159 CC(=O)OCCOc1ccccc1Br 34a_100000181306_100009814007 [0,1,0,0,0,0|3,0,0]=4 2275 B14R1.159 CC(=O)OCCOc1ccccc1Br 7a_100000181306_100009814007 [0,1,0,0,0,0|3,0,0]=4 2276 B14R1.159 CC(=O)OCCOc1ccccc1C 34a_100000210338_100009814007 [0,1,0,0,0,0|3,0,0]=4 2277 B14R1.159 CC(=O)OCCOc1ccccc1C 7a_100000210338_100009814007 [0,1,0,0,0,0|3,0,0]=4 2278 B14R1.159 CC(=O)OCCOc1ccccc1Cl 34a_100000210172_100009814007 [0,1,0,0,0,0|3,0,0]=4 2279 B14R1.159 CC(=O)OCCOc1ccccc1Cl 7a_100000210172_100009814007 [0,1,0,0,0,0|3,0,0]=4 2280 B14R1.159 CC(=O)OCCOc1ccccc1F 34a_100000210171_100009814007 [0,1,0,0,0,0|3,0,0]=4 2281 B14R1.159 CC(=O)OCCOc1ccccc1F 7a_100000210171_100009814007 [0,1,0,0,0,0|3,0,0]=4 2282 B14R1.159 CC(=O)OCCOc1ccccc1I 34a_100000739446_100009814007 [0,1,0,0,0,0|3,0,0]=4 2283 B14R1.159 CC(=O)OCCOc1ccccc1I 7a_100000739446_100009814007 [0,1,0,0,0,0|3,0,0]=4 2284 B14R1.159 CC(=O)OCCOc1ccccc1N 34a_100000185747_100009814007 [0,1,0,0,0,0|3,0,0]=4 2285 B14R1.159 CC(=O)OCCOc1ccccc1N 7a_100000185747_100009814007 [0,1,0,0,0,0|3,0,0]=4 2286 B14R1.159 CC(=O)OCCSc1ccccc1Br 62a_100000695589_100009814007 [0,1,0,0,0,0|3,0,0]=4 2287 B14R1.159 CC(=O)OCCSc1ccccc1Br 62a_100009814007_100000695589 [0,1,0,0,0,0|3,0,0]=4 2288 B14R1.159 CC(=O)OCCSc1ccccc1C 62a_100000210755_100009814007 [0,1,0,0,0,0|3,0,0]=4 2289 B14R1.159 CC(=O)OCCSc1ccccc1C 62a_100009814007_100000210755 [0,1,0,0,0,0|3,0,0]=4 2290 B14R1.159 CC(=O)OCCSc1ccccc1Cl 62a_100000764095_100009814007 [0,1,0,0,0,0|3,0,0]=4 2291 B14R1.159 CC(=O)OCCSc1ccccc1Cl 62a_100009814007_100000764095 [0,1,0,0,0,0|3,0,0]=4 2292 B14R1.159 CC(=O)OCCSc1ccccc1F 62a_100009814007_100011215700 [0,1,0,0,0,0|3,0,0]=4 2293 B14R1.159 CC(=O)OCCSc1ccccc1F 62a_100011215700_100009814007 [0,1,0,0,0,0|3,0,0]=4 2294 B14R1.159 CC(=O)OCCSc1ccccc1N 62a_100000210017_100009814007 [0,1,0,0,0,0|3,0,0]=4 2295 B14R1.159 CC(=O)OCCSc1ccccc1N 62a_100009814007_100000210017 [0,1,0,0,0,0|3,0,0]=4 2296 B14R1.159 CC(=O)OCCSc1ccccc1O 62a_100000739446_100009814007 [0,1,0,0,0,0|3,0,0]=4 2297 B14R1.159 CC(=O)OCCSc1ccccc1O 62a_100009814007_100000739446 [0,1,0,0,0,0|3,0,0]=4 2298 B14R1.159 CC(=O)OCNCc1ccccc1Br 34a_100000689332_100009813279 [0,1,0,0,0,0|3,0,0]=4 2299 B14R1.159 CC(=O)OCNCc1ccccc1C 34a_100000174972_100009813279 [0,1,0,0,0,0|3,0,0]=4 2300 B14R1.159 CC(=O)OCNCc1ccccc1Cl 34a_100000174879_100009813279 [0,1,0,0,0,0|3,0,0]=4 2301 B14R1.159 CC(=O)OCNCc1ccccc1F 34a_100000174869_100009813279 [0,1,0,0,0,0|3,0,0]=4 2302 B14R1.159 CC(=O)OCNCc1ccccc1O 34a_100000185550_100009813279 [0,1,0,0,0,0|3,0,0]=4 2303 B14R1.159 CC(=O)OCOCc1ccccc1Br 34a_100000756307_100009813279 [0,1,0,0,0,0|3,0,0]=4 2304 B14R1.159 CC(=O)OCOCc1ccccc1C 34a_100000698903_100009813279 [0,1,0,0,0,0|3,0,0]=4 2305 B14R1.159 CC(=O)OCOCc1ccccc1Cl 34a_100000210847_100009813279 [0,1,0,0,0,0|3,0,0]=4 2306 B14R1.159 CC(=O)OCOCc1ccccc1F 34a_100000211962_100009813279 [0,1,0,0,0,0|3,0,0]=4 2307 B14R1.159 CC(=O)OCOCc1ccccc1I 34a_100000187465_100009813279 [0,1,0,0,0,0|3,0,0]=4 2308 B14R1.159 CC(=O)OCOCc1ccccc1N 34a_100000212039_100009813279 [0,1,0,0,0,0|3,0,0]=4 2309 B14R1.159 CC(=O)OCSCc1ccccc1Br 62a_100000076356_100000184730 [0,1,0,0,0,0|3,0,0]=4 2310 B14R1.159 CC(=O)OCSCc1ccccc1Br 62a_100000184730_100000076356 [0,1,0,0,0,0|3,0,0]=4 2311 B14R1.159 CC(=O)OCSCc1ccccc1C 62a_100000076356_100000211839 [0,1,0,0,0,0|3,0,0]=4 2312 B14R1.159 CC(=O)OCSCc1ccccc1C 62a_100000211839_100000076356 [0,1,0,0,0,0|3,0,0]=4 2313 B14R1.159 CC(=O)OCSCc1ccccc1Cl 62a_100000076356_100000187162 [0,1,0,0,0,0|3,0,0]=4 2314 B14R1.159 CC(=O)OCSCc1ccccc1Cl 62a_100000187162_100000076356 [0,1,0,0,0,0|3,0,0]=4 2315 B14R1.159 CC(=O)OCSCc1ccccc1F 62a_100000076356_100000211605 [0,1,0,0,0,0|3,0,0]=4 2316 B14R1.159 CC(=O)OCSCc1ccccc1F 62a_100000211605_100000076356 [0,1,0,0,0,0|3,0,0]=4 2317 B14R1.159 CC(=O)OCSCc1ccccc1I 62a_100000076356_100011216222 [0,1,0,0,0,0|3,0,0]=4 2318 B14R1.159 CC(=O)OCSCc1ccccc1I 62a_100011216222_100000076356 [0,1,0,0,0,0|3,0,0]=4 2319 B14R1.159 CC(O)CCCNc1ccccc1Br 34a_100000210017_200000718107 [0,1,0,0,0,0|2,0,1]=4 2320 B14R1.159 CC(O)CCCNc1ccccc1Cl 34a_100000185783_200000718107 [0,1,0,0,0,0|2,0,1]=4 2321 B14R1.159 CC(O)CCCNc1ccccc1F 34a_100000210422_200000718107 [0,1,0,0,0,0|2,0,1]=4 2322 B14R1.159 CC(O)CCCNc1ccccc1I 34a_100000210053_200000718107 [0,1,0,0,0,0|2,0,1]=4 2323 B14R1.159 CC(O)CCCNc1ccccc1O 34a_100000185747_200000718107 [0,1,0,0,0,0|2,0,1]=4 2324 B14R1.159 CC(O)CCCOc1ccccc1Br 34a_100000181306_200000718107 [0,1,0,0,0,0|2,0,1]=4 2325 B14R1.159 CC(O)CCCOc1ccccc1Br 7a_100000181306_200000718107 [0,1,0,0,0,0|2,0,1]=4 2326 B14R1.159 CC(O)CCCOc1ccccc1Cl 34a_100000210172_200000718107 [0,1,0,0,0,0|2,0,1]=4 2327 B14R1.159 CC(O)CCCOc1ccccc1Cl 7a_100000210172_200000718107 [0,1,0,0,0,0|2,0,1]=4 2328 B14R1.159 CC(O)CCCOc1ccccc1F 34a_100000210171_200000718107 [0,1,0,0,0,0|2,0,1]=4 2329 B14R1.159 CC(O)CCCOc1ccccc1F 7a_100000210171_200000718107 [0,1,0,0,0,0|2,0,1]=4 2330 B14R1.159 CC(O)CCCOc1ccccc1I 34a_100000739446_200000718107 [0,1,0,0,0,0|2,0,1]=4 2331 B14R1.159 CC(O)CCCOc1ccccc1I 7a_100000739446_200000718107 [0,1,0,0,0,0|2,0,1]=4 2332 B14R1.159 CC(O)CCCOc1ccccc1N 34a_100000185747_200000718107 [0,1,0,0,0,0|2,0,1]=4 2333 B14R1.159 CC(O)CCCOc1ccccc1N 7a_100000185747_200000718107 [0,1,0,0,0,0|2,0,1]=4 2334 B14R1.159 CC(O)CCCSc1ccccc1Br 62a_100000695589_200000718107 [0,1,0,0,0,0|2,0,1]=4 2335 B14R1.159 CC(O)CCCSc1ccccc1Br 62a_200000718107_100000695589 [0,1,0,0,0,0|2,0,1]=4 2336 B14R1.159 CC(O)CCCSc1ccccc1Cl 62a_100000764095_200000718107 [0,1,0,0,0,0|2,0,1]=4 2337 B14R1.159 CC(O)CCCSc1ccccc1Cl 62a_200000718107_100000764095 [0,1,0,0,0,0|2,0,1]=4 2338 B14R1.159 CC(O)CCCSc1ccccc1F 62a_100011215700_200000718107 [0,1,0,0,0,0|2,0,1]=4 2339 B14R1.159 CC(O)CCCSc1ccccc1F 62a_200000718107_100011215700 [0,1,0,0,0,0|2,0,1]=4 2340 B14R1.159 CC(O)CCCSc1ccccc1N 62a_100000210017_200000718107 [0,1,0,0,0,0|2,0,1]=4 2341 B14R1.159 CC(O)CCCSc1ccccc1N 62a_200000718107_100000210017 [0,1,0,0,0,0|2,0,1]=4 2342 B14R1.159 CC(O)CCCSc1ccccc1O 62a_100000739446_200000718107 [0,1,0,0,0,0|2,0,1]=4 2343 B14R1.159 CC(O)CCCSc1ccccc1O 62a_200000718107_100000739446 [0,1,0,0,0,0|2,0,1]=4 2344 B14R1.159 CC(O)CCNCc1ccccc1Br 207a_200000755665_100000211189 [0,1,0,0,0,0|2,0,1]=4 2345 B14R1.159 CC(O)CCNCc1ccccc1Br 2230a_100000689332_100012276601 [0,1,0,0,0,0|2,0,1]=4 2346 B14R1.159 CC(O)CCNCc1ccccc1Br 2230a_200000755665_100000184730 [0,1,0,0,0,0|2,0,1]=4 2347 B14R1.159 CC(O)CCNCc1ccccc1Br 270004a_200000755665_100000211189 [0,1,0,0,0,0|2,0,1]=4 2348 B14R1.159 CC(O)CCNCc1ccccc1Br 34a_100000689332_100012276601 [0,1,0,0,0,0|2,0,1]=4 2349 B14R1.159 CC(O)CCNCc1ccccc1Cl 207a_200000755665_100000210073 [0,1,0,0,0,0|2,0,1]=4 2350 B14R1.159 CC(O)CCNCc1ccccc1Cl 2230a_100000174879_100012276601 [0,1,0,0,0,0|2,0,1]=4 2351 B14R1.159 CC(O)CCNCc1ccccc1Cl 2230a_200000755665_100000187162 [0,1,0,0,0,0|2,0,1]=4 2352 B14R1.159 CC(O)CCNCc1ccccc1Cl 270004a_200000755665_100000210073 [0,1,0,0,0,0|2,0,1]=4 2353 B14R1.159 CC(O)CCNCc1ccccc1Cl 34a_100000174879_100012276601 [0,1,0,0,0,0|2,0,1]=4 2354 B14R1.159 CC(O)CCNCc1ccccc1F 207a_200000755665_100000210811 [0,1,0,0,0,0|2,0,1]=4 2355 B14R1.159 CC(O)CCNCc1ccccc1F 2230a_200000755665_100000211605 [0,1,0,0,0,0|2,0,1]=4 2356 B14R1.159 CC(O)CCNCc1ccccc1F 270004a_200000755665_100000210811 [0,1,0,0,0,0|2,0,1]=4 2357 B14R1.159 CC(O)CCNCc1ccccc1F 34a_100000174869_100012276601 [0,1,0,0,0,0|2,0,1]=4 2358 B14R1.159 CC(O)CCNCc1ccccc1I 207a_200000755665_100000010305 [0,1,0,0,0,0|2,0,1]=4 2359 B14R1.159 CC(O)CCNCc1ccccc1I 2230a_200000755665_100011215278 [0,1,0,0,0,0|2,0,1]=4 2360 B14R1.159 CC(O)CCNCc1ccccc1I 270004a_200000755665_100000010305 [0,1,0,0,0,0|2,0,1]=4 2361 B14R1.159 CC(O)CCNCc1ccccc1O 34a_100000185550_100012276601 [0,1,0,0,0,0|2,0,1]=4 2362 B14R1.159 CC(O)CCOCc1ccccc1Br 34a_100000756307_100012276601 [0,1,0,0,0,0|2,0,1]=4 2363 B14R1.159 CC(O)CCOCc1ccccc1Br 7a_100000756307_100012276601 [0,1,0,0,0,0|2,0,1]=4 2364 B14R1.159 CC(O)CCOCc1ccccc1Cl 34a_100000210847_100012276601 [0,1,0,0,0,0|2,0,1]=4 2365 B14R1.159 CC(O)CCOCc1ccccc1Cl 7a_100000210847_100012276601 [0,1,0,0,0,0|2,0,1]=4 2366 B14R1.159 CC(O)CCOCc1ccccc1F 34a_100000211962_100012276601 [0,1,0,0,0,0|2,0,1]=4 2367 B14R1.159 CC(O)CCOCc1ccccc1F 7a_100000211962_100012276601 [0,1,0,0,0,0|2,0,1]=4 2368 B14R1.159 CC(O)CCOCc1ccccc1I 34a_100000187465_100012276601 [0,1,0,0,0,0|2,0,1]=4 2369 B14R1.159 CC(O)CCOCc1ccccc1I 7a_100000187465_100012276601 [0,1,0,0,0,0|2,0,1]=4 2370 B14R1.159 CC(O)CCOCc1ccccc1N 34a_100000212039_100012276601 [0,1,0,0,0,0|2,0,1]=4 2371 B14R1.159 CC(O)CCSCc1ccccc1Br 62a_100000184730_100012276601 [0,1,0,0,0,0|2,0,1]=4 2372 B14R1.159 CC(O)CCSCc1ccccc1Br 62a_100012276601_100000184730 [0,1,0,0,0,0|2,0,1]=4 2373 B14R1.159 CC(O)CCSCc1ccccc1Cl 62a_100000187162_100012276601 [0,1,0,0,0,0|2,0,1]=4 2374 B14R1.159 CC(O)CCSCc1ccccc1Cl 62a_100012276601_100000187162 [0,1,0,0,0,0|2,0,1]=4 2375 B14R1.159 CC(O)CCSCc1ccccc1F 62a_100000211605_100012276601 [0,1,0,0,0,0|2,0,1]=4 2376 B14R1.159 CC(O)CCSCc1ccccc1F 62a_100012276601_100000211605 [0,1,0,0,0,0|2,0,1]=4 2377 B14R1.159 CC(O)CCSCc1ccccc1I 62a_100011216222_100012276601 [0,1,0,0,0,0|2,0,1]=4 2378 B14R1.159 CC(O)CCSCc1ccccc1I 62a_100012276601_100011216222 [0,1,0,0,0,0|2,0,1]=4 2379 B14R1.159 CC(O)CNCCc1ccccc1Br 2230a_100000210904_100012161201 [0,1,0,0,0,0|2,0,1]=4 2380 B14R1.159 CC(O)CNCCc1ccccc1Br 2230a_100000747383_100011218427 [0,1,0,0,0,0|2,0,1]=4 2381 B14R1.159 CC(O)CNCCc1ccccc1Br 34a_100000210904_100012161201 [0,1,0,0,0,0|2,0,1]=4 2382 B14R1.159 CC(O)CNCCc1ccccc1Br 34a_100000747383_100011218427 [0,1,0,0,0,0|2,0,1]=4 2383 B14R1.159 CC(O)CNCCc1ccccc1Cl 2230a_100000210904_100011713703 [0,1,0,0,0,0|2,0,1]=4 2384 B14R1.159 CC(O)CNCCc1ccccc1Cl 2230a_100011207228_100011218427 [0,1,0,0,0,0|2,0,1]=4 2385 B14R1.159 CC(O)CNCCc1ccccc1Cl 270004a_100000210904_200011713468 [0,1,0,0,0,0|2,0,1]=4 2386 B14R1.159 CC(O)CNCCc1ccccc1Cl 34a_100000210904_100011713703 [0,1,0,0,0,0|2,0,1]=4 2387 B14R1.159 CC(O)CNCCc1ccccc1Cl 34a_100011207228_100011218427 [0,1,0,0,0,0|2,0,1]=4 2388 B14R1.159 CC(O)CNCCc1ccccc1F 2230a_100000185272_100011218427 [0,1,0,0,0,0|2,0,1]=4 2389 B14R1.159 CC(O)CNCCc1ccccc1F 2230a_100000210904_100011713696 [0,1,0,0,0,0|2,0,1]=4 2390 B14R1.159 CC(O)CNCCc1ccccc1F 34a_100000185272_100011218427 [0,1,0,0,0,0|2,0,1]=4 2391 B14R1.159 CC(O)CNCCc1ccccc1F 34a_100000210904_100000720011 [0,1,0,0,0,0|2,0,1]=4 2392 B14R1.159 CC(O)CNCCc1ccccc1O 34a_100000210904_100000722297 [0,1,0,0,0,0|2,0,1]=4 2393 B14R1.159 CC(O)CNCCc1ccccc1O 34a_100011207237_100011218427 [0,1,0,0,0,0|2,0,1]=4 2394 B14R1.159 CC(O)COCCc1ccccc1Br 34a_100000731337_100011218427 [0,1,0,0,0,0|2,0,1]=4 2395 B14R1.159 CC(O)COCCc1ccccc1Br 7a_100000731337_100011218427 [0,1,0,0,0,0|2,0,1]=4 2396 B14R1.159 CC(O)COCCc1ccccc1Cl 34a_100011215284_100011218427 [0,1,0,0,0,0|2,0,1]=4 2397 B14R1.159 CC(O)COCCc1ccccc1Cl 7a_100011215284_100011218427 [0,1,0,0,0,0|2,0,1]=4 2398 B14R1.159 CC(O)COCCc1ccccc1F 34a_100000753711_100011218427 [0,1,0,0,0,0|2,0,1]=4 2399 B14R1.159 CC(O)COCCc1ccccc1F 7a_100000753711_100011218427 [0,1,0,0,0,0|2,0,1]=4 2400 B14R1.159 CC(O)COCCc1ccccc1I 34a_100010255290_100011218427 [0,1,0,0,0,0|2,0,1]=4 2401 B14R1.159 CC(O)COCCc1ccccc1I 7a_100010255290_100011218427 [0,1,0,0,0,0|2,0,1]=4 2402 B14R1.159 CC(O)COCCc1ccccc1N 34a_100011215289_100011218427 [0,1,0,0,0,0|2,0,1]=4 2403 B14R1.159 CC(O)CSCCc1ccccc1Br 62a_100011218427_100012161201 [0,1,0,0,0,0|2,0,1]=4 2404 B14R1.159 CC(O)CSCCc1ccccc1Br 62a_100012161201_100011218427 [0,1,0,0,0,0|2,0,1]=4 2405 B14R1.159 CC(O)CSCCc1ccccc1Cl 62a_100011218427_100011713703 [0,1,0,0,0,0|2,0,1]=4 2406 B14R1.159 CC(O)CSCCc1ccccc1Cl 62a_100011713703_100011218427 [0,1,0,0,0,0|2,0,1]=4 2407 B14R1.159 CC(O)CSCCc1ccccc1F 62a_100011218427_100011713696 [0,1,0,0,0,0|2,0,1]=4 2408 B14R1.159 CC(O)CSCCc1ccccc1F 62a_100011713696_100011218427 [0,1,0,0,0,0|2,0,1]=4 2409 B14R1.159 CC(O)CSCCc1ccccc1O 62a_100000722297_100011218427 [0,1,0,0,0,0|2,0,1]=4 2410 B14R1.159 CC(O)CSCCc1ccccc1O 62a_100011218427_100000722297 [0,1,0,0,0,0|2,0,1]=4 2411 B14R1.159 C[C@@H](O)CNCCc1ccccc1Br 2230a_100000747383_100009817552 [0,1,0,0,0,0|2,0,1]=4 2412 B14R1.159 C[C@@H](O)CNCCc1ccccc1Br 34a_100000747383_100009817552 [0,1,0,0,0,0|2,0,1]=4 2413 B14R1.159 C[C@@H](O)CNCCc1ccccc1Cl 2230a_100011207228_100009817552 [0,1,0,0,0,0|2,0,1]=4 2414 B14R1.159 C[C@@H](O)CNCCc1ccccc1Cl 34a_100011207228_100009817552 [0,1,0,0,0,0|2,0,1]=4 2415 B14R1.159 C[C@@H](O)CNCCc1ccccc1F 2230a_100000185272_100009817552 [0,1,0,0,0,0|2,0,1]=4 2416 B14R1.159 C[C@@H](O)CNCCc1ccccc1F 34a_100000185272_100009817552 [0,1,0,0,0,0|2,0,1]=4 2417 B14R1.159 C[C@@H](O)CNCCc1ccccc1O 34a_100011207237_100009817552 [0,1,0,0,0,0|2,0,1]=4 2418 B14R1.159 C[C@@H](O)COCCc1ccccc1Br 34a_100000731337_100009817552 [0,1,0,0,0,0|2,0,1]=4 2419 B14R1.159 C[C@@H](O)COCCc1ccccc1Br 7a_100000731337_100009817552 [0,1,0,0,0,0|2,0,1]=4 2420 B14R1.159 C[C@@H](O)COCCc1ccccc1Cl 34a_100011215284_100009817552 [0,1,0,0,0,0|2,0,1]=4 2421 B14R1.159 C[C@@H](O)COCCc1ccccc1Cl 7a_100011215284_100009817552 [0,1,0,0,0,0|2,0,1]=4 2422 B14R1.159 C[C@@H](O)COCCc1ccccc1F 34a_100000753711_100009817552 [0,1,0,0,0,0|2,0,1]=4 2423 B14R1.159 C[C@@H](O)COCCc1ccccc1F 7a_100000753711_100009817552 [0,1,0,0,0,0|2,0,1]=4 2424 B14R1.159 C[C@@H](O)COCCc1ccccc1I 34a_100010255290_100009817552 [0,1,0,0,0,0|2,0,1]=4 2425 B14R1.159 C[C@@H](O)COCCc1ccccc1I 7a_100010255290_100009817552 [0,1,0,0,0,0|2,0,1]=4 2426 B14R1.159 C[C@@H](O)COCCc1ccccc1N 34a_100011215289_100009817552 [0,1,0,0,0,0|2,0,1]=4 2427 B14R1.159 C[C@@H](O)CSCCc1ccccc1Br 62a_100009817552_100012161201 [0,1,0,0,0,0|2,0,1]=4 2428 B14R1.159 C[C@@H](O)CSCCc1ccccc1Br 62a_100012161201_100009817552 [0,1,0,0,0,0|2,0,1]=4 2429 B14R1.159 C[C@@H](O)CSCCc1ccccc1Cl 62a_100009817552_100011713703 [0,1,0,0,0,0|2,0,1]=4 2430 B14R1.159 C[C@@H](O)CSCCc1ccccc1Cl 62a_100011713703_100009817552 [0,1,0,0,0,0|2,0,1]=4 2431 B14R1.159 C[C@@H](O)CSCCc1ccccc1F 62a_100009817552_100011713696 [0,1,0,0,0,0|2,0,1]=4 2432 B14R1.159 C[C@@H](O)CSCCc1ccccc1F 62a_100011713696_100009817552 [0,1,0,0,0,0|2,0,1]=4 2433 B14R1.159 C[C@@H](O)CSCCc1ccccc1O 62a_100000722297_100009817552 [0,1,0,0,0,0|2,0,1]=4 2434 B14R1.159 C[C@@H](O)CSCCc1ccccc1O 62a_100009817552_100000722297 [0,1,0,0,0,0|2,0,1]=4 2435 B14R1.159 C[n+]1ccccc1SCCCC(=O)N 62a_100102525003_100000212160 [0,1,0,0,0,0|3,0,0]=4 2436 B14R1.159 Cc1ccccc1CCNCC(=O)N 2230a_100000685071_100000747473 [0,1,0,0,0,0|2,0,0]=3 2437 B14R1.159 Cc1ccccc1CCNCC(=O)N 2230a_100000711301_100011713688 [0,1,0,0,0,0|2,0,0]=3 2438 B14R1.159 Cc1ccccc1CCNCC(=O)N 34a_100000685071_100000187820 [0,1,0,0,0,0|2,0,0]=3 2439 B14R1.159 Cc1ccccc1CCNCC(=O)O 269956a_100016091260_100011713688 [0,1,0,0,0,0|1,0,0]=2 2440 B14R1.159 Cc1ccccc1CCNCC(=O)[O-] 34a_100000685071_100020667443 [0,1,0,0,0,0|1,0,1]=3 2441 B14R1.159 Cc1ccccc1CCNCC(C)O 2230a_100000210904_100011713688 [0,1,0,0,0,0|2,0,1]=4 2442 B14R1.159 Cc1ccccc1CCNCC(C)O 2230a_100000685071_100011218427 [0,1,0,0,0,0|2,0,1]=4 2443 B14R1.159 Cc1ccccc1CCNCC(C)O 34a_100000210904_100011713688 [0,1,0,0,0,0|2,0,1]=4 2444 B14R1.159 Cc1ccccc1CCNCC(C)O 34a_100000685071_100011218427 [0,1,0,0,0,0|2,0,1]=4 2445 B14R1.159 Cc1ccccc1CCNC[C@@H](C)O 2230a_100000685071_100009817552 [0,1,0,0,0,0|2,0,1]=4 2446 B14R1.159 Cc1ccccc1CCNC[C@@H](C)O 34a_100000685071_100009817552 [0,1,0,0,0,0|2,0,1]=4 2447 B14R1.159 Cc1ccccc1CCNC[N+](=O)[O-] 34a_100000685071_100000761209 [0,1,0,0,0,0|2,0,1]=4 2448 B14R1.159 Cc1ccccc1CCOCC(=O)N 34a_100011220023_100000187820 [0,1,0,0,0,0|2,0,0]=3 2449 B14R1.159 Cc1ccccc1CCOCC(=O)N 7a_100011220023_100000187820 [0,1,0,0,0,0|2,0,0]=3 2450 B14R1.159 Cc1ccccc1CCOCC(=O)[O-] 34a_100011220023_100020667443 [0,1,0,0,0,0|1,0,1]=3 2451 B14R1.159 Cc1ccccc1CCOCC(C)O 34a_100011220023_100011218427 [0,1,0,0,0,0|2,0,1]=4 2452 B14R1.159 Cc1ccccc1CCOCC(C)O 7a_100011220023_100011218427 [0,1,0,0,0,0|2,0,1]=4 2453 B14R1.159 Cc1ccccc1CCOC[C@@H](C)O 34a_100011220023_100009817552 [0,1,0,0,0,0|2,0,1]=4 2454 B14R1.159 Cc1ccccc1CCOC[C@@H](C)O 7a_100011220023_100009817552 [0,1,0,0,0,0|2,0,1]=4 2455 B14R1.159 Cc1ccccc1CCOC[N+](=O)[O-] 34a_100011220023_100000761209 [0,1,0,0,0,0|2,0,1]=4 2456 B14R1.159 Cc1ccccc1CCSCC(=O)N 62a_100000747473_100011713688 [0,1,0,0,0,0|2,0,0]=3 2457 B14R1.159 Cc1ccccc1CCSCC(=O)N 62a_100011713688_100000747473 [0,1,0,0,0,0|2,0,0]=3 2458 B14R1.159 Cc1ccccc1CCSCC(=O)[O-] 62a_100011713688_100020667443 [0,1,0,0,0,0|1,0,1]=3 2459 B14R1.159 Cc1ccccc1CCSCC(=O)[O-] 62a_100020667443_100011713688 [0,1,0,0,0,0|1,0,1]=3 2460 B14R1.159 Cc1ccccc1CCSCC(C)O 62a_100011218427_100011713688 [0,1,0,0,0,0|2,0,1]=4 2461 B14R1.159 Cc1ccccc1CCSCC(C)O 62a_100011713688_100011218427 [0,1,0,0,0,0|2,0,1]=4 2462 B14R1.159 Cc1ccccc1CCSC[C@@H](C)O 62a_100009817552_100011713688 [0,1,0,0,0,0|2,0,1]=4 2463 B14R1.159 Cc1ccccc1CCSC[C@@H](C)O 62a_100011713688_100009817552 [0,1,0,0,0,0|2,0,1]=4 2464 B14R1.159 Cc1ccccc1CCSC[N+](=O)[O-] 62a_100011713688_100000761209 [0,1,0,0,0,0|2,0,1]=4 2465 B14R1.159 Cc1ccccc1CNCCC(=O)N 207a_100000740010_100000211143 [0,1,0,0,0,0|2,0,0]=3 2466 B14R1.159 Cc1ccccc1CNCCC(=O)N 34a_100000174972_100000731001 [0,1,0,0,0,0|2,0,0]=3 2467 B14R1.159 Cc1ccccc1CNCCC(C)O 207a_200000755665_100000211143 [0,1,0,0,0,0|2,0,1]=4 2468 B14R1.159 Cc1ccccc1CNCCC(C)O 2230a_200000755665_100000211839 [0,1,0,0,0,0|2,0,1]=4 2469 B14R1.159 Cc1ccccc1CNCCC(C)O 270004a_200000755665_100000211143 [0,1,0,0,0,0|2,0,1]=4 2470 B14R1.159 Cc1ccccc1CNCCC(C)O 34a_100000174972_100012276601 [0,1,0,0,0,0|2,0,1]=4 2471 B14R1.159 Cc1ccccc1CNOCC(=O)O 269956a_100000106656_100000211750 [0,1,0,0,0,0|2,0,0]=3 2472 B14R1.159 Cc1ccccc1COCCC(=O)N 34a_100000698903_100000731001 [0,1,0,0,0,0|2,0,0]=3 2473 B14R1.159 Cc1ccccc1COCCC(=O)N 34a_100000757172_100000211839 [0,1,0,0,0,0|2,0,0]=3 2474 B14R1.159 Cc1ccccc1COCCC(=O)N 7a_100000698903_100000744528 [0,1,0,0,0,0|2,0,0]=3 2475 B14R1.159 Cc1ccccc1COCCC(=O)N 7a_100000757172_100000211839 [0,1,0,0,0,0|2,0,0]=3 2476 B14R1.159 Cc1ccccc1COCCC(C)O 34a_100000698903_100012276601 [0,1,0,0,0,0|2,0,1]=4 2477 B14R1.159 Cc1ccccc1COCCC(C)O 7a_100000698903_100012276601 [0,1,0,0,0,0|2,0,1]=4 2478 B14R1.159 Cc1ccccc1CSCCC(=O)N 62a_100000211839_100000744528 [0,1,0,0,0,0|2,0,0]=3 2479 B14R1.159 Cc1ccccc1CSCCC(=O)N 62a_100000744528_100000211839 [0,1,0,0,0,0|2,0,0]=3 2480 B14R1.159 Cc1ccccc1CSCCC(C)O 62a_100000211839_100012276601 [0,1,0,0,0,0|2,0,1]=4 2481 B14R1.159 Cc1ccccc1CSCCC(C)O 62a_100012276601_100000211839 [0,1,0,0,0,0|2,0,1]=4 2482 B14R1.159 Cc1ccccc1NCCCC(=O)N 34a_100015192222_100102525003 [0,1,0,0,0,0|2,0,0]=3 2483 B14R1.159 Cc1ccccc1NCCCC(C)O 34a_100015192222_200000718107 [0,1,0,0,0,0|2,0,1]=4 2484 B14R1.159 Cc1ccccc1NCCOC(=O)N 34a_100015192222_200011214921 [0,1,0,0,0,0|3,0,0]=4 2485 B14R1.159 Cc1ccccc1OCCCC(=O)N 34a_100000210338_100102525003 [0,1,0,0,0,0|2,0,0]=3 2486 B14R1.159 Cc1ccccc1OCCCC(=O)N 7a_100000210338_100102525003 [0,1,0,0,0,0|2,0,0]=3 2487 B14R1.159 Cc1ccccc1OCCCC(=O)[13CH3] 1458a_100000735866_200025704644 [0,1,0,0,0,0|2,0,0]=3 2488 B14R1.159 Cc1ccccc1OCCCC(C)O 34a_100000210338_200000718107 [0,1,0,0,0,0|2,0,1]=4 2489 B14R1.159 Cc1ccccc1OCCCC(C)O 7a_100000210338_200000718107 [0,1,0,0,0,0|2,0,1]=4 2490 B14R1.159 Cc1ccccc1OCCNC(=O)N 7a_100000210338_200000034859 [0,1,0,0,0,0|3,0,0]=4 2491 B14R1.159 Cc1ccccc1OCCOC(=O)N 34a_100000210338_200011214921 [0,1,0,0,0,0|3,0,0]=4 2492 B14R1.159 Cc1ccccc1OCCOC(=O)N 7a_100000210338_200011214921 [0,1,0,0,0,0|3,0,0]=4 2493 B14R1.159 Cc1ccccc1SCCCC(=O)N 62a_100000210755_100102525003 [0,1,0,0,0,0|2,0,0]=3 2494 B14R1.159 Cc1ccccc1SCCCC(=O)N 62a_100102525003_100000210755 [0,1,0,0,0,0|2,0,0]=3 2495 B14R1.159 Cc1ccccc1SCCCC(C)O 62a_100000210755_200000718107 [0,1,0,0,0,0|2,0,1]=4 2496 B14R1.159 Cc1ccccc1SCCCC(C)O 62a_200000718107_100000210755 [0,1,0,0,0,0|2,0,1]=4 2497 B14R1.159 Cc1ccccc1SCCNC(=O)N 62a_100000210755_200000034859 [0,1,0,0,0,0|3,0,0]=4 2498 B14R1.159 Cc1ccccc1SCCNC(=O)N 62a_200000034859_100000210755 [0,1,0,0,0,0|3,0,0]=4 2499 B14R1.159 Cc1ccccc1SCCOC(=O)N 62a_100000210755_200011214921 [0,1,0,0,0,0|3,0,0]=4 2500 B14R1.159 Cc1ccccc1SCCOC(=O)N 62a_200011214921_100000210755 [0,1,0,0,0,0|3,0,0]=4 2501 B14R1.159 Cc1cccnc1CCOCC(=O)N 34a_100011997706_100000187820 [0,1,0,0,0,0|3,0,0]=4 2502 B14R1.159 Cc1cccnc1CCOCC(=O)N 7a_100011997706_100000187820 [0,1,0,0,0,0|3,0,0]=4 2503 B14R1.159 Cc1cccnc1CCOCC(=O)[O-] 34a_100011997706_100020667443 [0,1,0,0,0,0|2,0,1]=4 2504 B14R1.159 Cc1cccnc1CNCCC(=O)N 207a_100000740010_100000698913 [0,1,0,0,0,0|3,0,0]=4 2505 B14R1.159 Cc1cccnc1CNCCC(=O)N 34a_100011223789_100000731001 [0,1,0,0,0,0|3,0,0]=4 2506 B14R1.159 Cc1cccnc1CNOCC(=O)O 269956a_100000106656_100000696600 [0,1,0,0,0,0|3,0,0]=4 2507 B14R1.159 Cc1cccnc1COCCC(=O)N 34a_100000698912_100000731001 [0,1,0,0,0,0|3,0,0]=4 2508 B14R1.159 Cc1cccnc1COCCC(=O)N 34a_100000757172_100000696600 [0,1,0,0,0,0|3,0,0]=4 2509 B14R1.159 Cc1cccnc1COCCC(=O)N 7a_100000757172_100000696600 [0,1,0,0,0,0|3,0,0]=4 2510 B14R1.159 Cc1cccnc1CSCCC(=O)N 62a_100000696600_100000744528 [0,1,0,0,0,0|3,0,0]=4 2511 B14R1.159 Cc1cccnc1CSCCC(=O)N 62a_100000744528_100000696600 [0,1,0,0,0,0|3,0,0]=4 2512 B14R1.159 Cc1cccnc1SCCCC(=O)N 62a_100000751373_100102525003 [0,1,0,0,0,0|3,0,0]=4 2513 B14R1.159 Cc1cccnc1SCCCC(=O)N 62a_100102525003_100000751373 [0,1,0,0,0,0|3,0,0]=4 2514 B14R1.159 Cc1ccncc1CNCCC(=O)N 207a_100000740010_100000685662 [0,1,0,0,0,0|3,0,0]=4 2515 B14R1.159 Cc1ccncc1CNOCC(=O)O 269956a_100000106656_100000690890 [0,1,0,0,0,0|3,0,0]=4 2516 B14R1.159 Cc1ccncc1COCCC(=O)N 34a_100000757172_100000690890 [0,1,0,0,0,0|3,0,0]=4 2517 B14R1.159 Cc1ccncc1COCCC(=O)N 34a_100011996381_100000731001 [0,1,0,0,0,0|3,0,0]=4 2518 B14R1.159 Cc1ccncc1COCCC(=O)N 7a_100000757172_100000690890 [0,1,0,0,0,0|3,0,0]=4 2519 B14R1.159 Cc1ccncc1CSCCC(=O)N 62a_100000690890_100000744528 [0,1,0,0,0,0|3,0,0]=4 2520 B14R1.159 Cc1ccncc1CSCCC(=O)N 62a_100000744528_100000690890 [0,1,0,0,0,0|3,0,0]=4 2521 B14R1.159 Cc1ccncc1OCCCC(=O)N 34a_100011997053_100102525003 [0,1,0,0,0,0|3,0,0]=4 2522 B14R1.159 Cc1ccncc1OCCCC(=O)N 7a_100011997053_100102525003 [0,1,0,0,0,0|3,0,0]=4 2523 B14R1.159 Cc1ccncc1SCCCC(=O)N 62a_100000761580_100102525003 [0,1,0,0,0,0|3,0,0]=4 2524 B14R1.159 Cc1ccncc1SCCCC(=O)N 62a_100102525003_100000761580 [0,1,0,0,0,0|3,0,0]=4 2525 B14R1.159 Cc1cnccc1CNOCC(=O)O 269956a_100000106656_100020672808 [0,1,0,0,0,0|3,0,0]=4 2526 B14R1.159 Cc1cnccc1COCCC(=O)N 34a_100000757172_100020672809 [0,1,0,0,0,0|3,0,0]=4 2527 B14R1.159 Cc1cnccc1COCCC(=O)N 34a_100011997032_100000731001 [0,1,0,0,0,0|3,0,0]=4 2528 B14R1.159 Cc1cnccc1COCCC(=O)N 7a_100000757172_100020672808 [0,1,0,0,0,0|3,0,0]=4 2529 B14R1.159 Cc1cnccc1CSCCC(=O)N 62a_100000744528_100020672808 [0,1,0,0,0,0|3,0,0]=4 2530 B14R1.159 Cc1cnccc1CSCCC(=O)N 62a_100020672808_100000744528 [0,1,0,0,0,0|3,0,0]=4 2531 B14R1.159 Cc1cnccc1NCCCC(=O)N 27a_100000739312_100000765111 [0,1,0,0,0,0|3,0,0]=4 2532 B14R1.159 Cc1cnccc1OCCCC(=O)N 34a_100000694293_100102525003 [0,1,0,0,0,0|3,0,0]=4 2533 B14R1.159 Cc1cnccc1SCCCC(=O)N 62a_100000765111_100102525003 [0,1,0,0,0,0|3,0,0]=4 2534 B14R1.159 Cc1cnccc1SCCCC(=O)N 62a_100102525003_100000765111 [0,1,0,0,0,0|3,0,0]=4 2535 B14R1.159 Cc1ncccc1CNCCC(=O)N 207a_100000740010_100000751968 [0,1,0,0,0,0|3,0,0]=4 2536 B14R1.159 Cc1ncccc1CNOCC(=O)O 269956a_100000106656_100000732876 [0,1,0,0,0,0|3,0,0]=4 2537 B14R1.159 Cc1ncccc1COCCC(=O)N 34a_100000729262_100000731001 [0,1,0,0,0,0|3,0,0]=4 2538 B14R1.159 Cc1ncccc1COCCC(=O)N 34a_100000757172_100000732876 [0,1,0,0,0,0|3,0,0]=4 2539 B14R1.159 Cc1ncccc1COCCC(=O)N 7a_100000729262_100000744528 [0,1,0,0,0,0|3,0,0]=4 2540 B14R1.159 Cc1ncccc1COCCC(=O)N 7a_100000757172_100000732876 [0,1,0,0,0,0|3,0,0]=4 2541 B14R1.159 Cc1ncccc1CSCCC(=O)N 62a_100000732876_100000744528 [0,1,0,0,0,0|3,0,0]=4 2542 B14R1.159 Cc1ncccc1CSCCC(=O)N 62a_100000744528_100000732876 [0,1,0,0,0,0|3,0,0]=4 2543 B14R1.159 Cc1ncccc1OCCCC(=O)N 34a_100000745507_100102525003 [0,1,0,0,0,0|3,0,0]=4 2544 B14R1.159 Cc1ncccc1OCCCC(=O)N 7a_100000745507_100102525003 [0,1,0,0,0,0|3,0,0]=4 2545 B14R1.159 Cc1ncccc1SCCCC(=O)N 62a_100000751574_100102525003 [0,1,0,0,0,0|3,0,0]=4 2546 B14R1.159 Cc1ncccc1SCCCC(=O)N 62a_100102525003_100000751574 [0,1,0,0,0,0|3,0,0]=4 2547 B14R1.159 NC(=O)CCCNc1ccccc1Br 34a_100000210017_100102525003 [0,1,0,0,0,0|2,0,0]=3 2548 B14R1.159 NC(=O)CCCNc1ccccc1Cl 34a_100000185783_100102525003 [0,1,0,0,0,0|2,0,0]=3 2549 B14R1.159 NC(=O)CCCNc1ccccc1F 34a_100000210422_100102525003 [0,1,0,0,0,0|2,0,0]=3 2550 B14R1.159 NC(=O)CCCNc1ccccc1I 34a_100000210053_100102525003 [0,1,0,0,0,0|2,0,0]=3 2551 B14R1.159 NC(=O)CCCNc1ccccc1O 34a_100000185747_100102525003 [0,1,0,0,0,0|2,0,0]=3 2552 B14R1.159 NC(=O)CCCNc1ccncc1Br 27a_100000739312_100000726257 [0,1,0,0,0,0|3,0,0]=4 2553 B14R1.159 NC(=O)CCCNc1ccncc1F 27a_100000739312_100000035921 [0,1,0,0,0,0|3,0,0]=4 2554 B14R1.159 NC(=O)CCCNc1ncccc1Br 27a_100000739312_100000696092 [0,1,0,0,0,0|3,0,0]=4 2555 B14R1.159 NC(=O)CCCOc1cccc[n+]1[O-] 7a_100000211761_100102525003 [0,1,0,0,0,0|3,0,0]=4 2556 B14R1.159 NC(=O)CCCOc1ccccc1Br 34a_100000181306_100102525003 [0,1,0,0,0,0|2,0,0]=3 2557 B14R1.159 NC(=O)CCCOc1ccccc1Br 7a_100000181306_100102525003 [0,1,0,0,0,0|2,0,0]=3 2558 B14R1.159 NC(=O)CCCOc1ccccc1Cl 34a_100000210172_100102525003 [0,1,0,0,0,0|2,0,0]=3 2559 B14R1.159 NC(=O)CCCOc1ccccc1Cl 7a_100000210172_100102525003 [0,1,0,0,0,0|2,0,0]=3 2560 B14R1.159 NC(=O)CCCOc1ccccc1F 34a_100000210171_100102525003 [0,1,0,0,0,0|2,0,0]=3 2561 B14R1.159 NC(=O)CCCOc1ccccc1F 7a_100000210171_100102525003 [0,1,0,0,0,0|2,0,0]=3 2562 B14R1.159 NC(=O)CCCOc1ccccc1I 34a_100000739446_100102525003 [0,1,0,0,0,0|2,0,0]=3 2563 B14R1.159 NC(=O)CCCOc1ccccc1I 7a_100000739446_100102525003 [0,1,0,0,0,0|2,0,0]=3 2564 B14R1.159 NC(=O)CCCOc1ccccc1N 34a_100000185747_100102525003 [0,1,0,0,0,0|2,0,0]=3 2565 B14R1.159 NC(=O)CCCOc1ccccc1N 7a_100000185747_100102525003 [0,1,0,0,0,0|2,0,0]=3 2566 B14R1.159 NC(=O)CCCOc1cccnc1Br 34a_100000744436_100102525003 [0,1,0,0,0,0|3,0,0]=4 2567 B14R1.159 NC(=O)CCCOc1cccnc1Br 7a_100000744436_100102525003 [0,1,0,0,0,0|3,0,0]=4 2568 B14R1.159 NC(=O)CCCOc1cccnc1Cl 34a_100000757616_100102525003 [0,1,0,0,0,0|3,0,0]=4 2569 B14R1.159 NC(=O)CCCOc1cccnc1Cl 7a_100000757616_100102525003 [0,1,0,0,0,0|3,0,0]=4 2570 B14R1.159 NC(=O)CCCOc1cccnc1F 34a_100000061740_100102525003 [0,1,0,0,0,0|3,0,0]=4 2571 B14R1.159 NC(=O)CCCOc1cccnc1F 7a_100000061740_100102525003 [0,1,0,0,0,0|3,0,0]=4 2572 B14R1.159 NC(=O)CCCOc1cccnc1I 34a_100000034122_100102525003 [0,1,0,0,0,0|3,0,0]=4 2573 B14R1.159 NC(=O)CCCOc1cccnc1I 7a_100000034122_100102525003 [0,1,0,0,0,0|3,0,0]=4 2574 B14R1.159 NC(=O)CCCOc1cccnc1N 34a_100000211975_100102525003 [0,1,0,0,0,0|3,0,0]=4 2575 B14R1.159 NC(=O)CCCOc1cccnc1N 7a_100000211975_100102525003 [0,1,0,0,0,0|3,0,0]=4 2576 B14R1.159 NC(=O)CCCOc1cccoc1=O 34a_100000077404_100102525003 [0,1,0,0,0,0|3,0,0]=4 2577 B14R1.159 NC(=O)CCCOc1cccoc1=O 7a_100000077404_100102525003 [0,1,0,0,0,0|3,0,0]=4 2578 B14R1.159 NC(=O)CCCOc1ccncc1Br 34a_100011996408_100102525003 [0,1,0,0,0,0|3,0,0]=4 2579 B14R1.159 NC(=O)CCCOc1ccncc1Cl 34a_100011997054_100102525003 [0,1,0,0,0,0|3,0,0]=4 2580 B14R1.159 NC(=O)CCCOc1ccncc1F 34a_200000081243_100102525003 [0,1,0,0,0,0|3,0,0]=4 2581 B14R1.159 NC(=O)CCCOc1cnccc1Cl 34a_100011996695_100102525003 [0,1,0,0,0,0|3,0,0]=4 2582 B14R1.159 NC(=O)CCCOc1cnccc1I 34a_100000050107_100102525003 [0,1,0,0,0,0|3,0,0]=4 2583 B14R1.159 NC(=O)CCCOc1cnccc1N 34a_100000753702_100102525003 [0,1,0,0,0,0|3,0,0]=4 2584 B14R1.159 NC(=O)CCCOc1coccc1=O 34a_100000060831_100102525003 [0,1,0,0,0,0|3,0,0]=4 2585 B14R1.159 NC(=O)CCCOc1ncccc1Cl 34a_100011290957_100102525003 [0,1,0,0,0,0|3,0,0]=4 2586 B14R1.159 NC(=O)CCCOc1ncccc1F 34a_100011219419_100102525003 [0,1,0,0,0,0|3,0,0]=4 2587 B14R1.159 NC(=O)CCCOc1ncccc1N 34a_100000746358_100102525003 [0,1,0,0,0,0|3,0,0]=4 2588 B14R1.159 NC(=O)CCCSc1c[nH]ccc1=O 62a_100009998708_100102525003 [0,1,0,0,0,0|3,0,0]=4 2589 B14R1.159 NC(=O)CCCSc1c[nH]ccc1=O 62a_100102525003_100009998708 [0,1,0,0,0,0|3,0,0]=4 2590 B14R1.159 NC(=O)CCCSc1c[nH]ccc1=S 62a_100102525003_200012280681 [0,1,0,0,0,0|3,0,0]=4 2591 B14R1.159 NC(=O)CCCSc1c[nH]ccc1=S 62a_200012280681_100102525003 [0,1,0,0,0,0|3,0,0]=4 2592 B14R1.159 NC(=O)CCCSc1cccc[n+]1[O-] 62a_100102525003_200000042595 [0,1,0,0,0,0|3,0,0]=4 2593 B14R1.159 NC(=O)CCCSc1ccccc1Br 62a_100000695589_100102525003 [0,1,0,0,0,0|2,0,0]=3 2594 B14R1.159 NC(=O)CCCSc1ccccc1Br 62a_100102525003_100000695589 [0,1,0,0,0,0|2,0,0]=3 2595 B14R1.159 NC(=O)CCCSc1ccccc1Cl 62a_100000764095_100102525003 [0,1,0,0,0,0|2,0,0]=3 2596 B14R1.159 NC(=O)CCCSc1ccccc1Cl 62a_100102525003_100000764095 [0,1,0,0,0,0|2,0,0]=3 2597 B14R1.159 NC(=O)CCCSc1ccccc1F 62a_100011215700_100102525003 [0,1,0,0,0,0|2,0,0]=3 2598 B14R1.159 NC(=O)CCCSc1ccccc1F 62a_100102525003_100011215700 [0,1,0,0,0,0|2,0,0]=3 2599 B14R1.159 NC(=O)CCCSc1ccccc1N 62a_100000210017_100102525003 [0,1,0,0,0,0|2,0,0]=3 2600 B14R1.159 NC(=O)CCCSc1ccccc1N 62a_100102525003_100000210017 [0,1,0,0,0,0|2,0,0]=3 2601 B14R1.159 NC(=O)CCCSc1ccccc1O 62a_100000739446_100102525003 [0,1,0,0,0,0|2,0,0]=3 2602 B14R1.159 NC(=O)CCCSc1ccccc1O 62a_100102525003_100000739446 [0,1,0,0,0,0|2,0,0]=3 2603 B14R1.159 NC(=O)CCCSc1cccnc1Br 62a_100010202626_100102525003 [0,1,0,0,0,0|3,0,0]=4 2604 B14R1.159 NC(=O)CCCSc1cccnc1Br 62a_100102525003_100010202626 [0,1,0,0,0,0|3,0,0]=4 2605 B14R1.159 NC(=O)CCCSc1cccnc1Cl 62a_100000036424_100102525003 [0,1,0,0,0,0|3,0,0]=4 2606 B14R1.159 NC(=O)CCCSc1cccnc1Cl 62a_100102525003_100000036424 [0,1,0,0,0,0|3,0,0]=4 2607 B14R1.159 NC(=O)CCCSc1cccnc1F 62a_100009816115_100102525003 [0,1,0,0,0,0|3,0,0]=4 2608 B14R1.159 NC(=O)CCCSc1cccnc1F 62a_100102525003_100009816115 [0,1,0,0,0,0|3,0,0]=4 2609 B14R1.159 NC(=O)CCCSc1cccnc1N 62a_100000045569_100102525003 [0,1,0,0,0,0|3,0,0]=4 2610 B14R1.159 NC(=O)CCCSc1cccnc1N 62a_100102525003_100000045569 [0,1,0,0,0,0|3,0,0]=4 2611 B14R1.159 NC(=O)CCCSc1cccnc1O 62a_100000760158_100102525003 [0,1,0,0,0,0|3,0,0]=4 2612 B14R1.159 NC(=O)CCCSc1cccnc1O 62a_100102525003_100000760158 [0,1,0,0,0,0|3,0,0]=4 2613 B14R1.159 NC(=O)CCCSc1ccncc1Br 62a_100000726257_100102525003 [0,1,0,0,0,0|3,0,0]=4 2614 B14R1.159 NC(=O)CCCSc1ccncc1Br 62a_100102525003_100000726257 [0,1,0,0,0,0|3,0,0]=4 2615 B14R1.159 NC(=O)CCCSc1ccncc1Cl 62a_100000708259_100102525003 [0,1,0,0,0,0|3,0,0]=4 2616 B14R1.159 NC(=O)CCCSc1ccncc1Cl 62a_100102525003_100000708259 [0,1,0,0,0,0|3,0,0]=4 2617 B14R1.159 NC(=O)CCCSc1ccncc1F 62a_100000047030_100102525003 [0,1,0,0,0,0|3,0,0]=4 2618 B14R1.159 NC(=O)CCCSc1ccncc1F 62a_100102525003_100000047030 [0,1,0,0,0,0|3,0,0]=4 2619 B14R1.159 NC(=O)CCCSc1ccncc1N 62a_100000756074_100102525003 [0,1,0,0,0,0|3,0,0]=4 2620 B14R1.159 NC(=O)CCCSc1ccncc1N 62a_100102525003_100000756074 [0,1,0,0,0,0|3,0,0]=4 2621 B14R1.159 NC(=O)CCCSc1ccncc1O 62a_100009817591_100102525003 [0,1,0,0,0,0|3,0,0]=4 2622 B14R1.159 NC(=O)CCCSc1ccncc1O 62a_100102525003_100009817591 [0,1,0,0,0,0|3,0,0]=4 2623 B14R1.159 NC(=O)CCCSc1cnccc1Br 62a_100010138639_100102525003 [0,1,0,0,0,0|3,0,0]=4 2624 B14R1.159 NC(=O)CCCSc1cnccc1Br 62a_100102525003_100010138639 [0,1,0,0,0,0|3,0,0]=4 2625 B14R1.159 NC(=O)CCCSc1cnccc1Cl 62a_100009995489_100102525003 [0,1,0,0,0,0|3,0,0]=4 2626 B14R1.159 NC(=O)CCCSc1cnccc1Cl 62a_100102525003_100009995489 [0,1,0,0,0,0|3,0,0]=4 2627 B14R1.159 NC(=O)CCCSc1cnccc1F 62a_100009820683_100102525003 [0,1,0,0,0,0|3,0,0]=4 2628 B14R1.159 NC(=O)CCCSc1cnccc1F 62a_100102525003_100009820683 [0,1,0,0,0,0|3,0,0]=4 2629 B14R1.159 NC(=O)CCCSc1cnccc1N 62a_100000047001_100102525003 [0,1,0,0,0,0|3,0,0]=4 2630 B14R1.159 NC(=O)CCCSc1cnccc1N 62a_100102525003_100000047001 [0,1,0,0,0,0|3,0,0]=4 2631 B14R1.159 NC(=O)CCCSc1ncccc1Br 62a_100000696092_100102525003 [0,1,0,0,0,0|3,0,0]=4 2632 B14R1.159 NC(=O)CCCSc1ncccc1Br 62a_100102525003_100000696092 [0,1,0,0,0,0|3,0,0]=4 2633 B14R1.159 NC(=O)CCCSc1ncccc1Cl 62a_100011356963_100102525003 [0,1,0,0,0,0|3,0,0]=4 2634 B14R1.159 NC(=O)CCCSc1ncccc1Cl 62a_100102525003_100011356963 [0,1,0,0,0,0|3,0,0]=4 2635 B14R1.159 NC(=O)CCCSc1ncccc1F 62a_100000685392_100102525003 [0,1,0,0,0,0|3,0,0]=4 2636 B14R1.159 NC(=O)CCCSc1ncccc1F 62a_100102525003_100000685392 [0,1,0,0,0,0|3,0,0]=4 2637 B14R1.159 NC(=O)CCCSc1ncccc1N 62a_100000688686_100102525003 [0,1,0,0,0,0|3,0,0]=4 2638 B14R1.159 NC(=O)CCCSc1ncccc1N 62a_100102525003_100000688686 [0,1,0,0,0,0|3,0,0]=4 2639 B14R1.159 NC(=O)CCCSc1ncccc1O 62a_100000034122_100102525003 [0,1,0,0,0,0|3,0,0]=4 2640 B14R1.159 NC(=O)CCCSc1ncccc1O 62a_100102525003_100000034122 [0,1,0,0,0,0|3,0,0]=4 2641 B14R1.159 NC(=O)CCNCc1ccccc1Br 207a_100000740010_100000211189 [0,1,0,0,0,0|2,0,0]=3 2642 B14R1.159 NC(=O)CCNCc1ccccc1Br 2230a_100000689332_100000744528 [0,1,0,0,0,0|2,0,0]=3 2643 B14R1.159 NC(=O)CCNCc1ccccc1Br 34a_100000689332_100000731001 [0,1,0,0,0,0|2,0,0]=3 2644 B14R1.159 NC(=O)CCNCc1ccccc1Cl 207a_100000740010_100000210073 [0,1,0,0,0,0|2,0,0]=3 2645 B14R1.159 NC(=O)CCNCc1ccccc1Cl 2230a_100000174879_100000744528 [0,1,0,0,0,0|2,0,0]=3 2646 B14R1.159 NC(=O)CCNCc1ccccc1Cl 34a_100000174879_100000731001 [0,1,0,0,0,0|2,0,0]=3 2647 B14R1.159 NC(=O)CCNCc1ccccc1F 207a_100000740010_100000210811 [0,1,0,0,0,0|2,0,0]=3 2648 B14R1.159 NC(=O)CCNCc1ccccc1F 34a_100000174869_100000731001 [0,1,0,0,0,0|2,0,0]=3 2649 B14R1.159 NC(=O)CCNCc1ccccc1I 207a_100000740010_100000010305 [0,1,0,0,0,0|2,0,0]=3 2650 B14R1.159 NC(=O)CCNCc1ccccc1O 34a_100000185550_100000731001 [0,1,0,0,0,0|2,0,0]=3 2651 B14R1.159 NC(=O)CCNCc1cccnc1Br 2230a_100009818023_100000744528 [0,1,0,0,0,0|3,0,0]=4 2652 B14R1.159 NC(=O)CCNCc1cccnc1Br 34a_100009818023_100000731001 [0,1,0,0,0,0|3,0,0]=4 2653 B14R1.159 NC(=O)CCNCc1cccnc1Cl 2230a_100015189234_100000744528 [0,1,0,0,0,0|3,0,0]=4 2654 B14R1.159 NC(=O)CCNCc1cccnc1Cl 34a_100015189234_100000731001 [0,1,0,0,0,0|3,0,0]=4 2655 B14R1.159 NC(=O)CCNCc1cccnc1F 34a_100000724633_100000731001 [0,1,0,0,0,0|3,0,0]=4 2656 B14R1.159 NC(=O)CCNCc1cccnc1O 207a_100000740010_100011998315 [0,1,0,0,0,0|3,0,0]=4 2657 B14R1.159 NC(=O)CCNCc1ccncc1Cl 207a_100000740010_100011934409 [0,1,0,0,0,0|3,0,0]=4 2658 B14R1.159 NC(=O)CCNCc1ccncc1F 34a_100011935246_100000731001 [0,1,0,0,0,0|3,0,0]=4 2659 B14R1.159 NC(=O)CCNCc1ncccc1Br 207a_100000740010_100011934733 [0,1,0,0,0,0|3,0,0]=4 2660 B14R1.159 NC(=O)CCNCc1ncccc1Cl 207a_100000740010_100012001307 [0,1,0,0,0,0|3,0,0]=4 2661 B14R1.159 NC(=O)CCNCc1ncccc1Cl 2230a_100015189233_100000744528 [0,1,0,0,0,0|3,0,0]=4 2662 B14R1.159 NC(=O)CCNCc1ncccc1F 207a_100000740010_100011934734 [0,1,0,0,0,0|3,0,0]=4 2663 B14R1.159 NC(=O)CCNCc1ncccc1F 34a_100000690088_100000731001 [0,1,0,0,0,0|3,0,0]=4 2664 B14R1.159 NC(=O)CCOCc1ccccc1Br 34a_100000756307_100000731001 [0,1,0,0,0,0|2,0,0]=3 2665 B14R1.159 NC(=O)CCOCc1ccccc1Br 34a_100000757172_100000184730 [0,1,0,0,0,0|2,0,0]=3 2666 B14R1.159 NC(=O)CCOCc1ccccc1Br 7a_100000756307_100000744528 [0,1,0,0,0,0|2,0,0]=3 2667 B14R1.159 NC(=O)CCOCc1ccccc1Br 7a_100000757172_100000184730 [0,1,0,0,0,0|2,0,0]=3 2668 B14R1.159 NC(=O)CCOCc1ccccc1Cl 34a_100000210847_100000731001 [0,1,0,0,0,0|2,0,0]=3 2669 B14R1.159 NC(=O)CCOCc1ccccc1Cl 34a_100000757172_100000187162 [0,1,0,0,0,0|2,0,0]=3 2670 B14R1.159 NC(=O)CCOCc1ccccc1Cl 7a_100000210847_100000744528 [0,1,0,0,0,0|2,0,0]=3 2671 B14R1.159 NC(=O)CCOCc1ccccc1Cl 7a_100000757172_100000187162 [0,1,0,0,0,0|2,0,0]=3 2672 B14R1.159 NC(=O)CCOCc1ccccc1F 34a_100000211962_100000731001 [0,1,0,0,0,0|2,0,0]=3 2673 B14R1.159 NC(=O)CCOCc1ccccc1F 34a_100000757172_100000211605 [0,1,0,0,0,0|2,0,0]=3 2674 B14R1.159 NC(=O)CCOCc1ccccc1F 7a_100000211962_100000744528 [0,1,0,0,0,0|2,0,0]=3 2675 B14R1.159 NC(=O)CCOCc1ccccc1F 7a_100000757172_100000211605 [0,1,0,0,0,0|2,0,0]=3 2676 B14R1.159 NC(=O)CCOCc1ccccc1I 34a_100000187465_100000731001 [0,1,0,0,0,0|2,0,0]=3 2677 B14R1.159 NC(=O)CCOCc1ccccc1I 34a_100000757172_100011215278 [0,1,0,0,0,0|2,0,0]=3 2678 B14R1.159 NC(=O)CCOCc1ccccc1I 7a_100000187465_100000744528 [0,1,0,0,0,0|2,0,0]=3 2679 B14R1.159 NC(=O)CCOCc1ccccc1I 7a_100000757172_100011215278 [0,1,0,0,0,0|2,0,0]=3 2680 B14R1.159 NC(=O)CCOCc1ccccc1N 34a_100000212039_100000731001 [0,1,0,0,0,0|2,0,0]=3 2681 B14R1.159 NC(=O)CCOCc1cccnc1Br 34a_100000719692_100000731001 [0,1,0,0,0,0|3,0,0]=4 2682 B14R1.159 NC(=O)CCOCc1cccnc1Br 34a_100000757172_100010140945 [0,1,0,0,0,0|3,0,0]=4 2683 B14R1.159 NC(=O)CCOCc1cccnc1Br 7a_100000719692_100000744528 [0,1,0,0,0,0|3,0,0]=4 2684 B14R1.159 NC(=O)CCOCc1cccnc1Br 7a_100000757172_100010140945 [0,1,0,0,0,0|3,0,0]=4 2685 B14R1.159 NC(=O)CCOCc1cccnc1Cl 34a_100000748726_100000731001 [0,1,0,0,0,0|3,0,0]=4 2686 B14R1.159 NC(=O)CCOCc1cccnc1Cl 34a_100000757172_100000045678 [0,1,0,0,0,0|3,0,0]=4 2687 B14R1.159 NC(=O)CCOCc1cccnc1Cl 7a_100000748726_100000744528 [0,1,0,0,0,0|3,0,0]=4 2688 B14R1.159 NC(=O)CCOCc1cccnc1Cl 7a_100000757172_100000045678 [0,1,0,0,0,0|3,0,0]=4 2689 B14R1.159 NC(=O)CCOCc1cccnc1F 34a_100000079888_100000731001 [0,1,0,0,0,0|3,0,0]=4 2690 B14R1.159 NC(=O)CCOCc1cccnc1F 34a_100000757172_100000099810 [0,1,0,0,0,0|3,0,0]=4 2691 B14R1.159 NC(=O)CCOCc1cccnc1F 7a_100000079888_100000744528 [0,1,0,0,0,0|3,0,0]=4 2692 B14R1.159 NC(=O)CCOCc1cccnc1F 7a_100000757172_100000099810 [0,1,0,0,0,0|3,0,0]=4 2693 B14R1.159 NC(=O)CCOCc1ccncc1Cl 7a_100000757172_100000763264 [0,1,0,0,0,0|3,0,0]=4 2694 B14R1.159 NC(=O)CCOCc1ccncc1F 34a_100012172863_100000731001 [0,1,0,0,0,0|3,0,0]=4 2695 B14R1.159 NC(=O)CCOCc1cnccc1Cl 34a_100000117392_100000731001 [0,1,0,0,0,0|3,0,0]=4 2696 B14R1.159 NC(=O)CCOCc1ncccc1Br 34a_100000757172_100025702911 [0,1,0,0,0,0|3,0,0]=4 2697 B14R1.159 NC(=O)CCOCc1ncccc1Br 34a_100011996772_100000731001 [0,1,0,0,0,0|3,0,0]=4 2698 B14R1.159 NC(=O)CCOCc1ncccc1Br 7a_100000757172_100025702911 [0,1,0,0,0,0|3,0,0]=4 2699 B14R1.159 NC(=O)CCOCc1ncccc1Cl 34a_100012002383_100000731001 [0,1,0,0,0,0|3,0,0]=4 2700 B14R1.159 NC(=O)CCOCc1ncccc1Cl 7a_100000757172_100000099807 [0,1,0,0,0,0|3,0,0]=4 2701 B14R1.159 NC(=O)CCOCc1ncccc1F 34a_100000757172_100000104219 [0,1,0,0,0,0|3,0,0]=4 2702 B14R1.159 NC(=O)CCOCc1ncccc1F 34a_100011934865_100000731001 [0,1,0,0,0,0|3,0,0]=4 2703 B14R1.159 NC(=O)CCOCc1ncccc1F 7a_100000757172_100000104219 [0,1,0,0,0,0|3,0,0]=4 2704 B14R1.159 NC(=O)CCOCc1ncccc1N 34a_114873767017_100000731001 [0,1,0,0,0,0|3,0,0]=4 2705 B14R1.159 NC(=O)CCOCc1ncccc1O 34a_100000757172_200020655725 [0,1,0,0,0,0|3,0,0]=4 2706 B14R1.159 NC(=O)CCOCc1ncccc1O 7a_100000757172_200020655725 [0,1,0,0,0,0|3,0,0]=4 2707 B14R1.159 NC(=O)CCSCc1ccccc1Br 62a_100000184730_100000744528 [0,1,0,0,0,0|2,0,0]=3 2708 B14R1.159 NC(=O)CCSCc1ccccc1Br 62a_100000744528_100000184730 [0,1,0,0,0,0|2,0,0]=3 2709 B14R1.159 NC(=O)CCSCc1ccccc1Cl 62a_100000187162_100000744528 [0,1,0,0,0,0|2,0,0]=3 2710 B14R1.159 NC(=O)CCSCc1ccccc1Cl 62a_100000744528_100000187162 [0,1,0,0,0,0|2,0,0]=3 2711 B14R1.159 NC(=O)CCSCc1ccccc1F 62a_100000211605_100000744528 [0,1,0,0,0,0|2,0,0]=3 2712 B14R1.159 NC(=O)CCSCc1ccccc1F 62a_100000744528_100000211605 [0,1,0,0,0,0|2,0,0]=3 2713 B14R1.159 NC(=O)CCSCc1ccccc1I 62a_100000744528_100011216222 [0,1,0,0,0,0|2,0,0]=3 2714 B14R1.159 NC(=O)CCSCc1ccccc1I 62a_100011216222_100000744528 [0,1,0,0,0,0|2,0,0]=3 2715 B14R1.159 NC(=O)CCSCc1cccnc1Br 62a_100000744528_100010140945 [0,1,0,0,0,0|3,0,0]=4 2716 B14R1.159 NC(=O)CCSCc1cccnc1Br 62a_100010140945_100000744528 [0,1,0,0,0,0|3,0,0]=4 2717 B14R1.159 NC(=O)CCSCc1cccnc1Cl 62a_100000045678_100000744528 [0,1,0,0,0,0|3,0,0]=4 2718 B14R1.159 NC(=O)CCSCc1cccnc1Cl 62a_100000744528_100000045678 [0,1,0,0,0,0|3,0,0]=4 2719 B14R1.159 NC(=O)CCSCc1cccnc1F 62a_100000099810_100000744528 [0,1,0,0,0,0|3,0,0]=4 2720 B14R1.159 NC(=O)CCSCc1cccnc1F 62a_100000744528_100000099810 [0,1,0,0,0,0|3,0,0]=4 2721 B14R1.159 NC(=O)CCSCc1ccncc1Cl 62a_100000744528_100000763264 [0,1,0,0,0,0|3,0,0]=4 2722 B14R1.159 NC(=O)CCSCc1ccncc1Cl 62a_100000763264_100000744528 [0,1,0,0,0,0|3,0,0]=4 2723 B14R1.159 NC(=O)CCSCc1ncccc1Br 62a_100000744528_100025702911 [0,1,0,0,0,0|3,0,0]=4 2724 B14R1.159 NC(=O)CCSCc1ncccc1Br 62a_100025702911_100000744528 [0,1,0,0,0,0|3,0,0]=4 2725 B14R1.159 NC(=O)CCSCc1ncccc1Cl 62a_100000099807_100000744528 [0,1,0,0,0,0|3,0,0]=4 2726 B14R1.159 NC(=O)CCSCc1ncccc1Cl 62a_100000744528_100000099807 [0,1,0,0,0,0|3,0,0]=4 2727 B14R1.159 NC(=O)CCSCc1ncccc1F 62a_100000104219_100000744528 [0,1,0,0,0,0|3,0,0]=4 2728 B14R1.159 NC(=O)CCSCc1ncccc1F 62a_100000744528_100000104219 [0,1,0,0,0,0|3,0,0]=4 2729 B14R1.159 NC(=O)CCSCc1ncccc1O 62a_100000744528_200020655725 [0,1,0,0,0,0|3,0,0]=4 2730 B14R1.159 NC(=O)CCSCc1ncccc1O 62a_200020655725_100000744528 [0,1,0,0,0,0|3,0,0]=4 2731 B14R1.159 NC(=O)CNCCc1ccccc1Br 2230a_100000711301_100012161201 [0,1,0,0,0,0|2,0,0]=3 2732 B14R1.159 NC(=O)CNCCc1ccccc1Br 2230a_100000747383_100000747473 [0,1,0,0,0,0|2,0,0]=3 2733 B14R1.159 NC(=O)CNCCc1ccccc1Br 34a_100000747383_100000187820 [0,1,0,0,0,0|2,0,0]=3 2734 B14R1.159 NC(=O)CNCCc1ccccc1Cl 2230a_100000711301_100011713703 [0,1,0,0,0,0|2,0,0]=3 2735 B14R1.159 NC(=O)CNCCc1ccccc1Cl 2230a_100011207228_100000747473 [0,1,0,0,0,0|2,0,0]=3 2736 B14R1.159 NC(=O)CNCCc1ccccc1Cl 34a_100011207228_100000187820 [0,1,0,0,0,0|2,0,0]=3 2737 B14R1.159 NC(=O)CNCCc1ccccc1F 2230a_100000185272_100000747473 [0,1,0,0,0,0|2,0,0]=3 2738 B14R1.159 NC(=O)CNCCc1ccccc1F 2230a_100000711301_100011713696 [0,1,0,0,0,0|2,0,0]=3 2739 B14R1.159 NC(=O)CNCCc1ccccc1F 34a_100000185272_100000187820 [0,1,0,0,0,0|2,0,0]=3 2740 B14R1.159 NC(=O)CNCCc1ccccc1O 34a_100011207237_100000187820 [0,1,0,0,0,0|2,0,0]=3 2741 B14R1.159 NC(=O)CNCCn1ccccc1=O 2230a_100000687133_100000747473 [0,1,0,0,0,0|3,0,0]=4 2742 B14R1.159 NC(=O)COCCc1ccccc1Br 34a_100000731337_100000187820 [0,1,0,0,0,0|2,0,0]=3 2743 B14R1.159 NC(=O)COCCc1ccccc1Br 7a_100000731337_100000187820 [0,1,0,0,0,0|2,0,0]=3 2744 B14R1.159 NC(=O)COCCc1ccccc1Cl 34a_100011215284_100000187820 [0,1,0,0,0,0|2,0,0]=3 2745 B14R1.159 NC(=O)COCCc1ccccc1Cl 7a_100011215284_100000187820 [0,1,0,0,0,0|2,0,0]=3 2746 B14R1.159 NC(=O)COCCc1ccccc1F 34a_100000753711_100000187820 [0,1,0,0,0,0|2,0,0]=3 2747 B14R1.159 NC(=O)COCCc1ccccc1F 7a_100000753711_100000187820 [0,1,0,0,0,0|2,0,0]=3 2748 B14R1.159 NC(=O)COCCc1ccccc1I 34a_100010255290_100000187820 [0,1,0,0,0,0|2,0,0]=3 2749 B14R1.159 NC(=O)COCCc1ccccc1I 7a_100010255290_100000187820 [0,1,0,0,0,0|2,0,0]=3 2750 B14R1.159 NC(=O)COCCc1ccccc1N 34a_100011215289_100000187820 [0,1,0,0,0,0|2,0,0]=3 2751 B14R1.159 NC(=O)CSCCc1ccccc1Br 62a_100000747473_100012161201 [0,1,0,0,0,0|2,0,0]=3 2752 B14R1.159 NC(=O)CSCCc1ccccc1Br 62a_100012161201_100000747473 [0,1,0,0,0,0|2,0,0]=3 2753 B14R1.159 NC(=O)CSCCc1ccccc1Cl 62a_100000747473_100011713703 [0,1,0,0,0,0|2,0,0]=3 2754 B14R1.159 NC(=O)CSCCc1ccccc1Cl 62a_100011713703_100000747473 [0,1,0,0,0,0|2,0,0]=3 2755 B14R1.159 NC(=O)CSCCc1ccccc1F 62a_100000747473_100011713696 [0,1,0,0,0,0|2,0,0]=3 2756 B14R1.159 NC(=O)CSCCc1ccccc1F 62a_100011713696_100000747473 [0,1,0,0,0,0|2,0,0]=3 2757 B14R1.159 NC(=O)CSCCc1ccccc1O 62a_100000722297_100000747473 [0,1,0,0,0,0|2,0,0]=3 2758 B14R1.159 NC(=O)CSCCc1ccccc1O 62a_100000747473_100000722297 [0,1,0,0,0,0|2,0,0]=3 2759 B14R1.159 NC(=O)NCCOc1ccccc1Br 7a_100000181306_200000034859 [0,1,0,0,0,0|3,0,0]=4 2760 B14R1.159 NC(=O)NCCOc1ccccc1Cl 7a_100000210172_200000034859 [0,1,0,0,0,0|3,0,0]=4 2761 B14R1.159 NC(=O)NCCOc1ccccc1F 7a_100000210171_200000034859 [0,1,0,0,0,0|3,0,0]=4 2762 B14R1.159 NC(=O)NCCOc1ccccc1I 7a_100000739446_200000034859 [0,1,0,0,0,0|3,0,0]=4 2763 B14R1.159 NC(=O)NCCOc1ccccc1N 7a_100000185747_200000034859 [0,1,0,0,0,0|3,0,0]=4 2764 B14R1.159 NC(=O)NCCSc1ccccc1Br 62a_100000695589_200000034859 [0,1,0,0,0,0|3,0,0]=4 2765 B14R1.159 NC(=O)NCCSc1ccccc1Br 62a_200000034859_100000695589 [0,1,0,0,0,0|3,0,0]=4 2766 B14R1.159 NC(=O)NCCSc1ccccc1Cl 62a_100000764095_200000034859 [0,1,0,0,0,0|3,0,0]=4 2767 B14R1.159 NC(=O)NCCSc1ccccc1Cl 62a_200000034859_100000764095 [0,1,0,0,0,0|3,0,0]=4 2768 B14R1.159 NC(=O)NCCSc1ccccc1F 62a_100011215700_200000034859 [0,1,0,0,0,0|3,0,0]=4 2769 B14R1.159 NC(=O)NCCSc1ccccc1F 62a_200000034859_100011215700 [0,1,0,0,0,0|3,0,0]=4 2770 B14R1.159 NC(=O)NCCSc1ccccc1N 62a_100000210017_200000034859 [0,1,0,0,0,0|3,0,0]=4 2771 B14R1.159 NC(=O)NCCSc1ccccc1N 62a_200000034859_100000210017 [0,1,0,0,0,0|3,0,0]=4 2772 B14R1.159 NC(=O)NCCSc1ccccc1O 62a_100000739446_200000034859 [0,1,0,0,0,0|3,0,0]=4 2773 B14R1.159 NC(=O)NCCSc1ccccc1O 62a_200000034859_100000739446 [0,1,0,0,0,0|3,0,0]=4 2774 B14R1.159 NC(=O)OCCNc1ccccc1Br 34a_100000210017_200011214921 [0,1,0,0,0,0|3,0,0]=4 2775 B14R1.159 NC(=O)OCCNc1ccccc1Cl 34a_100000185783_200011214921 [0,1,0,0,0,0|3,0,0]=4 2776 B14R1.159 NC(=O)OCCNc1ccccc1F 34a_100000210422_200011214921 [0,1,0,0,0,0|3,0,0]=4 2777 B14R1.159 NC(=O)OCCNc1ccccc1I 34a_100000210053_200011214921 [0,1,0,0,0,0|3,0,0]=4 2778 B14R1.159 NC(=O)OCCNc1ccccc1O 34a_100000185747_200011214921 [0,1,0,0,0,0|3,0,0]=4 2779 B14R1.159 NC(=O)OCCOc1ccccc1Br 34a_100000181306_200011214921 [0,1,0,0,0,0|3,0,0]=4 2780 B14R1.159 NC(=O)OCCOc1ccccc1Br 7a_100000181306_200011214921 [0,1,0,0,0,0|3,0,0]=4 2781 B14R1.159 NC(=O)OCCOc1ccccc1Cl 34a_100000210172_200011214921 [0,1,0,0,0,0|3,0,0]=4 2782 B14R1.159 NC(=O)OCCOc1ccccc1Cl 7a_100000210172_200011214921 [0,1,0,0,0,0|3,0,0]=4 2783 B14R1.159 NC(=O)OCCOc1ccccc1F 34a_100000210171_200011214921 [0,1,0,0,0,0|3,0,0]=4 2784 B14R1.159 NC(=O)OCCOc1ccccc1F 7a_100000210171_200011214921 [0,1,0,0,0,0|3,0,0]=4 2785 B14R1.159 NC(=O)OCCOc1ccccc1I 34a_100000739446_200011214921 [0,1,0,0,0,0|3,0,0]=4 2786 B14R1.159 NC(=O)OCCOc1ccccc1I 7a_100000739446_200011214921 [0,1,0,0,0,0|3,0,0]=4 2787 B14R1.159 NC(=O)OCCOc1ccccc1N 34a_100000185747_200011214921 [0,1,0,0,0,0|3,0,0]=4 2788 B14R1.159 NC(=O)OCCOc1ccccc1N 7a_100000185747_200011214921 [0,1,0,0,0,0|3,0,0]=4 2789 B14R1.159 NC(=O)OCCSc1ccccc1Br 62a_100000695589_200011214921 [0,1,0,0,0,0|3,0,0]=4 2790 B14R1.159 NC(=O)OCCSc1ccccc1Br 62a_200011214921_100000695589 [0,1,0,0,0,0|3,0,0]=4 2791 B14R1.159 NC(=O)OCCSc1ccccc1Cl 62a_100000764095_200011214921 [0,1,0,0,0,0|3,0,0]=4 2792 B14R1.159 NC(=O)OCCSc1ccccc1Cl 62a_200011214921_100000764095 [0,1,0,0,0,0|3,0,0]=4 2793 B14R1.159 NC(=O)OCCSc1ccccc1F 62a_100011215700_200011214921 [0,1,0,0,0,0|3,0,0]=4 2794 B14R1.159 NC(=O)OCCSc1ccccc1F 62a_200011214921_100011215700 [0,1,0,0,0,0|3,0,0]=4 2795 B14R1.159 NC(=O)OCCSc1ccccc1N 62a_100000210017_200011214921 [0,1,0,0,0,0|3,0,0]=4 2796 B14R1.159 NC(=O)OCCSc1ccccc1N 62a_200011214921_100000210017 [0,1,0,0,0,0|3,0,0]=4 2797 B14R1.159 NC(=O)OCCSc1ccccc1O 62a_100000739446_200011214921 [0,1,0,0,0,0|3,0,0]=4 2798 B14R1.159 NC(=O)OCCSc1ccccc1O 62a_200011214921_100000739446 [0,1,0,0,0,0|3,0,0]=4 2799 B14R1.159 Nc1ccccc1CCOCC(=O)[O-] 34a_100011215289_100020667443 [0,1,0,0,0,0|1,0,1]=3 2800 B14R1.159 Nc1ccccc1CCOC[N+](=O)[O-] 34a_100011215289_100000761209 [0,1,0,0,0,0|2,0,1]=4 2801 B14R1.159 O=C(O)CNCCc1ccccc1Br 269956a_100016091260_100012161201 [0,1,0,0,0,0|1,0,0]=2 2802 B14R1.159 O=C(O)CNCCc1ccccc1Cl 269956a_100016091260_100011713703 [0,1,0,0,0,0|1,0,0]=2 2803 B14R1.159 O=C(O)CNCCc1ccccc1F 269956a_100016091260_100011713696 [0,1,0,0,0,0|1,0,0]=2 2804 B14R1.159 O=C(O)CNCCc1ccccc1O 269956a_100016091260_100000722297 [0,1,0,0,0,0|1,0,0]=2 2805 B14R1.159 O=C(O)CONCc1ccccc1Br 269956a_100000106656_100000184730 [0,1,0,0,0,0|2,0,0]=3 2806 B14R1.159 O=C(O)CONCc1ccccc1Cl 269956a_100000106656_100000187162 [0,1,0,0,0,0|2,0,0]=3 2807 B14R1.159 O=C(O)CONCc1ccccc1F 269956a_100000106656_100000187165 [0,1,0,0,0,0|2,0,0]=3 2808 B14R1.159 O=C(O)CONCc1ccccc1I 269956a_100000106656_100011216222 [0,1,0,0,0,0|2,0,0]=3 2809 B14R1.159 O=C(O)CONCc1cccnc1Br 269956a_100000106656_100010140945 [0,1,0,0,0,0|3,0,0]=4 2810 B14R1.159 O=C(O)CONCc1cccnc1Cl 269956a_100000106656_100000045678 [0,1,0,0,0,0|3,0,0]=4 2811 B14R1.159 O=C(O)CONCc1cccnc1F 269956a_100000106656_100000099810 [0,1,0,0,0,0|3,0,0]=4 2812 B14R1.159 O=C(O)CONCc1ccncc1Cl 269956a_100000106656_100000763264 [0,1,0,0,0,0|3,0,0]=4 2813 B14R1.159 O=C(O)CONCc1ncccc1Br 269956a_100000106656_100025702911 [0,1,0,0,0,0|3,0,0]=4 2814 B14R1.159 O=C(O)CONCc1ncccc1Cl 269956a_100000106656_100000099807 [0,1,0,0,0,0|3,0,0]=4 2815 B14R1.159 O=C(O)CONCc1ncccc1F 269956a_100000106656_100000104219 [0,1,0,0,0,0|3,0,0]=4 2816 B14R1.159 O=C(O)CONCc1ncccc1O 269956a_100000106656_200020655725 [0,1,0,0,0,0|3,0,0]=4 2817 B14R1.159 O=C([O-])CNCCc1ccccc1Br 34a_100000747383_100020667443 [0,1,0,0,0,0|1,0,1]=3 2818 B14R1.159 O=C([O-])CNCCc1ccccc1Cl 34a_100011207228_100020667443 [0,1,0,0,0,0|1,0,1]=3 2819 B14R1.159 O=C([O-])CNCCc1ccccc1F 34a_100000185272_100020667443 [0,1,0,0,0,0|1,0,1]=3 2820 B14R1.159 O=C([O-])CNCCc1ccccc1O 34a_100011207237_100020667443 [0,1,0,0,0,0|1,0,1]=3 2821 B14R1.159 O=C([O-])COCCc1ccccc1Br 34a_100000731337_100020667443 [0,1,0,0,0,0|1,0,1]=3 2822 B14R1.159 O=C([O-])COCCc1ccccc1Cl 34a_100011215284_100020667443 [0,1,0,0,0,0|1,0,1]=3 2823 B14R1.159 O=C([O-])COCCc1ccccc1F 34a_100000753711_100020667443 [0,1,0,0,0,0|1,0,1]=3 2824 B14R1.159 O=C([O-])COCCc1ccccc1I 34a_100010255290_100020667443 [0,1,0,0,0,0|1,0,1]=3 2825 B14R1.159 O=C([O-])CSCCc1ccccc1Br 62a_100012161201_100020667443 [0,1,0,0,0,0|1,0,1]=3 2826 B14R1.159 O=C([O-])CSCCc1ccccc1Br 62a_100020667443_100012161201 [0,1,0,0,0,0|1,0,1]=3 2827 B14R1.159 O=C([O-])CSCCc1ccccc1Cl 62a_100011713703_100020667443 [0,1,0,0,0,0|1,0,1]=3 2828 B14R1.159 O=C([O-])CSCCc1ccccc1Cl 62a_100020667443_100011713703 [0,1,0,0,0,0|1,0,1]=3 2829 B14R1.159 O=C([O-])CSCCc1ccccc1F 62a_100011713696_100020667443 [0,1,0,0,0,0|1,0,1]=3 2830 B14R1.159 O=C([O-])CSCCc1ccccc1F 62a_100020667443_100011713696 [0,1,0,0,0,0|1,0,1]=3 2831 B14R1.159 O=C([O-])CSCCc1ccccc1O 62a_100000722297_100020667443 [0,1,0,0,0,0|1,0,1]=3 2832 B14R1.159 O=C([O-])CSCCc1ccccc1O 62a_100020667443_100000722297 [0,1,0,0,0,0|1,0,1]=3 2833 B14R1.159 O=[N+]([O-])CNCCc1ccccc1Br 34a_100000747383_100000761209 [0,1,0,0,0,0|2,0,1]=4 2834 B14R1.159 O=[N+]([O-])CNCCc1ccccc1Cl 34a_100011207228_100000761209 [0,1,0,0,0,0|2,0,1]=4 2835 B14R1.159 O=[N+]([O-])CNCCc1ccccc1F 34a_100000185272_100000761209 [0,1,0,0,0,0|2,0,1]=4 2836 B14R1.159 O=[N+]([O-])CNCCc1ccccc1O 34a_100011207237_100000761209 [0,1,0,0,0,0|2,0,1]=4 2837 B14R1.159 O=[N+]([O-])COCCc1ccccc1Br 34a_100000731337_100000761209 [0,1,0,0,0,0|2,0,1]=4 2838 B14R1.159 O=[N+]([O-])COCCc1ccccc1Cl 34a_100011215284_100000761209 [0,1,0,0,0,0|2,0,1]=4 2839 B14R1.159 O=[N+]([O-])COCCc1ccccc1F 34a_100000753711_100000761209 [0,1,0,0,0,0|2,0,1]=4 2840 B14R1.159 O=[N+]([O-])COCCc1ccccc1I 34a_100010255290_100000761209 [0,1,0,0,0,0|2,0,1]=4 2841 B14R1.159 O=[N+]([O-])CSCCc1ccccc1Br 62a_100012161201_100000761209 [0,1,0,0,0,0|2,0,1]=4 2842 B14R1.159 O=[N+]([O-])CSCCc1ccccc1Cl 62a_100011713703_100000761209 [0,1,0,0,0,0|2,0,1]=4 2843 B14R1.159 O=[N+]([O-])CSCCc1ccccc1F 62a_100011713696_100000761209 [0,1,0,0,0,0|2,0,1]=4 2844 B14R1.159 O=[N+]([O-])CSCCc1ccccc1O 62a_100000722297_100000761209 [0,1,0,0,0,0|2,0,1]=4 2845 B14R1.159 [13CH3]C(=O)CCCOc1ccccc1Cl 1458a_100000747900_200025704644 [0,1,0,0,0,0|2,0,0]=3 2846 B14R1.420 C=C(Br)CCOC(C)c1ccccc1 34a_100009813270_100000211855 [0,1,0,0,0,0|3,0,0]=4 2847 B14R1.420 C=C(C)CCN[C@H](C)c1ccccc1 2230a_100000751104_100000730704 [0,1,0,0,0,0|3,0,0]=4 2848 B14R1.420 C=C(C)CCOC(C)c1ccccc1 34a_100000764851_100000211855 [0,1,0,0,0,0|3,0,0]=4 2849 B14R1.420 C=C(C)CCO[C@H](C)c1ccccc1 34a_100000761318_100000730704 [0,1,0,0,0,0|3,0,0]=4 2850 B14R1.420 C=C(C)CCO[C@H](C)c1ccccc1 7a_100000761318_100000730704 [0,1,0,0,0,0|3,0,0]=4 2851 B14R1.420 C=C(C)CCSC(C)c1ccccc1 62a_100000230085_100000730704 [0,1,0,0,0,0|3,0,0]=4 2852 B14R1.420 C=C(C)CCSC(C)c1ccccc1 62a_100000730704_100000230085 [0,1,0,0,0,0|3,0,0]=4 2853 B14R1.420 C=C(C)CNCC(C)c1ccccc1 2230a_100000701038_100000748629 [0,1,0,0,0,0|3,0,0]=4 2854 B14R1.420 C=C(C)CNCC(C)c1ccccc1 34a_100000701038_100000748629 [0,1,0,0,0,0|3,0,0]=4 2855 B14R1.420 C=C(C)CNCC(O)c1ccccc1 2230a_100000210709_100000748629 [0,1,0,0,0,0|3,0,0]=4 2856 B14R1.420 C=C(C)COCC(C)c1ccccc1 34a_100000210245_100000756946 [0,1,0,0,0,0|3,0,0]=4 2857 B14R1.420 C=C(C)COCC(C)c1ccccc1 34a_100011215166_100000748629 [0,1,0,0,0,0|3,0,0]=4 2858 B14R1.420 C=C(C)COCC(C)c1ccccc1 7a_100011215166_100000748629 [0,1,0,0,0,0|3,0,0]=4 2859 B14R1.420 C=C(C)COCC(O)c1ccccc1 34a_100000210245_100000185958 [0,1,0,0,0,0|3,0,0]=4 2860 B14R1.420 C=C(C)COC[C@@H](N)c1ccccc1 34a_100000751927_100000748629 [0,1,0,0,0,0|3,0,0]=4 2861 B14R1.420 C=C(C)COC[C@@H](O)c1ccccc1 34a_100000210245_100011933945 [0,1,0,0,0,0|3,0,0]=4 2862 B14R1.420 C=C(C)CSCC(C)c1ccccc1 62a_100000748629_100000756946 [0,1,0,0,0,0|3,0,0]=4 2863 B14R1.420 C=C(C)CSCC(C)c1ccccc1 62a_100000756946_100000211660 [0,1,0,0,0,0|3,0,0]=4 2864 B14R1.420 C=C(C)CSCC(O)c1ccccc1 62a_100000185958_100000211660 [0,1,0,0,0,0|3,0,0]=4 2865 B14R1.420 C=C(C)CSCC(O)c1ccccc1 62a_100000748629_100000185958 [0,1,0,0,0,0|3,0,0]=4 2866 B14R1.420 C=C(C)CSC[C@@H](O)c1ccccc1 62a_100000748629_100011933945 [0,1,0,0,0,0|3,0,0]=4 2867 B14R1.420 C=C(C)CSC[C@@H](O)c1ccccc1 62a_100011933945_100000211660 [0,1,0,0,0,0|3,0,0]=4 2868 B14R1.420 C=C(CCCC(=O)C)c1ccccc1 1458a_200009911520_200000210301 [0,1,0,0,0,0|1,0,1]=3 2869 B14R1.420 C=C(CCCC(=O)[13CH3])c1ccccc1 1458a_200009911520_200025704644 [0,1,0,0,0,0|1,0,1]=3 2870 B14R1.420 C=C(F)CNCC(C)c1ccccc1 2230a_100000701038_100009893438 [0,1,0,0,0,0|3,0,0]=4 2871 B14R1.420 C=C(F)CNCC(C)c1ccccc1 34a_100000701038_100009893438 [0,1,0,0,0,0|3,0,0]=4 2872 B14R1.420 C=C(F)CNCC(O)c1ccccc1 2230a_100000210709_100009893438 [0,1,0,0,0,0|3,0,0]=4 2873 B14R1.420 C=C(F)COCC(C)c1ccccc1 34a_100011215166_100009893438 [0,1,0,0,0,0|3,0,0]=4 2874 B14R1.420 C=C(F)COCC(C)c1ccccc1 34a_200010262243_100000756946 [0,1,0,0,0,0|3,0,0]=4 2875 B14R1.420 C=C(F)COCC(C)c1ccccc1 7a_100011215166_100000042424 [0,1,0,0,0,0|3,0,0]=4 2876 B14R1.420 C=C(F)COCC(O)c1ccccc1 34a_200010262243_100000185958 [0,1,0,0,0,0|3,0,0]=4 2877 B14R1.420 C=C(F)COC[C@@H](N)c1ccccc1 34a_100000751927_100009893438 [0,1,0,0,0,0|3,0,0]=4 2878 B14R1.420 C=C(F)COC[C@@H](O)c1ccccc1 34a_200010262243_100011933945 [0,1,0,0,0,0|3,0,0]=4 2879 B14R1.420 C=C(F)CSCC(C)c1ccccc1 62a_100000042424_100000756946 [0,1,0,0,0,0|3,0,0]=4 2880 B14R1.420 C=C(F)CSCC(C)c1ccccc1 62a_100000756946_100000042424 [0,1,0,0,0,0|3,0,0]=4 2881 B14R1.420 C=C(F)CSCC(O)c1ccccc1 62a_100000042424_100000185958 [0,1,0,0,0,0|3,0,0]=4 2882 B14R1.420 C=C(F)CSCC(O)c1ccccc1 62a_100000185958_100000042424 [0,1,0,0,0,0|3,0,0]=4 2883 B14R1.420 C=C(F)CSC[C@@H](O)c1ccccc1 62a_100000042424_100011933945 [0,1,0,0,0,0|3,0,0]=4 2884 B14R1.420 C=C(F)CSC[C@@H](O)c1ccccc1 62a_100011933945_100000042424 [0,1,0,0,0,0|3,0,0]=4 2885 B14R1.420 CC(=O)CCCC(=O)c1ccccc1 1458a_100000070787_100000211006 [0,1,0,0,0,0|1,0,1]=3 2886 B14R1.420 CC(=O)CCCC(=O)c1ccccc1 1458a_100000185807_100011215641 [0,1,0,0,0,0|1,0,1]=3 2887 B14R1.420 CC(=O)CCCN(C)c1ccccc1 269982a_100000210012_100011215641 [0,1,0,0,0,0|2,0,0]=3 2888 B14R1.420 CC(=O)CCCN(C)c1ccccc1 34a_100000210012_100000685027 [0,1,0,0,0,0|2,0,0]=3 2889 B14R1.420 CC(=O)CCNC(=O)c1ccccc1 1458a_100000070787_200011215302 [0,1,0,0,0,0|2,0,1]=4 2890 B14R1.420 CC(=O)CCNC(=O)c1ccccc1 1458a_100000182757_200000210301 [0,1,0,0,0,0|2,0,1]=4 2891 B14R1.420 CC(=O)CCOC(=O)c1ccccc1 1458a_100000070787_100000184176 [0,1,0,0,0,0|2,0,1]=4 2892 B14R1.420 CC(=O)CCOC(C)c1ccccc1 34a_100000759926_100000211855 [0,1,0,0,0,0|2,0,0]=3 2893 B14R1.420 CC(=O)CCOC(C)c1ccccc1 7a_100000759926_100000230085 [0,1,0,0,0,0|2,0,0]=3 2894 B14R1.420 CC(=O)CCO[C@H](C)c1ccccc1 7a_100000761318_100000053229 [0,1,0,0,0,0|2,0,0]=3 2895 B14R1.420 CC(=O)CCSC(C)c1ccccc1 62a_100000053229_100000230085 [0,1,0,0,0,0|2,0,0]=3 2896 B14R1.420 CC(=O)CCSC(C)c1ccccc1 62a_100000230085_100000053229 [0,1,0,0,0,0|2,0,0]=3 2897 B14R1.420 CC(=O)COCC(C)c1ccccc1 34a_100000211253_100000756946 [0,1,0,0,0,0|2,0,0]=3 2898 B14R1.420 CC(=O)COCC(O)c1ccccc1 34a_100000211253_100000185958 [0,1,0,0,0,0|2,0,0]=3 2899 B14R1.420 CC(=O)COC[C@@H](O)c1ccccc1 34a_100000211253_100011933945 [0,1,0,0,0,0|2,0,0]=3 2900 B14R1.420 CC(=O)NCCC(=O)c1ccccc1 1458a_100000185807_100000189650 [0,1,0,0,0,0|2,0,1]=4 2901 B14R1.420 CC(=O)NCCC(O)c1ccccc1 240690a_100000763605_100015343762 [0,1,0,0,0,0|2,0,0]=3 2902 B14R1.420 CC(=O)NCCC(O)c1ccccc1 527a_100000763605_100103153847 [0,1,0,0,0,0|2,0,0]=3 2903 B14R1.420 CC(=O)NCCN(C)c1ccccc1 2230a_100000210012_100000189650 [0,1,0,0,0,0|3,0,0]=4 2904 B14R1.420 CC(=O)NCCN(C)c1ccccc1 240690a_100000231046_100015343762 [0,1,0,0,0,0|3,0,0]=4 2905 B14R1.420 CC(=O)NCCN(C)c1ccccc1 269982a_100000210012_100000189650 [0,1,0,0,0,0|3,0,0]=4 2906 B14R1.420 CC(=O)NCCN(C)c1ccccc1 527a_100000231046_100103153847 [0,1,0,0,0,0|3,0,0]=4 2907 B14R1.420 CC(=O)OCCC(=O)c1ccccc1 1458a_100000185807_100009814007 [0,1,0,0,0,0|2,0,1]=4 2908 B14R1.420 CC(=O)OCCN(C)c1ccccc1 269982a_100000210012_100009814007 [0,1,0,0,0,0|3,0,0]=4 2909 B14R1.420 CC(=O)OCCN(C)c1ccccc1 34a_100000210012_100009814007 [0,1,0,0,0,0|3,0,0]=4 2910 B14R1.420 CC(=O)OCO[C@H](C)c1ccccc1 34a_100000761318_100009813279 [0,1,0,0,0,0|3,0,0]=4 2911 B14R1.420 CC(=O)OCSC(C)c1ccccc1 62a_100000076356_100000230085 [0,1,0,0,0,0|3,0,0]=4 2912 B14R1.420 CC(=O)OCSC(C)c1ccccc1 62a_100000230085_100000076356 [0,1,0,0,0,0|3,0,0]=4 2913 B14R1.420 CC(CNCC(=O)N)c1ccccc1 2230a_100000701038_100000747473 [0,1,0,0,0,0|2,0,0]=3 2914 B14R1.420 CC(CNCC(=O)N)c1ccccc1 2230a_100000711301_100000756946 [0,1,0,0,0,0|2,0,0]=3 2915 B14R1.420 CC(CNCC(=O)N)c1ccccc1 34a_100000701038_100000187820 [0,1,0,0,0,0|2,0,0]=3 2916 B14R1.420 CC(CNCC(=O)O)c1ccccc1 269956a_100016091260_100000756946 [0,1,0,0,0,0|1,0,0]=2 2917 B14R1.420 CC(CNCC(=O)[O-])c1ccccc1 34a_100000701038_100020667443 [0,1,0,0,0,0|1,0,1]=3 2918 B14R1.420 CC(CNC[C@@H](C)O)c1ccccc1 2230a_100000701038_100009817552 [0,1,0,0,0,0|2,0,1]=4 2919 B14R1.420 CC(CNC[C@@H](C)O)c1ccccc1 34a_100000701038_100009817552 [0,1,0,0,0,0|2,0,1]=4 2920 B14R1.420 CC(CNC[N+](=O)[O-])c1ccccc1 34a_100000701038_100000761209 [0,1,0,0,0,0|2,0,1]=4 2921 B14R1.420 CC(COCC(=O)N)c1ccccc1 34a_100011215166_100000187820 [0,1,0,0,0,0|2,0,0]=3 2922 B14R1.420 CC(COCC(=O)N)c1ccccc1 7a_100011215166_100000187820 [0,1,0,0,0,0|2,0,0]=3 2923 B14R1.420 CC(COCC(=O)[O-])c1ccccc1 34a_100011215166_100020667443 [0,1,0,0,0,0|1,0,1]=3 2924 B14R1.420 CC(COC[C@@H](C)O)c1ccccc1 34a_100011215166_100009817552 [0,1,0,0,0,0|2,0,1]=4 2925 B14R1.420 CC(COC[C@@H](C)O)c1ccccc1 7a_100011215166_100009817552 [0,1,0,0,0,0|2,0,1]=4 2926 B14R1.420 CC(COC[N+](=O)[O-])c1ccccc1 34a_100011215166_100000761209 [0,1,0,0,0,0|2,0,1]=4 2927 B14R1.420 CC(CSCC(=O)N)c1ccccc1 62a_100000747473_100000756946 [0,1,0,0,0,0|2,0,0]=3 2928 B14R1.420 CC(CSCC(=O)N)c1ccccc1 62a_100000756946_100000747473 [0,1,0,0,0,0|2,0,0]=3 2929 B14R1.420 CC(CSCC(=O)[O-])c1ccccc1 62a_100000756946_100020667443 [0,1,0,0,0,0|1,0,1]=3 2930 B14R1.420 CC(CSCC(=O)[O-])c1ccccc1 62a_100020667443_100000756946 [0,1,0,0,0,0|1,0,1]=3 2931 B14R1.420 CC(CSC[C@@H](C)O)c1ccccc1 62a_100000756946_100009817552 [0,1,0,0,0,0|2,0,1]=4 2932 B14R1.420 CC(CSC[C@@H](C)O)c1ccccc1 62a_100009817552_100000756946 [0,1,0,0,0,0|2,0,1]=4 2933 B14R1.420 CC(CSC[N+](=O)[O-])c1ccccc1 62a_100000756946_100000761209 [0,1,0,0,0,0|2,0,1]=4 2934 B14R1.420 CC(NCCC(=O)N)c1ccccc1 269862a_100000740010_100000185851 [0,1,0,0,0,0|2,0,0]=3 2935 B14R1.420 CC(NCCC(=O)N)c1ccccn1 2230a_100000181244_100000744528 [0,1,0,0,0,0|3,0,0]=4 2936 B14R1.420 CC(NCCC(=O)N)c1ccccn1 269862a_100000740010_100000210467 [0,1,0,0,0,0|3,0,0]=4 2937 B14R1.420 CC(NCCC(=O)N)c1cccnc1 2230a_100000195435_100000744528 [0,1,0,0,0,0|3,0,0]=4 2938 B14R1.420 CC(NCCC(=O)N)c1cccnc1 269862a_100000740010_100000210468 [0,1,0,0,0,0|3,0,0]=4 2939 B14R1.420 CC(NCCC(=O)N)c1ccncc1 2230a_100000181269_100000744528 [0,1,0,0,0,0|3,0,0]=4 2940 B14R1.420 CC(NCCC(=O)N)c1ccncc1 269862a_100000740010_100000185792 [0,1,0,0,0,0|3,0,0]=4 2941 B14R1.420 CC(NOCC(=O)O)c1ccccc1 269956a_100000106656_100000211855 [0,1,0,0,0,0|2,0,0]=3 2942 B14R1.420 CC(O)CCCC(=O)c1ccccc1 1458a_100000185807_200000718107 [0,1,0,0,0,0|1,0,2]=4 2943 B14R1.420 CC(O)CCCN(C)c1ccccc1 2230a_100000210012_200000718107 [0,1,0,0,0,0|2,0,1]=4 2944 B14R1.420 CC(O)CCCN(C)c1ccccc1 269982a_100000210012_200000718107 [0,1,0,0,0,0|2,0,1]=4 2945 B14R1.420 CC(O)CCCN(C)c1ccccc1 34a_100000210012_200000718107 [0,1,0,0,0,0|2,0,1]=4 2946 B14R1.420 CC(O)CCNC(C)c1ccccc1 2230a_200000755665_100000230085 [0,1,0,0,0,0|2,0,1]=4 2947 B14R1.420 CC(O)CCNC(C)c1ccccc1 269862a_200000755665_100000185851 [0,1,0,0,0,0|2,0,1]=4 2948 B14R1.420 CC(O)CCN[C@H](C)c1ccccc1 2230a_100000751104_100012276601 [0,1,0,0,0,0|2,0,1]=4 2949 B14R1.420 CC(O)CCO[C@H](C)c1ccccc1 34a_100000761318_100012276601 [0,1,0,0,0,0|2,0,1]=4 2950 B14R1.420 CC(O)CCO[C@H](C)c1ccccc1 7a_100000761318_100012276601 [0,1,0,0,0,0|2,0,1]=4 2951 B14R1.420 CC(O)CCSC(C)c1ccccc1 62a_100000230085_100012276601 [0,1,0,0,0,0|2,0,1]=4 2952 B14R1.420 CC(O)CCSC(C)c1ccccc1 62a_100012276601_100000230085 [0,1,0,0,0,0|2,0,1]=4 2953 B14R1.420 CC(O)CNCC(C)c1ccccc1 2230a_100000210904_100000756946 [0,1,0,0,0,0|2,0,1]=4 2954 B14R1.420 CC(O)CNCC(C)c1ccccc1 2230a_100000701038_100011218427 [0,1,0,0,0,0|2,0,1]=4 2955 B14R1.420 CC(O)CNCC(C)c1ccccc1 270004a_100000210904_100000212034 [0,1,0,0,0,0|2,0,1]=4 2956 B14R1.420 CC(O)CNCC(C)c1ccccc1 34a_100000210904_100000756946 [0,1,0,0,0,0|2,0,1]=4 2957 B14R1.420 CC(O)CNCC(C)c1ccccc1 34a_100000701038_100011218427 [0,1,0,0,0,0|2,0,1]=4 2958 B14R1.420 CC(O)CNCC(O)c1ccccc1 2230a_100000210709_100011218427 [0,1,0,0,0,0|2,0,1]=4 2959 B14R1.420 CC(O)CNCC(O)c1ccccc1 2230a_100000210904_100000185958 [0,1,0,0,0,0|2,0,1]=4 2960 B14R1.420 CC(O)CNCC(O)c1ccccc1 34a_100000210904_100000185958 [0,1,0,0,0,0|2,0,1]=4 2961 B14R1.420 CC(O)CNC[C@@H](O)c1ccccc1 2230a_100000210904_100011933945 [0,1,0,0,0,0|2,0,1]=4 2962 B14R1.420 CC(O)CNC[C@@H](O)c1ccccc1 34a_100000210904_100011933945 [0,1,0,0,0,0|2,0,1]=4 2963 B14R1.420 CC(O)COCC(C)c1ccccc1 34a_100011215166_100011218427 [0,1,0,0,0,0|2,0,1]=4 2964 B14R1.420 CC(O)COCC(C)c1ccccc1 7a_100011215166_100011218427 [0,1,0,0,0,0|2,0,1]=4 2965 B14R1.420 CC(O)COC[C@@H](N)c1ccccc1 34a_100000751927_100011218427 [0,1,0,0,0,0|2,0,1]=4 2966 B14R1.420 CC(O)CSCC(C)c1ccccc1 62a_100000756946_100011218427 [0,1,0,0,0,0|2,0,1]=4 2967 B14R1.420 CC(O)CSCC(C)c1ccccc1 62a_100011218427_100000756946 [0,1,0,0,0,0|2,0,1]=4 2968 B14R1.420 CC(O)CSCC(O)c1ccccc1 62a_100000185958_100011218427 [0,1,0,0,0,0|2,0,1]=4 2969 B14R1.420 CC(O)CSCC(O)c1ccccc1 62a_100011218427_100000185958 [0,1,0,0,0,0|2,0,1]=4 2970 B14R1.420 CC(O)CSC[C@@H](O)c1ccccc1 62a_100011218427_100011933945 [0,1,0,0,0,0|2,0,1]=4 2971 B14R1.420 CC(O)CSC[C@@H](O)c1ccccc1 62a_100011933945_100011218427 [0,1,0,0,0,0|2,0,1]=4 2972 B14R1.420 CC(OCCC(=O)N)c1ccccc1 34a_100000757172_100000211855 [0,1,0,0,0,0|2,0,0]=3 2973 B14R1.420 CC(OCCC(=O)N)c1ccccc1 7a_100000757172_100000230085 [0,1,0,0,0,0|2,0,0]=3 2974 B14R1.420 CC(SCCC(=O)N)c1ccccc1 62a_100000230085_100000744528 [0,1,0,0,0,0|2,0,0]=3 2975 B14R1.420 CC(SCCC(=O)N)c1ccccc1 62a_100000744528_100000230085 [0,1,0,0,0,0|2,0,0]=3 2976 B14R1.420 CN(CCCC(=O)N)c1ccccc1 269982a_100000210012_100102525003 [0,1,0,0,0,0|2,0,0]=3 2977 B14R1.420 CN(CCCC(=O)N)c1ccccc1 34a_100000210012_100102525003 [0,1,0,0,0,0|2,0,0]=3 2978 B14R1.420 CN(CCNC(=O)N)c1ccccc1 2230a_100000210012_200000034859 [0,1,0,0,0,0|3,0,0]=4 2979 B14R1.420 CN(CCNC(=O)N)c1ccccc1 269982a_100000210012_200000034859 [0,1,0,0,0,0|3,0,0]=4 2980 B14R1.420 CN(CCOC(=O)N)c1ccccc1 269982a_100000210012_200011214921 [0,1,0,0,0,0|3,0,0]=4 2981 B14R1.420 CN(CCOC(=O)N)c1ccccc1 34a_100000210012_200011214921 [0,1,0,0,0,0|3,0,0]=4 2982 B14R1.420 C[C@@H](NCCC(=O)N)c1ccccc1 2230a_100000751104_100000744528 [0,1,0,0,0,0|2,0,0]=3 2983 B14R1.420 C[C@@H](O)CNCC(O)c1ccccc1 2230a_100000210709_100009817552 [0,1,0,0,0,0|2,0,1]=4 2984 B14R1.420 C[C@@H](O)COC[C@@H](N)c1ccccc1 34a_100000751927_100009817552 [0,1,0,0,0,0|2,0,1]=4 2985 B14R1.420 C[C@@H](O)CSCC(O)c1ccccc1 62a_100000185958_100009817552 [0,1,0,0,0,0|2,0,1]=4 2986 B14R1.420 C[C@@H](O)CSCC(O)c1ccccc1 62a_100009817552_100000185958 [0,1,0,0,0,0|2,0,1]=4 2987 B14R1.420 C[C@@H](O)CSC[C@@H](O)c1ccccc1 62a_100009817552_100011933945 [0,1,0,0,0,0|2,0,1]=4 2988 B14R1.420 C[C@@H](O)CSC[C@@H](O)c1ccccc1 62a_100011933945_100009817552 [0,1,0,0,0,0|2,0,1]=4 2989 B14R1.420 C[C@@H](OCCC(=O)N)c1ccccc1 34a_100000761318_100000731001 [0,1,0,0,0,0|2,0,0]=3 2990 B14R1.420 C[C@@H](OCCC(=O)N)c1ccccc1 7a_100000761318_100000744528 [0,1,0,0,0,0|2,0,0]=3 2991 B14R1.420 NC(=O)CCCC(=O)c1ccccc1 1458a_100000185807_100102525003 [0,1,0,0,0,0|1,0,1]=3 2992 B14R1.420 NC(=O)CCNC(=O)c1ccccc1 11a_100000740010_100000185807 [0,1,0,0,0,0|2,0,1]=4 2993 B14R1.420 NC(=O)CCNC(=O)c1ccccc1 240690a_100000740010_100000185807 [0,1,0,0,0,0|2,0,1]=4 2994 B14R1.420 NC(=O)CCNC(=O)c1ccccc1 527a_100000740010_100000185807 [0,1,0,0,0,0|2,0,1]=4 2995 B14R1.420 NC(=O)CNCC(O)c1ccccc1 2230a_100000210709_100000747473 [0,1,0,0,0,0|2,0,0]=3 2996 B14R1.420 NC(=O)CNCC(O)c1ccccc1 2230a_100000711301_100000185958 [0,1,0,0,0,0|2,0,0]=3 2997 B14R1.420 NC(=O)CNCC(O)c1ccccn1 2230a_100000691469_100000747473 [0,1,0,0,0,0|3,0,0]=4 2998 B14R1.420 NC(=O)CNCC(O)c1cccnc1 2230a_100020605170_100000747473 [0,1,0,0,0,0|3,0,0]=4 2999 B14R1.420 NC(=O)CNC[C@@H](O)c1ccccc1 2230a_100000711301_100011933945 [0,1,0,0,0,0|2,0,0]=3 3000 B14R1.420 NC(=O)COC[C@@H](N)c1ccccc1 34a_100000751927_100000187820 [0,1,0,0,0,0|2,0,0]=3 3001 B14R1.420 NC(=O)COC[C@@H](N)c1ccncc1 34a_100138412524_100000187820 [0,1,0,0,0,0|3,0,0]=4 3002 B14R1.420 NC(=O)CSCC(=O)c1ccccc1 62a_100000211460_100000747473 [0,1,0,0,0,0|2,0,1]=4 3003 B14R1.420 NC(=O)CSCC(=O)c1ccccc1 62a_100000747473_100000211460 [0,1,0,0,0,0|2,0,1]=4 3004 B14R1.420 NC(=O)CSCC(O)c1ccccc1 62a_100000185958_100000747473 [0,1,0,0,0,0|2,0,0]=3 3005 B14R1.420 NC(=O)CSCC(O)c1ccccc1 62a_100000747473_100000185958 [0,1,0,0,0,0|2,0,0]=3 3006 B14R1.420 NC(=O)CSCS(=O)c1ccccc1 62a_100000747473_100000031784 [0,1,0,0,0,0|3,0,0]=4 3007 B14R1.420 NC(=O)CSC[C@@H](O)c1ccccc1 62a_100000747473_100011933945 [0,1,0,0,0,0|2,0,0]=3 3008 B14R1.420 NC(=O)CSC[C@@H](O)c1ccccc1 62a_100011933945_100000747473 [0,1,0,0,0,0|2,0,0]=3 3009 B14R1.420 NC(=O)NCCC(=O)c1ccccc1 1458a_100000185807_200000034859 [0,1,0,0,0,0|2,0,1]=4 3010 B14R1.420 NC(=O)OCCC(=O)c1ccccc1 1458a_100000185807_200011214921 [0,1,0,0,0,0|2,0,1]=4 3011 B14R1.420 N[C@H](COCC(=O)[O-])c1ccccc1 34a_100000751927_100020667443 [0,1,0,0,0,0|1,0,1]=3 3012 B14R1.420 N[C@H](COCC(=O)[O-])c1ccncc1 34a_100138412524_100020667443 [0,1,0,0,0,0|2,0,1]=4 3013 B14R1.420 N[C@H](COC[N+](=O)[O-])c1ccccc1 34a_100000751927_100000761209 [0,1,0,0,0,0|2,0,1]=4 3014 B14R1.420 O=C(O)CNCC(=O)c1ccccc1 269956a_100016091260_100000211460 [0,1,0,0,0,0|1,0,1]=3 3015 B14R1.420 O=C(O)CNCC(=O)c1ccccn1 269956a_100016091260_100000027445 [0,1,0,0,0,0|2,0,1]=4 3016 B14R1.420 O=C(O)CNCC(=O)c1cccnc1 269956a_100016091260_100000757877 [0,1,0,0,0,0|2,0,1]=4 3017 B14R1.420 O=C(O)CNCC(=O)c1ccncc1 269956a_100016091260_100000027454 [0,1,0,0,0,0|2,0,1]=4 3018 B14R1.420 O=C(O)CNCC(O)c1ccccc1 269956a_100016091260_100000185958 [0,1,0,0,0,0|1,0,0]=2 3019 B14R1.420 O=C(O)CNCS(=O)c1ccccc1 269956a_100016091260_100000031784 [0,1,0,0,0,0|2,0,0]=3 3020 B14R1.420 O=C(O)CNC[C@@H](O)c1ccccc1 269956a_100016091260_100011933945 [0,1,0,0,0,0|1,0,0]=2 3021 B14R1.420 O=C([O-])CSCC(=O)c1ccccc1 62a_100000211460_100020667443 [0,1,0,0,0,0|1,0,2]=4 3022 B14R1.420 O=C([O-])CSCC(=O)c1ccccc1 62a_100020667443_100000211460 [0,1,0,0,0,0|1,0,2]=4 3023 B14R1.420 O=C([O-])CSCC(O)c1ccccc1 62a_100000185958_100020667443 [0,1,0,0,0,0|1,0,1]=3 3024 B14R1.420 O=C([O-])CSCC(O)c1ccccc1 62a_100020667443_100000185958 [0,1,0,0,0,0|1,0,1]=3 3025 B14R1.420 O=C([O-])CSCS(=O)c1ccccc1 62a_100020667443_100000031784 [0,1,0,0,0,0|2,0,1]=4 3026 B14R1.420 O=C([O-])CSC[C@@H](O)c1ccccc1 62a_100011933945_100020667443 [0,1,0,0,0,0|1,0,1]=3 3027 B14R1.420 O=C([O-])CSC[C@@H](O)c1ccccc1 62a_100020667443_100011933945 [0,1,0,0,0,0|1,0,1]=3 3028 B14R1.420 O=[N+]([O-])CSCC(O)c1ccccc1 62a_100000185958_100000761209 [0,1,0,0,0,0|2,0,1]=4 3029 B14R1.420 O=[N+]([O-])CSC[C@@H](O)c1ccccc1 62a_100011933945_100000761209 [0,1,0,0,0,0|2,0,1]=4 3030 B14R1.420 [13CH3]C(=O)CCNC(=O)c1ccccc1 1458a_100000182757_200025704644 [0,1,0,0,0,0|2,0,1]=4 3031 B14R1.423 C=C(C)CCC(=O)Cc1ccccc1 1458a_200000688413_100015291786 [0,1,0,0,0,0|2,0,1]=4 3032 B14R1.423 C=C(C)CCN(C)Cc1ccccc1 2230a_100000186898_100000730704 [0,1,0,0,0,0|3,0,0]=4 3033 B14R1.423 C=C(C)CCN(C)Cc1ccccc1 269982a_100000186898_100000730704 [0,1,0,0,0,0|3,0,0]=4 3034 B14R1.423 C=C(C)COC(C)Cc1ccccc1 34a_100000210245_200011218536 [0,1,0,0,0,0|3,0,0]=4 3035 B14R1.423 C=C(C)COC(C)Cc1ccccc1 34a_100000748627_100000748629 [0,1,0,0,0,0|3,0,0]=4 3036 B14R1.423 C=C(C)COC(C)Cc1ccccc1 7a_100000748627_100000748629 [0,1,0,0,0,0|3,0,0]=4 3037 B14R1.423 C=C(C)CSC(C)Cc1ccccc1 62a_100000748629_200011218536 [0,1,0,0,0,0|3,0,0]=4 3038 B14R1.423 C=C(C)CSC(C)Cc1ccccc1 62a_200011218536_100000211660 [0,1,0,0,0,0|3,0,0]=4 3039 B14R1.423 C=C(F)COC(C)Cc1ccccc1 34a_100000748627_100009893438 [0,1,0,0,0,0|3,0,0]=4 3040 B14R1.423 C=C(F)COC(C)Cc1ccccc1 34a_200010262243_200011218536 [0,1,0,0,0,0|3,0,0]=4 3041 B14R1.423 C=C(F)COC(C)Cc1ccccc1 7a_100000748627_100000042424 [0,1,0,0,0,0|3,0,0]=4 3042 B14R1.423 C=C(F)CSC(C)Cc1ccccc1 62a_100000042424_200011218536 [0,1,0,0,0,0|3,0,0]=4 3043 B14R1.423 C=C(F)CSC(C)Cc1ccccc1 62a_200011218536_100000042424 [0,1,0,0,0,0|3,0,0]=4 3044 B14R1.423 CC(=O)CCC(=O)Nc1ccccc1 1458a_100000070787_100000242058 [0,1,0,0,0,0|2,0,1]=4 3045 B14R1.423 CC(=O)CCC(=O)Nc1ccccc1 1458a_100000180958_200000210301 [0,1,0,0,0,0|2,0,1]=4 3046 B14R1.423 CC(=O)CCC(=O)Oc1ccccc1 1458a_100000070787_200000035796 [0,1,0,0,0,0|2,0,1]=4 3047 B14R1.423 CC(=O)CCN(C)Cc1ccccc1 1458a_100000070787_100015196923 [0,1,0,0,0,0|2,0,0]=3 3048 B14R1.423 CC(=O)CCN(C)Cc1ccccc1 1458a_100000177486_200000210301 [0,1,0,0,0,0|2,0,0]=3 3049 B14R1.423 CC(=O)CCN(C)Cc1ccccc1 269982a_100000186898_100000053229 [0,1,0,0,0,0|2,0,0]=3 3050 B14R1.423 CC(=O)CCN(C)Cc1ccccn1 269982a_100000207498_100000053229 [0,1,0,0,0,0|3,0,0]=4 3051 B14R1.423 CC(=O)CCN(C)Cc1cccnc1 269982a_100000184577_100000053229 [0,1,0,0,0,0|3,0,0]=4 3052 B14R1.423 CC(=O)CCN(C)Cc1ccncc1 269982a_100000187231_100000053229 [0,1,0,0,0,0|3,0,0]=4 3053 B14R1.423 CC(=O)CNC(=O)Cc1ccccc1 1458a_100000184600_200000210301 [0,1,0,0,0,0|2,0,1]=4 3054 B14R1.423 CC(=O)COC(C)Cc1ccccc1 34a_100000211253_200011218536 [0,1,0,0,0,0|2,0,0]=3 3055 B14R1.423 CC(=O)NCC(=O)Cc1ccccc1 1458a_100000194580_100015291786 [0,1,0,0,0,0|2,0,1]=4 3056 B14R1.423 CC(=O)NCC(C)Oc1ccccc1 11a_100000755676_100015343762 [0,1,0,0,0,0|3,0,0]=4 3057 B14R1.423 CC(=O)NCC(C)Oc1ccccc1 1626a_100000755676_100015343762 [0,1,0,0,0,0|3,0,0]=4 3058 B14R1.423 CC(=O)NCC(C)Oc1ccccc1 240690a_100000755676_100015343762 [0,1,0,0,0,0|3,0,0]=4 3059 B14R1.423 CC(=O)NCC(C)Oc1ccccc1 527a_100000755676_100103153847 [0,1,0,0,0,0|3,0,0]=4 3060 B14R1.423 CC(=O)NCC(O)Cc1ccccc1 240690a_100000752270_100015343762 [0,1,0,0,0,0|2,0,0]=3 3061 B14R1.423 CC(=O)NCC(O)Cc1ccccc1 527a_100000752270_100103153847 [0,1,0,0,0,0|2,0,0]=3 3062 B14R1.423 CC(=O)OCC(=O)Cc1ccccc1 1458a_100000183556_100015291786 [0,1,0,0,0,0|2,0,1]=4 3063 B14R1.423 CC(=O)OCN(C)Cc1ccccc1 269982a_100000186898_100000076356 [0,1,0,0,0,0|3,0,0]=4 3064 B14R1.423 CC(=O)SCC(=O)Cc1ccccc1 1458a_100000049016_100015291786 [0,1,0,0,0,0|2,0,1]=4 3065 B14R1.423 CC(Cc1ccccc1)NCC(=O)O 269956a_100016091260_200011218536 [0,1,0,0,0,0|1,0,0]=2 3066 B14R1.423 CC(Cc1ccccc1)OCC(=O)N 34a_100000748627_100000187820 [0,1,0,0,0,0|2,0,0]=3 3067 B14R1.423 CC(Cc1ccccc1)OCC(=O)N 7a_100000748627_100000187820 [0,1,0,0,0,0|2,0,0]=3 3068 B14R1.423 CC(Cc1ccccc1)OCC(=O)[O-] 34a_100000748627_100020667443 [0,1,0,0,0,0|1,0,1]=3 3069 B14R1.423 CC(Cc1ccccc1)OC[C@@H](C)O 34a_100000748627_100009817552 [0,1,0,0,0,0|2,0,1]=4 3070 B14R1.423 CC(Cc1ccccc1)OC[C@@H](C)O 7a_100000748627_100009817552 [0,1,0,0,0,0|2,0,1]=4 3071 B14R1.423 CC(Cc1ccccc1)OC[N+](=O)[O-] 34a_100000748627_100000761209 [0,1,0,0,0,0|2,0,1]=4 3072 B14R1.423 CC(Cc1ccccc1)SCC(=O)N 62a_100000747473_200011218536 [0,1,0,0,0,0|2,0,0]=3 3073 B14R1.423 CC(Cc1ccccc1)SCC(=O)N 62a_200011218536_100000747473 [0,1,0,0,0,0|2,0,0]=3 3074 B14R1.423 CC(Cc1ccccc1)SCC(=O)[O-] 62a_100020667443_200011218536 [0,1,0,0,0,0|1,0,1]=3 3075 B14R1.423 CC(Cc1ccccc1)SCC(=O)[O-] 62a_200011218536_100020667443 [0,1,0,0,0,0|1,0,1]=3 3076 B14R1.423 CC(Cc1ccccc1)SC[C@@H](C)O 62a_100009817552_200011218536 [0,1,0,0,0,0|2,0,1]=4 3077 B14R1.423 CC(Cc1ccccc1)SC[C@@H](C)O 62a_200011218536_100009817552 [0,1,0,0,0,0|2,0,1]=4 3078 B14R1.423 CC(Cc1ccccc1)SC[N+](=O)[O-] 62a_200011218536_100000761209 [0,1,0,0,0,0|2,0,1]=4 3079 B14R1.423 CC(Cc1ccccn1)NCC(=O)N 2230a_100000238496_100000747473 [0,1,0,0,0,0|3,0,0]=4 3080 B14R1.423 CC(Cc1cccnc1)NCC(=O)N 2230a_100011207255_100000747473 [0,1,0,0,0,0|3,0,0]=4 3081 B14R1.423 CC(O)CCN(C)Cc1ccccc1 2230a_100000186898_100012276601 [0,1,0,0,0,0|2,0,1]=4 3082 B14R1.423 CC(O)CCN(C)Cc1ccccc1 269982a_100000186898_100012276601 [0,1,0,0,0,0|2,0,1]=4 3083 B14R1.423 CC(O)CNC(C)Cc1ccccc1 34a_100000210904_200011218536 [0,1,0,0,0,0|2,0,1]=4 3084 B14R1.423 CC(O)COC(C)Cc1ccccc1 34a_100000748627_100011218427 [0,1,0,0,0,0|2,0,1]=4 3085 B14R1.423 CC(O)COC(C)Cc1ccccc1 7a_100000748627_100011218427 [0,1,0,0,0,0|2,0,1]=4 3086 B14R1.423 CC(O)CSC(C)Cc1ccccc1 62a_100011218427_200011218536 [0,1,0,0,0,0|2,0,1]=4 3087 B14R1.423 CC(O)CSC(C)Cc1ccccc1 62a_200011218536_100011218427 [0,1,0,0,0,0|2,0,1]=4 3088 B14R1.423 CN(CCC(=O)N)Cc1ccccc1 2230a_100000177509_200000210301 [0,1,0,0,0,0|2,0,0]=3 3089 B14R1.423 CN(CCC(=O)N)Cc1ccccc1 2230a_100000186898_100000744528 [0,1,0,0,0,0|2,0,0]=3 3090 B14R1.423 CN(CCC(=O)N)Cc1ccccc1 2230a_100000730477_100015291786 [0,1,0,0,0,0|2,0,0]=3 3091 B14R1.423 CN(CCC(=O)N)Cc1ccccc1 269982a_100000177509_200000210301 [0,1,0,0,0,0|2,0,0]=3 3092 B14R1.423 CN(CCC(=O)N)Cc1ccccc1 269982a_100000186898_100000744528 [0,1,0,0,0,0|2,0,0]=3 3093 B14R1.423 CN(CCC(=O)N)Cc1ccccc1 270004a_100000730477_100015611070 [0,1,0,0,0,0|2,0,0]=3 3094 B14R1.423 CN(CCC(=O)N)Cc1ccccn1 2230a_100000207498_100000744528 [0,1,0,0,0,0|3,0,0]=4 3095 B14R1.423 CN(CCC(=O)N)Cc1ccccn1 2230a_100000730477_100000721315 [0,1,0,0,0,0|3,0,0]=4 3096 B14R1.423 CN(CCC(=O)N)Cc1ccccn1 269982a_100000207498_100000744528 [0,1,0,0,0,0|3,0,0]=4 3097 B14R1.423 CN(CCC(=O)N)Cc1ccccn1 270004a_100000730477_100000209966 [0,1,0,0,0,0|3,0,0]=4 3098 B14R1.423 CN(CCC(=O)N)Cc1cccnc1 2230a_100000184577_100000744528 [0,1,0,0,0,0|3,0,0]=4 3099 B14R1.423 CN(CCC(=O)N)Cc1cccnc1 2230a_100000730477_100000741622 [0,1,0,0,0,0|3,0,0]=4 3100 B14R1.423 CN(CCC(=O)N)Cc1cccnc1 269982a_100000184577_100000744528 [0,1,0,0,0,0|3,0,0]=4 3101 B14R1.423 CN(CCC(=O)N)Cc1cccnc1 270004a_100000730477_100000209961 [0,1,0,0,0,0|3,0,0]=4 3102 B14R1.423 CN(CCC(=O)N)Cc1ccncc1 2230a_100000187231_100000744528 [0,1,0,0,0,0|3,0,0]=4 3103 B14R1.423 CN(CCC(=O)N)Cc1ccncc1 2230a_100000730477_100015193705 [0,1,0,0,0,0|3,0,0]=4 3104 B14R1.423 CN(CCC(=O)N)Cc1ccncc1 269982a_100000187231_100000744528 [0,1,0,0,0,0|3,0,0]=4 3105 B14R1.423 CN(CCC(=O)[13CH3])Cc1ccccc1 1458a_100000177486_200025704644 [0,1,0,0,0,0|2,0,0]=3 3106 B14R1.423 NC(=O)CCC(=O)Cc1ccccc1 1458a_100011215257_100015291786 [0,1,0,0,0,0|1,0,1]=3 3107 B14R1.423 NC(=O)CCC(=O)Cc1ccccn1 1458a_100011215257_100000721315 [0,1,0,0,0,0|2,0,1]=4 3108 B14R1.423 NC(=O)CCC(=O)Cc1cccnc1 1458a_100011215257_100000733263 [0,1,0,0,0,0|2,0,1]=4 3109 B14R1.423 NC(=O)CCC(=O)Cc1ccncc1 1458a_100011215257_100000705612 [0,1,0,0,0,0|2,0,1]=4 3110 B14R1.423 NC(=O)CCC(=O)Nc1ccccc1 22a_100000106764_100011215257 [0,1,0,0,0,0|2,0,1]=4 3111 B14R1.423 NC(=O)CCC(=O)Nc1ccccc1 527a_100000106764_100011215257 [0,1,0,0,0,0|2,0,1]=4 3112 B14R1.423 NC(=O)NCC(=O)Cc1ccccc1 1458a_100000184981_100015291786 [0,1,0,0,0,0|2,0,1]=4 3113 B14R1.423 O=C(CC[N+](=O)[O-])Cc1ccccc1 1458a_200000064761_100015291786 [0,1,0,0,0,0|1,0,2]=4 3114 B14R1.423 [13CH3]C(=O)CCC(=O)Nc1ccccc1 1458a_100000180958_200025704644 [0,1,0,0,0,0|2,0,1]=4 3115 B14R1.423 [13CH3]C(=O)CNC(=O)Cc1ccccc1 1458a_100000184600_200025704644 [0,1,0,0,0,0|2,0,1]=4 3116 B14R1.423 [13CH3]N(CCC(=O)N)Cc1ccccc1 2230a_100000177509_200025704644 [0,1,0,0,0,0|2,0,0]=3 3117 B14R1.423 [13CH3]N(CCC(=O)N)Cc1ccccc1 269982a_100000177509_200025704644 [0,1,0,0,0,0|2,0,0]=3 3118 B14R1.677 C=C(Br)CCOCc1ccc(cc1)Br 34a_100009813270_100000189115 [0,1,0,0,0,0|3,0,0]=4 3119 B14R1.677 C=C(Br)CCOCc1ccc(cc1)C 34a_100009813270_100000210814 [0,1,0,0,0,0|3,0,0]=4 3120 B14R1.677 C=C(Br)CCOCc1ccc(cc1)Cl 34a_100009813270_100000694040 [0,1,0,0,0,0|3,0,0]=4 3121 B14R1.677 C=C(Br)CCOCc1ccc(cc1)F 34a_100009813270_100000198546 [0,1,0,0,0,0|3,0,0]=4 3122 B14R1.677 C=C(Br)CCOCc1ccc(cc1)I 34a_100009813270_100000189116 [0,1,0,0,0,0|3,0,0]=4 3123 B14R1.677 C=C(C)CCNCc1ccc(cc1)Br 2230a_100000174875_100000730704 [0,1,0,0,0,0|3,0,0]=4 3124 B14R1.677 C=C(C)CCNCc1ccc(cc1)Br 34a_100000174875_100000730704 [0,1,0,0,0,0|3,0,0]=4 3125 B14R1.677 C=C(C)CCNCc1ccc(cc1)C 2230a_100000174908_100000730704 [0,1,0,0,0,0|3,0,0]=4 3126 B14R1.677 C=C(C)CCNCc1ccc(cc1)C 34a_100000174908_100000730704 [0,1,0,0,0,0|3,0,0]=4 3127 B14R1.677 C=C(C)CCNCc1ccc(cc1)Cl 2230a_100000174871_100000730704 [0,1,0,0,0,0|3,0,0]=4 3128 B14R1.677 C=C(C)CCNCc1ccc(cc1)Cl 34a_100000174871_100000730704 [0,1,0,0,0,0|3,0,0]=4 3129 B14R1.677 C=C(C)CCNCc1ccc(cc1)F 2230a_100000174882_100000730704 [0,1,0,0,0,0|3,0,0]=4 3130 B14R1.677 C=C(C)CCNCc1ccc(cc1)F 34a_100000174882_100000730704 [0,1,0,0,0,0|3,0,0]=4 3131 B14R1.677 C=C(C)CCNCc1ccc(cc1)I 2230a_100016989417_100000730704 [0,1,0,0,0,0|3,0,0]=4 3132 B14R1.677 C=C(C)CCNCc1ccc(cc1)I 34a_100016989417_100000730704 [0,1,0,0,0,0|3,0,0]=4 3133 B14R1.677 C=C(C)CCNCc1ccc(cc1)O 34a_100000185549_100000730704 [0,1,0,0,0,0|3,0,0]=4 3134 B14R1.677 C=C(C)CCOCc1ccc(cc1)Br 34a_100000695286_100000730704 [0,1,0,0,0,0|3,0,0]=4 3135 B14R1.677 C=C(C)CCOCc1ccc(cc1)Br 34a_100000764851_100000189115 [0,1,0,0,0,0|3,0,0]=4 3136 B14R1.677 C=C(C)CCOCc1ccc(cc1)C 34a_100000764851_100000210814 [0,1,0,0,0,0|3,0,0]=4 3137 B14R1.677 C=C(C)CCOCc1ccc(cc1)C 34a_100011215236_100000730704 [0,1,0,0,0,0|3,0,0]=4 3138 B14R1.677 C=C(C)CCOCc1ccc(cc1)C 7a_100011215236_100000730704 [0,1,0,0,0,0|3,0,0]=4 3139 B14R1.677 C=C(C)CCOCc1ccc(cc1)Cl 34a_100000211118_100000730704 [0,1,0,0,0,0|3,0,0]=4 3140 B14R1.677 C=C(C)CCOCc1ccc(cc1)Cl 34a_100000764851_100000694040 [0,1,0,0,0,0|3,0,0]=4 3141 B14R1.677 C=C(C)CCOCc1ccc(cc1)Cl 7a_100000211118_100000730704 [0,1,0,0,0,0|3,0,0]=4 3142 B14R1.677 C=C(C)CCOCc1ccc(cc1)F 34a_100000210977_100000730704 [0,1,0,0,0,0|3,0,0]=4 3143 B14R1.677 C=C(C)CCOCc1ccc(cc1)F 34a_100000764851_100000198546 [0,1,0,0,0,0|3,0,0]=4 3144 B14R1.677 C=C(C)CCOCc1ccc(cc1)F 7a_100000210977_100000730704 [0,1,0,0,0,0|3,0,0]=4 3145 B14R1.677 C=C(C)CCOCc1ccc(cc1)I 34a_100000690907_100000730704 [0,1,0,0,0,0|3,0,0]=4 3146 B14R1.677 C=C(C)CCOCc1ccc(cc1)I 34a_100000764851_100000189116 [0,1,0,0,0,0|3,0,0]=4 3147 B14R1.677 C=C(C)CCOCc1ccc(cc1)I 7a_100000690907_100000730704 [0,1,0,0,0,0|3,0,0]=4 3148 B14R1.677 C=C(C)CCOCc1ccc(cc1)N 34a_100011215238_100000730704 [0,1,0,0,0,0|3,0,0]=4 3149 B14R1.677 C=C(C)CCSCc1ccc(cc1)Br 62a_100000189115_100000730704 [0,1,0,0,0,0|3,0,0]=4 3150 B14R1.677 C=C(C)CCSCc1ccc(cc1)Br 62a_100000730704_100000189115 [0,1,0,0,0,0|3,0,0]=4 3151 B14R1.677 C=C(C)CCSCc1ccc(cc1)C 62a_100000210814_100000730704 [0,1,0,0,0,0|3,0,0]=4 3152 B14R1.677 C=C(C)CCSCc1ccc(cc1)C 62a_100000730704_100000210814 [0,1,0,0,0,0|3,0,0]=4 3153 B14R1.677 C=C(C)CCSCc1ccc(cc1)Cl 62a_100000187161_100000730704 [0,1,0,0,0,0|3,0,0]=4 3154 B14R1.677 C=C(C)CCSCc1ccc(cc1)Cl 62a_100000730704_100000187161 [0,1,0,0,0,0|3,0,0]=4 3155 B14R1.677 C=C(C)CCSCc1ccc(cc1)F 62a_100000198546_100000730704 [0,1,0,0,0,0|3,0,0]=4 3156 B14R1.677 C=C(C)CCSCc1ccc(cc1)F 62a_100000730704_100000187164 [0,1,0,0,0,0|3,0,0]=4 3157 B14R1.677 C=C(C)CCSCc1ccc(cc1)I 62a_100000189116_100000730704 [0,1,0,0,0,0|3,0,0]=4 3158 B14R1.677 C=C(C)CCSCc1ccc(cc1)I 62a_100000730704_100000189116 [0,1,0,0,0,0|3,0,0]=4 3159 B14R1.677 C=C(C)CNCCc1ccc(cc1)Br 2230a_100000755846_100000748629 [0,1,0,0,0,0|3,0,0]=4 3160 B14R1.677 C=C(C)CNCCc1ccc(cc1)Br 34a_100000755846_100000748629 [0,1,0,0,0,0|3,0,0]=4 3161 B14R1.677 C=C(C)CNCCc1ccc(cc1)C 2230a_100000705350_100000748629 [0,1,0,0,0,0|3,0,0]=4 3162 B14R1.677 C=C(C)CNCCc1ccc(cc1)C 34a_100000705350_100000748629 [0,1,0,0,0,0|3,0,0]=4 3163 B14R1.677 C=C(C)CNCCc1ccc(cc1)Cl 2230a_100000185265_100000748629 [0,1,0,0,0,0|3,0,0]=4 3164 B14R1.677 C=C(C)CNCCc1ccc(cc1)Cl 34a_100000185265_100000748629 [0,1,0,0,0,0|3,0,0]=4 3165 B14R1.677 C=C(C)CNCCc1ccc(cc1)F 2230a_100000199005_100000748629 [0,1,0,0,0,0|3,0,0]=4 3166 B14R1.677 C=C(C)CNCCc1ccc(cc1)F 34a_100000199005_100000748629 [0,1,0,0,0,0|3,0,0]=4 3167 B14R1.677 C=C(C)CNCCc1ccc(cc1)O 34a_100000743037_100000748629 [0,1,0,0,0,0|3,0,0]=4 3168 B14R1.677 C=C(C)COCCc1ccc(cc1)Br 34a_100000210245_100011740612 [0,1,0,0,0,0|3,0,0]=4 3169 B14R1.677 C=C(C)COCCc1ccc(cc1)Br 34a_100000766406_100000748629 [0,1,0,0,0,0|3,0,0]=4 3170 B14R1.677 C=C(C)COCCc1ccc(cc1)Br 7a_100000766406_100000748629 [0,1,0,0,0,0|3,0,0]=4 3171 B14R1.677 C=C(C)COCCc1ccc(cc1)C 34a_100000210245_100011713686 [0,1,0,0,0,0|3,0,0]=4 3172 B14R1.677 C=C(C)COCCc1ccc(cc1)C 34a_100000756670_100000748629 [0,1,0,0,0,0|3,0,0]=4 3173 B14R1.677 C=C(C)COCCc1ccc(cc1)C 7a_100000756670_100000748629 [0,1,0,0,0,0|3,0,0]=4 3174 B14R1.677 C=C(C)COCCc1ccc(cc1)Cl 34a_100000210245_100011713675 [0,1,0,0,0,0|3,0,0]=4 3175 B14R1.677 C=C(C)COCCc1ccc(cc1)Cl 34a_100011219627_100000748629 [0,1,0,0,0,0|3,0,0]=4 3176 B14R1.677 C=C(C)COCCc1ccc(cc1)Cl 7a_100011219627_100000748629 [0,1,0,0,0,0|3,0,0]=4 3177 B14R1.677 C=C(C)COCCc1ccc(cc1)F 34a_100000210245_100011217392 [0,1,0,0,0,0|3,0,0]=4 3178 B14R1.677 C=C(C)COCCc1ccc(cc1)F 34a_100000754732_100000748629 [0,1,0,0,0,0|3,0,0]=4 3179 B14R1.677 C=C(C)COCCc1ccc(cc1)F 7a_100000754732_100000748629 [0,1,0,0,0,0|3,0,0]=4 3180 B14R1.677 C=C(C)COCCc1ccc(cc1)I 34a_100012291149_100000748629 [0,1,0,0,0,0|3,0,0]=4 3181 B14R1.677 C=C(C)COCCc1ccc(cc1)I 7a_100012291149_100000748629 [0,1,0,0,0,0|3,0,0]=4 3182 B14R1.677 C=C(C)COCCc1ccc(cc1)N 34a_100011204434_100000748629 [0,1,0,0,0,0|3,0,0]=4 3183 B14R1.677 C=C(C)CSCCc1ccc(cc1)Br 62a_100000748629_100011740612 [0,1,0,0,0,0|3,0,0]=4 3184 B14R1.677 C=C(C)CSCCc1ccc(cc1)Br 62a_100011740612_100000211660 [0,1,0,0,0,0|3,0,0]=4 3185 B14R1.677 C=C(C)CSCCc1ccc(cc1)C 62a_100000748629_100011713686 [0,1,0,0,0,0|3,0,0]=4 3186 B14R1.677 C=C(C)CSCCc1ccc(cc1)C 62a_100011713686_100000211660 [0,1,0,0,0,0|3,0,0]=4 3187 B14R1.677 C=C(C)CSCCc1ccc(cc1)Cl 62a_100000748629_100011713675 [0,1,0,0,0,0|3,0,0]=4 3188 B14R1.677 C=C(C)CSCCc1ccc(cc1)Cl 62a_100011713675_100000211660 [0,1,0,0,0,0|3,0,0]=4 3189 B14R1.677 C=C(C)CSCCc1ccc(cc1)F 62a_100000748629_100011217392 [0,1,0,0,0,0|3,0,0]=4 3190 B14R1.677 C=C(C)CSCCc1ccc(cc1)F 62a_100011217392_100000211660 [0,1,0,0,0,0|3,0,0]=4 3191 B14R1.677 C=C(C)CSCCc1ccc(cc1)O 62a_100000748629_100009816426 [0,1,0,0,0,0|3,0,0]=4 3192 B14R1.677 C=C(C)CSCCc1ccc(cc1)O 62a_100009816426_100000211660 [0,1,0,0,0,0|3,0,0]=4 3193 B14R1.677 C=C(F)CNCCc1ccc(cc1)Br 2230a_100000755846_100009893438 [0,1,0,0,0,0|3,0,0]=4 3194 B14R1.677 C=C(F)CNCCc1ccc(cc1)Br 34a_100000755846_100009893438 [0,1,0,0,0,0|3,0,0]=4 3195 B14R1.677 C=C(F)CNCCc1ccc(cc1)C 2230a_100000705350_100009893438 [0,1,0,0,0,0|3,0,0]=4 3196 B14R1.677 C=C(F)CNCCc1ccc(cc1)C 34a_100000705350_100009893438 [0,1,0,0,0,0|3,0,0]=4 3197 B14R1.677 C=C(F)CNCCc1ccc(cc1)Cl 2230a_100000185265_100009893438 [0,1,0,0,0,0|3,0,0]=4 3198 B14R1.677 C=C(F)CNCCc1ccc(cc1)Cl 34a_100000185265_100009893438 [0,1,0,0,0,0|3,0,0]=4 3199 B14R1.677 C=C(F)CNCCc1ccc(cc1)F 2230a_100000199005_100009893438 [0,1,0,0,0,0|3,0,0]=4 3200 B14R1.677 C=C(F)CNCCc1ccc(cc1)F 34a_100000199005_100009893438 [0,1,0,0,0,0|3,0,0]=4 3201 B14R1.677 C=C(F)CNCCc1ccc(cc1)O 34a_100000743037_100009893438 [0,1,0,0,0,0|3,0,0]=4 3202 B14R1.677 C=C(F)COCCc1ccc(cc1)Br 34a_100000766406_100009893438 [0,1,0,0,0,0|3,0,0]=4 3203 B14R1.677 C=C(F)COCCc1ccc(cc1)Br 34a_200010262243_100011740612 [0,1,0,0,0,0|3,0,0]=4 3204 B14R1.677 C=C(F)COCCc1ccc(cc1)Br 7a_100000766406_100000042424 [0,1,0,0,0,0|3,0,0]=4 3205 B14R1.677 C=C(F)COCCc1ccc(cc1)C 34a_100000756670_100009893438 [0,1,0,0,0,0|3,0,0]=4 3206 B14R1.677 C=C(F)COCCc1ccc(cc1)C 34a_200010262243_100011713686 [0,1,0,0,0,0|3,0,0]=4 3207 B14R1.677 C=C(F)COCCc1ccc(cc1)C 7a_100000756670_100000042424 [0,1,0,0,0,0|3,0,0]=4 3208 B14R1.677 C=C(F)COCCc1ccc(cc1)Cl 34a_100011219627_100009893438 [0,1,0,0,0,0|3,0,0]=4 3209 B14R1.677 C=C(F)COCCc1ccc(cc1)Cl 34a_200010262243_100011713675 [0,1,0,0,0,0|3,0,0]=4 3210 B14R1.677 C=C(F)COCCc1ccc(cc1)Cl 7a_100011219627_100000042424 [0,1,0,0,0,0|3,0,0]=4 3211 B14R1.677 C=C(F)COCCc1ccc(cc1)F 34a_100000754732_100009893438 [0,1,0,0,0,0|3,0,0]=4 3212 B14R1.677 C=C(F)COCCc1ccc(cc1)F 34a_200010262243_100011217392 [0,1,0,0,0,0|3,0,0]=4 3213 B14R1.677 C=C(F)COCCc1ccc(cc1)F 7a_100000754732_100000042424 [0,1,0,0,0,0|3,0,0]=4 3214 B14R1.677 C=C(F)COCCc1ccc(cc1)I 34a_100012291149_100009893438 [0,1,0,0,0,0|3,0,0]=4 3215 B14R1.677 C=C(F)COCCc1ccc(cc1)I 7a_100012291149_100000042424 [0,1,0,0,0,0|3,0,0]=4 3216 B14R1.677 C=C(F)COCCc1ccc(cc1)N 34a_100011204434_100009893438 [0,1,0,0,0,0|3,0,0]=4 3217 B14R1.677 C=C(F)CSCCc1ccc(cc1)Br 62a_100000042424_100011740612 [0,1,0,0,0,0|3,0,0]=4 3218 B14R1.677 C=C(F)CSCCc1ccc(cc1)Br 62a_100011740612_100000042424 [0,1,0,0,0,0|3,0,0]=4 3219 B14R1.677 C=C(F)CSCCc1ccc(cc1)C 62a_100000042424_100011713686 [0,1,0,0,0,0|3,0,0]=4 3220 B14R1.677 C=C(F)CSCCc1ccc(cc1)C 62a_100011713686_100000042424 [0,1,0,0,0,0|3,0,0]=4 3221 B14R1.677 C=C(F)CSCCc1ccc(cc1)Cl 62a_100000042424_100011713675 [0,1,0,0,0,0|3,0,0]=4 3222 B14R1.677 C=C(F)CSCCc1ccc(cc1)Cl 62a_100011713675_100000042424 [0,1,0,0,0,0|3,0,0]=4 3223 B14R1.677 C=C(F)CSCCc1ccc(cc1)F 62a_100000042424_100011217392 [0,1,0,0,0,0|3,0,0]=4 3224 B14R1.677 C=C(F)CSCCc1ccc(cc1)F 62a_100011217392_100000042424 [0,1,0,0,0,0|3,0,0]=4 3225 B14R1.677 C=C(F)CSCCc1ccc(cc1)O 62a_100000042424_100009816426 [0,1,0,0,0,0|3,0,0]=4 3226 B14R1.677 C=C(F)CSCCc1ccc(cc1)O 62a_100009816426_100000042424 [0,1,0,0,0,0|3,0,0]=4 3227 B14R1.677 CC(=O)CCCCc1ccc(cc1)Br 1458a_100000070787_200012094861 [0,1,0,0,0,0|1,0,0]=2 3228 B14R1.677 CC(=O)CCCCc1ccc(cc1)Br 1458a_100000741018_200000210301 [0,1,0,0,0,0|1,0,0]=2 3229 B14R1.677 CC(=O)CCCCc1ccc(cc1)Cl 1458a_100000684701_200000210301 [0,1,0,0,0,0|1,0,0]=2 3230 B14R1.677 CC(=O)CCCCc1ccc(cc1)F 1458a_100000070787_100012093538 [0,1,0,0,0,0|1,0,0]=2 3231 B14R1.677 CC(=O)CCCCc1ccc(cc1)F 1458a_100000703604_200000210301 [0,1,0,0,0,0|1,0,0]=2 3232 B14R1.677 CC(=O)CCCCc1ccc(cc1)I 1458a_100000749853_200000210301 [0,1,0,0,0,0|1,0,0]=2 3233 B14R1.677 CC(=O)CCCCc1ccc(cc1)O 1458a_100000047048_200000210301 [0,1,0,0,0,0|1,0,0]=2 3234 B14R1.677 CC(=O)CCCNc1ccc(cc1)Br 34a_100000210018_100000685027 [0,1,0,0,0,0|2,0,0]=3 3235 B14R1.677 CC(=O)CCCNc1ccc(cc1)C 34a_100000124888_100000685027 [0,1,0,0,0,0|2,0,0]=3 3236 B14R1.677 CC(=O)CCCNc1ccc(cc1)Cl 34a_100000210052_100000685027 [0,1,0,0,0,0|2,0,0]=3 3237 B14R1.677 CC(=O)CCCNc1ccc(cc1)F 34a_100000185862_100000685027 [0,1,0,0,0,0|2,0,0]=3 3238 B14R1.677 CC(=O)CCCNc1ccc(cc1)I 34a_100000185761_100000685027 [0,1,0,0,0,0|2,0,0]=3 3239 B14R1.677 CC(=O)CCCNc1ccc(cc1)O 34a_100000185829_100000685027 [0,1,0,0,0,0|2,0,0]=3 3240 B14R1.677 CC(=O)CCCOc1ccc(=O)[nH]c1 34a_100000075641_100000685027 [0,1,0,0,0,0|3,0,0]=4 3241 B14R1.677 CC(=O)CCCOc1ccc(cc1)Br 1458a_100000070787_100011259224 [0,1,0,0,0,0|2,0,0]=3 3242 B14R1.677 CC(=O)CCCOc1ccc(cc1)Br 1458a_100000183208_200000210301 [0,1,0,0,0,0|2,0,0]=3 3243 B14R1.677 CC(=O)CCCOc1ccc(cc1)Br 34a_100000185759_100000685027 [0,1,0,0,0,0|2,0,0]=3 3244 B14R1.677 CC(=O)CCCOc1ccc(cc1)Br 7a_100000185759_100011215641 [0,1,0,0,0,0|2,0,0]=3 3245 B14R1.677 CC(=O)CCCOc1ccc(cc1)C 1458a_100000182836_200000210301 [0,1,0,0,0,0|2,0,0]=3 3246 B14R1.677 CC(=O)CCCOc1ccc(cc1)C 34a_100000210336_100000685027 [0,1,0,0,0,0|2,0,0]=3 3247 B14R1.677 CC(=O)CCCOc1ccc(cc1)C 7a_100000210336_100011215641 [0,1,0,0,0,0|2,0,0]=3 3248 B14R1.677 CC(=O)CCCOc1ccc(cc1)Cl 1458a_100000741531_200000210301 [0,1,0,0,0,0|2,0,0]=3 3249 B14R1.677 CC(=O)CCCOc1ccc(cc1)Cl 34a_100000210216_100000685027 [0,1,0,0,0,0|2,0,0]=3 3250 B14R1.677 CC(=O)CCCOc1ccc(cc1)Cl 7a_100000210216_100011215641 [0,1,0,0,0,0|2,0,0]=3 3251 B14R1.677 CC(=O)CCCOc1ccc(cc1)F 1458a_100000070787_100000181347 [0,1,0,0,0,0|2,0,0]=3 3252 B14R1.677 CC(=O)CCCOc1ccc(cc1)F 1458a_100000735736_200000210301 [0,1,0,0,0,0|2,0,0]=3 3253 B14R1.677 CC(=O)CCCOc1ccc(cc1)F 34a_100000210339_100000685027 [0,1,0,0,0,0|2,0,0]=3 3254 B14R1.677 CC(=O)CCCOc1ccc(cc1)I 1458a_100000744034_200000210301 [0,1,0,0,0,0|2,0,0]=3 3255 B14R1.677 CC(=O)CCCOc1ccc(cc1)I 34a_100000212066_100000685027 [0,1,0,0,0,0|2,0,0]=3 3256 B14R1.677 CC(=O)CCCOc1ccc(cc1)I 7a_100000212066_100011215641 [0,1,0,0,0,0|2,0,0]=3 3257 B14R1.677 CC(=O)CCCOc1ccc(cc1)N 34a_100000185829_100000685027 [0,1,0,0,0,0|2,0,0]=3 3258 B14R1.677 CC(=O)CCCOc1ccc(cn1)C 34a_100000759353_100000685027 [0,1,0,0,0,0|3,0,0]=4 3259 B14R1.677 CC(=O)CCCOc1ccc(cn1)Cl 34a_100011215309_100000685027 [0,1,0,0,0,0|3,0,0]=4 3260 B14R1.677 CC(=O)CCCOc1ccc(cn1)F 34a_100000742473_100000685027 [0,1,0,0,0,0|3,0,0]=4 3261 B14R1.677 CC(=O)CCCOc1ccc(cn1)N 34a_100000729260_100000685027 [0,1,0,0,0,0|3,0,0]=4 3262 B14R1.677 CC(=O)CCCOc1ccc(nc1)Br 34a_100000685995_100000685027 [0,1,0,0,0,0|3,0,0]=4 3263 B14R1.677 CC(=O)CCCOc1ccc(nc1)Br 7a_100000685995_100011215641 [0,1,0,0,0,0|3,0,0]=4 3264 B14R1.677 CC(=O)CCCOc1ccc(nc1)C 34a_100000745506_100000685027 [0,1,0,0,0,0|3,0,0]=4 3265 B14R1.677 CC(=O)CCCOc1ccc(nc1)C 7a_100000745506_100011215641 [0,1,0,0,0,0|3,0,0]=4 3266 B14R1.677 CC(=O)CCCOc1ccc(nc1)Cl 34a_100000744096_100000685027 [0,1,0,0,0,0|3,0,0]=4 3267 B14R1.677 CC(=O)CCCOc1ccc(nc1)Cl 7a_100000744096_100011215641 [0,1,0,0,0,0|3,0,0]=4 3268 B14R1.677 CC(=O)CCCOc1ccc(nc1)F 34a_100000688820_100000685027 [0,1,0,0,0,0|3,0,0]=4 3269 B14R1.677 CC(=O)CCCOc1ccc(nc1)F 7a_100000688820_100011215641 [0,1,0,0,0,0|3,0,0]=4 3270 B14R1.677 CC(=O)CCCOc1ccc(nc1)I 34a_100000687607_100000685027 [0,1,0,0,0,0|3,0,0]=4 3271 B14R1.677 CC(=O)CCCOc1ccc(nc1)I 7a_100000687607_100011215641 [0,1,0,0,0,0|3,0,0]=4 3272 B14R1.677 CC(=O)CCCOc1ccc(nc1)N 34a_100015188713_100000685027 [0,1,0,0,0,0|3,0,0]=4 3273 B14R1.677 CC(=O)CCCOc1ccc(nc1)N 7a_100015188713_100011215641 [0,1,0,0,0,0|3,0,0]=4 3274 B14R1.677 CC(=O)CCCSc1cc[n+](cc1)[O-] 62a_100011215641_100000039755 [0,1,0,0,0,0|3,0,0]=4 3275 B14R1.677 CC(=O)CCCSc1ccc(=O)[nH]c1 62a_100000212171_100011215641 [0,1,0,0,0,0|3,0,0]=4 3276 B14R1.677 CC(=O)CCCSc1ccc(=O)[nH]c1 62a_100011215641_100000212171 [0,1,0,0,0,0|3,0,0]=4 3277 B14R1.677 CC(=O)CCCSc1ccc(cc1)Br 1458a_100000753536_200000210301 [0,1,0,0,0,0|2,0,0]=3 3278 B14R1.677 CC(=O)CCCSc1ccc(cc1)Br 62a_100000752885_100011215641 [0,1,0,0,0,0|2,0,0]=3 3279 B14R1.677 CC(=O)CCCSc1ccc(cc1)Br 62a_100011215641_100000752885 [0,1,0,0,0,0|2,0,0]=3 3280 B14R1.677 CC(=O)CCCSc1ccc(cc1)C 62a_100000186775_100011215641 [0,1,0,0,0,0|2,0,0]=3 3281 B14R1.677 CC(=O)CCCSc1ccc(cc1)C 62a_100011215641_100000186775 [0,1,0,0,0,0|2,0,0]=3 3282 B14R1.677 CC(=O)CCCSc1ccc(cc1)Cl 1458a_100000182790_200000210301 [0,1,0,0,0,0|2,0,0]=3 3283 B14R1.677 CC(=O)CCCSc1ccc(cc1)Cl 62a_100000755918_100011215641 [0,1,0,0,0,0|2,0,0]=3 3284 B14R1.677 CC(=O)CCCSc1ccc(cc1)Cl 62a_100011215641_100000755918 [0,1,0,0,0,0|2,0,0]=3 3285 B14R1.677 CC(=O)CCCSc1ccc(cc1)F 62a_100000211213_100011215641 [0,1,0,0,0,0|2,0,0]=3 3286 B14R1.677 CC(=O)CCCSc1ccc(cc1)F 62a_100011215641_100000211213 [0,1,0,0,0,0|2,0,0]=3 3287 B14R1.677 CC(=O)CCCSc1ccc(cc1)N 62a_100000185761_100011215641 [0,1,0,0,0,0|2,0,0]=3 3288 B14R1.677 CC(=O)CCCSc1ccc(cc1)N 62a_100011215641_100000185761 [0,1,0,0,0,0|2,0,0]=3 3289 B14R1.677 CC(=O)CCCSc1ccc(cc1)O 62a_100011215641_100000185759 [0,1,0,0,0,0|2,0,0]=3 3290 B14R1.677 CC(=O)CCCSc1ccc(cn1)Br 62a_100000686858_100011215641 [0,1,0,0,0,0|3,0,0]=4 3291 B14R1.677 CC(=O)CCCSc1ccc(cn1)Br 62a_100011215641_100000686858 [0,1,0,0,0,0|3,0,0]=4 3292 B14R1.677 CC(=O)CCCSc1ccc(cn1)C 62a_100011192072_100011215641 [0,1,0,0,0,0|3,0,0]=4 3293 B14R1.677 CC(=O)CCCSc1ccc(cn1)C 62a_100011215641_100000754016 [0,1,0,0,0,0|3,0,0]=4 3294 B14R1.677 CC(=O)CCCSc1ccc(cn1)Cl 62a_100011215641_100011356976 [0,1,0,0,0,0|3,0,0]=4 3295 B14R1.677 CC(=O)CCCSc1ccc(cn1)Cl 62a_100011356976_100011215641 [0,1,0,0,0,0|3,0,0]=4 3296 B14R1.677 CC(=O)CCCSc1ccc(cn1)F 62a_100000744514_100011215641 [0,1,0,0,0,0|3,0,0]=4 3297 B14R1.677 CC(=O)CCCSc1ccc(cn1)F 62a_100011215641_100000744514 [0,1,0,0,0,0|3,0,0]=4 3298 B14R1.677 CC(=O)CCCSc1ccc(cn1)N 62a_100000737798_100011215641 [0,1,0,0,0,0|3,0,0]=4 3299 B14R1.677 CC(=O)CCCSc1ccc(cn1)N 62a_100011215641_100000737798 [0,1,0,0,0,0|3,0,0]=4 3300 B14R1.677 CC(=O)CCCSc1ccc(cn1)O 62a_100000685995_100011215641 [0,1,0,0,0,0|3,0,0]=4 3301 B14R1.677 CC(=O)CCCSc1ccc(cn1)O 62a_100011215641_100000744096 [0,1,0,0,0,0|3,0,0]=4 3302 B14R1.677 CC(=O)CCCSc1ccc(nc1)Br 62a_100009814638_100011215641 [0,1,0,0,0,0|3,0,0]=4 3303 B14R1.677 CC(=O)CCCSc1ccc(nc1)Br 62a_100011215641_100009814638 [0,1,0,0,0,0|3,0,0]=4 3304 B14R1.677 CC(=O)CCCSc1ccc(nc1)C 62a_100000751577_100011215641 [0,1,0,0,0,0|3,0,0]=4 3305 B14R1.677 CC(=O)CCCSc1ccc(nc1)C 62a_100011215641_100000751577 [0,1,0,0,0,0|3,0,0]=4 3306 B14R1.677 CC(=O)CCCSc1ccc(nc1)Cl 62a_100000034144_100011215641 [0,1,0,0,0,0|3,0,0]=4 3307 B14R1.677 CC(=O)CCCSc1ccc(nc1)Cl 62a_100011215641_100000034144 [0,1,0,0,0,0|3,0,0]=4 3308 B14R1.677 CC(=O)CCCSc1ccc(nc1)F 62a_100000042367_100011215641 [0,1,0,0,0,0|3,0,0]=4 3309 B14R1.677 CC(=O)CCCSc1ccc(nc1)F 62a_100011215641_100000042367 [0,1,0,0,0,0|3,0,0]=4 3310 B14R1.677 CC(=O)CCCSc1ccc(nc1)N 62a_100000187370_100011215641 [0,1,0,0,0,0|3,0,0]=4 3311 B14R1.677 CC(=O)CCCSc1ccc(nc1)N 62a_100011215641_100000187370 [0,1,0,0,0,0|3,0,0]=4 3312 B14R1.677 CC(=O)CCOCc1cc[n+](cc1)[O-] 7a_100000031831_100000053229 [0,1,0,0,0,0|3,0,0]=4 3313 B14R1.677 CC(=O)CCOCc1ccc(cc1)Br 34a_100000759926_100000189115 [0,1,0,0,0,0|2,0,0]=3 3314 B14R1.677 CC(=O)CCOCc1ccc(cc1)Br 7a_100000759926_100011217064 [0,1,0,0,0,0|2,0,0]=3 3315 B14R1.677 CC(=O)CCOCc1ccc(cc1)C 34a_100000759926_100000210814 [0,1,0,0,0,0|2,0,0]=3 3316 B14R1.677 CC(=O)CCOCc1ccc(cc1)C 7a_100000759926_100000210814 [0,1,0,0,0,0|2,0,0]=3 3317 B14R1.677 CC(=O)CCOCc1ccc(cc1)C 7a_100011215236_100000053229 [0,1,0,0,0,0|2,0,0]=3 3318 B14R1.677 CC(=O)CCOCc1ccc(cc1)Cl 34a_100000759926_100000694040 [0,1,0,0,0,0|2,0,0]=3 3319 B14R1.677 CC(=O)CCOCc1ccc(cc1)Cl 7a_100000211118_100000053229 [0,1,0,0,0,0|2,0,0]=3 3320 B14R1.677 CC(=O)CCOCc1ccc(cc1)Cl 7a_100000759926_100000187161 [0,1,0,0,0,0|2,0,0]=3 3321 B14R1.677 CC(=O)CCOCc1ccc(cc1)F 34a_100000759926_100000198546 [0,1,0,0,0,0|2,0,0]=3 3322 B14R1.677 CC(=O)CCOCc1ccc(cc1)F 7a_100000210977_100000053229 [0,1,0,0,0,0|2,0,0]=3 3323 B14R1.677 CC(=O)CCOCc1ccc(cc1)F 7a_100000759926_100000198546 [0,1,0,0,0,0|2,0,0]=3 3324 B14R1.677 CC(=O)CCOCc1ccc(cc1)I 34a_100000759926_100000189116 [0,1,0,0,0,0|2,0,0]=3 3325 B14R1.677 CC(=O)CCOCc1ccc(cc1)I 7a_100000690907_100000053229 [0,1,0,0,0,0|2,0,0]=3 3326 B14R1.677 CC(=O)CCOCc1ccc(cc1)I 7a_100000759926_100000189116 [0,1,0,0,0,0|2,0,0]=3 3327 B14R1.677 CC(=O)CCOCc1ccc(cn1)Br 34a_100000759926_100000702658 [0,1,0,0,0,0|3,0,0]=4 3328 B14R1.677 CC(=O)CCOCc1ccc(cn1)Br 7a_100000759926_100000702658 [0,1,0,0,0,0|3,0,0]=4 3329 B14R1.677 CC(=O)CCOCc1ccc(cn1)C 34a_100000759926_100000691093 [0,1,0,0,0,0|3,0,0]=4 3330 B14R1.677 CC(=O)CCOCc1ccc(cn1)C 7a_100000759926_100000691093 [0,1,0,0,0,0|3,0,0]=4 3331 B14R1.677 CC(=O)CCOCc1ccc(cn1)Cl 34a_100000759926_100012066911 [0,1,0,0,0,0|3,0,0]=4 3332 B14R1.677 CC(=O)CCOCc1ccc(cn1)Cl 7a_100000759926_100012066911 [0,1,0,0,0,0|3,0,0]=4 3333 B14R1.677 CC(=O)CCOCc1ccc(cn1)F 34a_100000759926_100000703193 [0,1,0,0,0,0|3,0,0]=4 3334 B14R1.677 CC(=O)CCOCc1ccc(cn1)F 7a_100000759926_100000703193 [0,1,0,0,0,0|3,0,0]=4 3335 B14R1.677 CC(=O)CCOCc1ccc(nc1)Br 34a_100000759926_100009831999 [0,1,0,0,0,0|3,0,0]=4 3336 B14R1.677 CC(=O)CCOCc1ccc(nc1)Br 7a_100000759926_100009831999 [0,1,0,0,0,0|3,0,0]=4 3337 B14R1.677 CC(=O)CCOCc1ccc(nc1)Br 7a_100009816760_100000053229 [0,1,0,0,0,0|3,0,0]=4 3338 B14R1.677 CC(=O)CCOCc1ccc(nc1)C 34a_100000759926_100016987292 [0,1,0,0,0,0|3,0,0]=4 3339 B14R1.677 CC(=O)CCOCc1ccc(nc1)C 7a_100000759926_100016987292 [0,1,0,0,0,0|3,0,0]=4 3340 B14R1.677 CC(=O)CCOCc1ccc(nc1)Cl 34a_100000759926_100000735431 [0,1,0,0,0,0|3,0,0]=4 3341 B14R1.677 CC(=O)CCOCc1ccc(nc1)Cl 7a_100000755211_100000053229 [0,1,0,0,0,0|3,0,0]=4 3342 B14R1.677 CC(=O)CCOCc1ccc(nc1)Cl 7a_100000759926_100000735431 [0,1,0,0,0,0|3,0,0]=4 3343 B14R1.677 CC(=O)CCOCc1ccc(nc1)F 34a_100000759926_100000099788 [0,1,0,0,0,0|3,0,0]=4 3344 B14R1.677 CC(=O)CCOCc1ccc(nc1)F 7a_100000759926_100009820150 [0,1,0,0,0,0|3,0,0]=4 3345 B14R1.677 CC(=O)CCSCc1ccc(cc1)Br 62a_100000053229_100000189115 [0,1,0,0,0,0|2,0,0]=3 3346 B14R1.677 CC(=O)CCSCc1ccc(cc1)Br 62a_100000189115_100000053229 [0,1,0,0,0,0|2,0,0]=3 3347 B14R1.677 CC(=O)CCSCc1ccc(cc1)C 1458a_200000173737_200000210301 [0,1,0,0,0,0|2,0,0]=3 3348 B14R1.677 CC(=O)CCSCc1ccc(cc1)C 62a_100000053229_100000210814 [0,1,0,0,0,0|2,0,0]=3 3349 B14R1.677 CC(=O)CCSCc1ccc(cc1)C 62a_100000210814_100000053229 [0,1,0,0,0,0|2,0,0]=3 3350 B14R1.677 CC(=O)CCSCc1ccc(cc1)Cl 62a_100000053229_100000187161 [0,1,0,0,0,0|2,0,0]=3 3351 B14R1.677 CC(=O)CCSCc1ccc(cc1)Cl 62a_100000187161_100000053229 [0,1,0,0,0,0|2,0,0]=3 3352 B14R1.677 CC(=O)CCSCc1ccc(cc1)F 62a_100000053229_100000187164 [0,1,0,0,0,0|2,0,0]=3 3353 B14R1.677 CC(=O)CCSCc1ccc(cc1)F 62a_100000198546_100000053229 [0,1,0,0,0,0|2,0,0]=3 3354 B14R1.677 CC(=O)CCSCc1ccc(cc1)I 62a_100000053229_100000189116 [0,1,0,0,0,0|2,0,0]=3 3355 B14R1.677 CC(=O)CCSCc1ccc(cc1)I 62a_100000189116_100000053229 [0,1,0,0,0,0|2,0,0]=3 3356 B14R1.677 CC(=O)CCSCc1ccc(cn1)Br 62a_100000053229_100000702658 [0,1,0,0,0,0|3,0,0]=4 3357 B14R1.677 CC(=O)CCSCc1ccc(cn1)Br 62a_100000702658_100000053229 [0,1,0,0,0,0|3,0,0]=4 3358 B14R1.677 CC(=O)CCSCc1ccc(cn1)C 62a_100000053229_100000691093 [0,1,0,0,0,0|3,0,0]=4 3359 B14R1.677 CC(=O)CCSCc1ccc(cn1)C 62a_100000691093_100000053229 [0,1,0,0,0,0|3,0,0]=4 3360 B14R1.677 CC(=O)CCSCc1ccc(cn1)Cl 62a_100000053229_100000697101 [0,1,0,0,0,0|3,0,0]=4 3361 B14R1.677 CC(=O)CCSCc1ccc(cn1)Cl 62a_100012066911_100000053229 [0,1,0,0,0,0|3,0,0]=4 3362 B14R1.677 CC(=O)CCSCc1ccc(cn1)F 62a_100000053229_100000703193 [0,1,0,0,0,0|3,0,0]=4 3363 B14R1.677 CC(=O)CCSCc1ccc(cn1)F 62a_100000703193_100000053229 [0,1,0,0,0,0|3,0,0]=4 3364 B14R1.677 CC(=O)CCSCc1ccc(nc1)Br 62a_100000053229_100009831999 [0,1,0,0,0,0|3,0,0]=4 3365 B14R1.677 CC(=O)CCSCc1ccc(nc1)Br 62a_100009831999_100000053229 [0,1,0,0,0,0|3,0,0]=4 3366 B14R1.677 CC(=O)CCSCc1ccc(nc1)C 62a_100000053229_100016987292 [0,1,0,0,0,0|3,0,0]=4 3367 B14R1.677 CC(=O)CCSCc1ccc(nc1)C 62a_100016987292_100000053229 [0,1,0,0,0,0|3,0,0]=4 3368 B14R1.677 CC(=O)CCSCc1ccc(nc1)Cl 62a_100000053229_100000735431 [0,1,0,0,0,0|3,0,0]=4 3369 B14R1.677 CC(=O)CCSCc1ccc(nc1)Cl 62a_100000735431_100000053229 [0,1,0,0,0,0|3,0,0]=4 3370 B14R1.677 CC(=O)CCSCc1ccc(nc1)F 62a_100000053229_100000099788 [0,1,0,0,0,0|3,0,0]=4 3371 B14R1.677 CC(=O)CCSCc1ccc(nc1)F 62a_100009820150_100000053229 [0,1,0,0,0,0|3,0,0]=4 3372 B14R1.677 CC(=O)COCCc1ccc(cc1)Br 34a_100000211253_100011740612 [0,1,0,0,0,0|2,0,0]=3 3373 B14R1.677 CC(=O)COCCc1ccc(cc1)C 34a_100000211253_100011713686 [0,1,0,0,0,0|2,0,0]=3 3374 B14R1.677 CC(=O)COCCc1ccc(cc1)Cl 34a_100000211253_100011713675 [0,1,0,0,0,0|2,0,0]=3 3375 B14R1.677 CC(=O)COCCc1ccc(cc1)F 34a_100000211253_100011217392 [0,1,0,0,0,0|2,0,0]=3 3376 B14R1.677 CC(=O)NCCCc1ccc(cc1)Br 11a_100011297623_100015343762 [0,1,0,0,0,0|2,0,0]=3 3377 B14R1.677 CC(=O)NCCCc1ccc(cc1)Br 1626a_100011297623_100015343762 [0,1,0,0,0,0|2,0,0]=3 3378 B14R1.677 CC(=O)NCCCc1ccc(cc1)Br 240690a_100011297623_100015343762 [0,1,0,0,0,0|2,0,0]=3 3379 B14R1.677 CC(=O)NCCCc1ccc(cc1)Br 527a_100011297623_100103153847 [0,1,0,0,0,0|2,0,0]=3 3380 B14R1.677 CC(=O)NCCCc1ccc(cc1)C 11a_100011236272_100015343762 [0,1,0,0,0,0|2,0,0]=3 3381 B14R1.677 CC(=O)NCCCc1ccc(cc1)C 1626a_100011236272_100015343762 [0,1,0,0,0,0|2,0,0]=3 3382 B14R1.677 CC(=O)NCCCc1ccc(cc1)C 240690a_100011236272_100015343762 [0,1,0,0,0,0|2,0,0]=3 3383 B14R1.677 CC(=O)NCCCc1ccc(cc1)C 527a_100011236272_100103153847 [0,1,0,0,0,0|2,0,0]=3 3384 B14R1.677 CC(=O)NCCCc1ccc(cc1)Cl 11a_100000748451_100015343762 [0,1,0,0,0,0|2,0,0]=3 3385 B14R1.677 CC(=O)NCCCc1ccc(cc1)Cl 1626a_100000748451_100015343762 [0,1,0,0,0,0|2,0,0]=3 3386 B14R1.677 CC(=O)NCCCc1ccc(cc1)Cl 240690a_100000748451_100015343762 [0,1,0,0,0,0|2,0,0]=3 3387 B14R1.677 CC(=O)NCCCc1ccc(cc1)Cl 527a_100000748451_100103153847 [0,1,0,0,0,0|2,0,0]=3 3388 B14R1.677 CC(=O)NCCCc1ccc(cc1)F 11a_100025745824_100015343762 [0,1,0,0,0,0|2,0,0]=3 3389 B14R1.677 CC(=O)NCCCc1ccc(cc1)F 1626a_100025745824_100015343762 [0,1,0,0,0,0|2,0,0]=3 3390 B14R1.677 CC(=O)NCCCc1ccc(cc1)F 240690a_100025745824_100015343762 [0,1,0,0,0,0|2,0,0]=3 3391 B14R1.677 CC(=O)NCCCc1ccc(cc1)F 527a_100025745824_100103153847 [0,1,0,0,0,0|2,0,0]=3 3392 B14R1.677 CC(=O)NCCNc1ccc(cc1)Br 2230a_100000210018_100000189650 [0,1,0,0,0,0|3,0,0]=4 3393 B14R1.677 CC(=O)NCCNc1ccc(cc1)Cl 2230a_100000210052_100000189650 [0,1,0,0,0,0|3,0,0]=4 3394 B14R1.677 CC(=O)NCCOc1ccc(cc1)Br 11a_100000746992_100015343762 [0,1,0,0,0,0|3,0,0]=4 3395 B14R1.677 CC(=O)NCCOc1ccc(cc1)Br 1626a_100000746992_100015343762 [0,1,0,0,0,0|3,0,0]=4 3396 B14R1.677 CC(=O)NCCOc1ccc(cc1)Br 240690a_100000746992_100015343762 [0,1,0,0,0,0|3,0,0]=4 3397 B14R1.677 CC(=O)NCCOc1ccc(cc1)Br 527a_100000746992_100103153847 [0,1,0,0,0,0|3,0,0]=4 3398 B14R1.677 CC(=O)NCCOc1ccc(cc1)Br 7a_100000185759_100000189650 [0,1,0,0,0,0|3,0,0]=4 3399 B14R1.677 CC(=O)NCCOc1ccc(cc1)C 11a_100020666663_100015343762 [0,1,0,0,0,0|3,0,0]=4 3400 B14R1.677 CC(=O)NCCOc1ccc(cc1)C 1626a_100020666663_100015343762 [0,1,0,0,0,0|3,0,0]=4 3401 B14R1.677 CC(=O)NCCOc1ccc(cc1)C 240690a_100020666663_100015343762 [0,1,0,0,0,0|3,0,0]=4 3402 B14R1.677 CC(=O)NCCOc1ccc(cc1)C 527a_100020666663_100103153847 [0,1,0,0,0,0|3,0,0]=4 3403 B14R1.677 CC(=O)NCCOc1ccc(cc1)C 7a_100000210336_100000189650 [0,1,0,0,0,0|3,0,0]=4 3404 B14R1.677 CC(=O)NCCOc1ccc(cc1)Cl 11a_100000697975_100015343762 [0,1,0,0,0,0|3,0,0]=4 3405 B14R1.677 CC(=O)NCCOc1ccc(cc1)Cl 1626a_100000697975_100015343762 [0,1,0,0,0,0|3,0,0]=4 3406 B14R1.677 CC(=O)NCCOc1ccc(cc1)Cl 240690a_100000697975_100015343762 [0,1,0,0,0,0|3,0,0]=4 3407 B14R1.677 CC(=O)NCCOc1ccc(cc1)Cl 527a_100000697975_100103153847 [0,1,0,0,0,0|3,0,0]=4 3408 B14R1.677 CC(=O)NCCOc1ccc(cc1)Cl 7a_100000210216_100000189650 [0,1,0,0,0,0|3,0,0]=4 3409 B14R1.677 CC(=O)NCCOc1ccc(cc1)F 11a_100000737420_100015343762 [0,1,0,0,0,0|3,0,0]=4 3410 B14R1.677 CC(=O)NCCOc1ccc(cc1)F 1626a_100000737420_100015343762 [0,1,0,0,0,0|3,0,0]=4 3411 B14R1.677 CC(=O)NCCOc1ccc(cc1)F 240690a_100000737420_100015343762 [0,1,0,0,0,0|3,0,0]=4 3412 B14R1.677 CC(=O)NCCOc1ccc(cc1)F 527a_100000737420_100103153847 [0,1,0,0,0,0|3,0,0]=4 3413 B14R1.677 CC(=O)NCCOc1ccc(cc1)I 7a_100000212066_100000189650 [0,1,0,0,0,0|3,0,0]=4 3414 B14R1.677 CC(=O)NCCOc1ccc(cc1)O 271570a_203496583355_200009814669 [0,1,0,0,0,0|3,0,0]=4 3415 B14R1.677 CC(=O)NCCSc1ccc(cc1)Br 240690a_100000184645_100015343762 [0,1,0,0,0,0|3,0,0]=4 3416 B14R1.677 CC(=O)NCCSc1ccc(cc1)Br 527a_100000184645_100103153847 [0,1,0,0,0,0|3,0,0]=4 3417 B14R1.677 CC(=O)NCCSc1ccc(cc1)Br 62a_100000189650_100000752885 [0,1,0,0,0,0|3,0,0]=4 3418 B14R1.677 CC(=O)NCCSc1ccc(cc1)Br 62a_100000752885_100000189650 [0,1,0,0,0,0|3,0,0]=4 3419 B14R1.677 CC(=O)NCCSc1ccc(cc1)C 11a_100000739754_100015343762 [0,1,0,0,0,0|3,0,0]=4 3420 B14R1.677 CC(=O)NCCSc1ccc(cc1)C 240690a_100000739754_100015343762 [0,1,0,0,0,0|3,0,0]=4 3421 B14R1.677 CC(=O)NCCSc1ccc(cc1)C 527a_100000739754_100103153847 [0,1,0,0,0,0|3,0,0]=4 3422 B14R1.677 CC(=O)NCCSc1ccc(cc1)C 62a_100000186775_100000189650 [0,1,0,0,0,0|3,0,0]=4 3423 B14R1.677 CC(=O)NCCSc1ccc(cc1)C 62a_100000189650_100000186775 [0,1,0,0,0,0|3,0,0]=4 3424 B14R1.677 CC(=O)NCCSc1ccc(cc1)Cl 11a_100000174974_100015343762 [0,1,0,0,0,0|3,0,0]=4 3425 B14R1.677 CC(=O)NCCSc1ccc(cc1)Cl 240690a_100000174974_100015343762 [0,1,0,0,0,0|3,0,0]=4 3426 B14R1.677 CC(=O)NCCSc1ccc(cc1)Cl 527a_100000174974_100103153847 [0,1,0,0,0,0|3,0,0]=4 3427 B14R1.677 CC(=O)NCCSc1ccc(cc1)Cl 62a_100000189650_100000755918 [0,1,0,0,0,0|3,0,0]=4 3428 B14R1.677 CC(=O)NCCSc1ccc(cc1)Cl 62a_100000755918_100000189650 [0,1,0,0,0,0|3,0,0]=4 3429 B14R1.677 CC(=O)NCCSc1ccc(cc1)F 62a_100000189650_100000211213 [0,1,0,0,0,0|3,0,0]=4 3430 B14R1.677 CC(=O)NCCSc1ccc(cc1)F 62a_100000211213_100000189650 [0,1,0,0,0,0|3,0,0]=4 3431 B14R1.677 CC(=O)NCCSc1ccc(cc1)N 62a_100000185761_100000189650 [0,1,0,0,0,0|3,0,0]=4 3432 B14R1.677 CC(=O)NCCSc1ccc(cc1)N 62a_100000189650_100000185761 [0,1,0,0,0,0|3,0,0]=4 3433 B14R1.677 CC(=O)NCCSc1ccc(cc1)O 62a_100000189650_100000185759 [0,1,0,0,0,0|3,0,0]=4 3434 B14R1.677 CC(=O)OCCNc1ccc(cc1)Br 34a_100000210018_100009814007 [0,1,0,0,0,0|3,0,0]=4 3435 B14R1.677 CC(=O)OCCNc1ccc(cc1)C 34a_100000124888_100009814007 [0,1,0,0,0,0|3,0,0]=4 3436 B14R1.677 CC(=O)OCCNc1ccc(cc1)Cl 34a_100000210052_100009814007 [0,1,0,0,0,0|3,0,0]=4 3437 B14R1.677 CC(=O)OCCNc1ccc(cc1)F 34a_100000185862_100009814007 [0,1,0,0,0,0|3,0,0]=4 3438 B14R1.677 CC(=O)OCCNc1ccc(cc1)I 34a_100000185761_100009814007 [0,1,0,0,0,0|3,0,0]=4 3439 B14R1.677 CC(=O)OCCNc1ccc(cc1)O 34a_100000185829_100009814007 [0,1,0,0,0,0|3,0,0]=4 3440 B14R1.677 CC(=O)OCCOc1ccc(cc1)Br 34a_100000185759_100009814007 [0,1,0,0,0,0|3,0,0]=4 3441 B14R1.677 CC(=O)OCCOc1ccc(cc1)Br 7a_100000185759_100009814007 [0,1,0,0,0,0|3,0,0]=4 3442 B14R1.677 CC(=O)OCCOc1ccc(cc1)C 34a_100000210336_100009814007 [0,1,0,0,0,0|3,0,0]=4 3443 B14R1.677 CC(=O)OCCOc1ccc(cc1)C 7a_100000210336_100009814007 [0,1,0,0,0,0|3,0,0]=4 3444 B14R1.677 CC(=O)OCCOc1ccc(cc1)Cl 34a_100000210216_100009814007 [0,1,0,0,0,0|3,0,0]=4 3445 B14R1.677 CC(=O)OCCOc1ccc(cc1)Cl 7a_100000210216_100009814007 [0,1,0,0,0,0|3,0,0]=4 3446 B14R1.677 CC(=O)OCCOc1ccc(cc1)F 34a_100000210339_100009814007 [0,1,0,0,0,0|3,0,0]=4 3447 B14R1.677 CC(=O)OCCOc1ccc(cc1)I 34a_100000212066_100009814007 [0,1,0,0,0,0|3,0,0]=4 3448 B14R1.677 CC(=O)OCCOc1ccc(cc1)I 7a_100000212066_100009814007 [0,1,0,0,0,0|3,0,0]=4 3449 B14R1.677 CC(=O)OCCOc1ccc(cc1)N 34a_100000185829_100009814007 [0,1,0,0,0,0|3,0,0]=4 3450 B14R1.677 CC(=O)OCCSc1ccc(cc1)Br 62a_100000752885_100009814007 [0,1,0,0,0,0|3,0,0]=4 3451 B14R1.677 CC(=O)OCCSc1ccc(cc1)Br 62a_100009814007_100000752885 [0,1,0,0,0,0|3,0,0]=4 3452 B14R1.677 CC(=O)OCCSc1ccc(cc1)C 62a_100000186775_100009814007 [0,1,0,0,0,0|3,0,0]=4 3453 B14R1.677 CC(=O)OCCSc1ccc(cc1)C 62a_100009814007_100000186775 [0,1,0,0,0,0|3,0,0]=4 3454 B14R1.677 CC(=O)OCCSc1ccc(cc1)Cl 62a_100000755918_100009814007 [0,1,0,0,0,0|3,0,0]=4 3455 B14R1.677 CC(=O)OCCSc1ccc(cc1)Cl 62a_100009814007_100000755918 [0,1,0,0,0,0|3,0,0]=4 3456 B14R1.677 CC(=O)OCCSc1ccc(cc1)F 62a_100000211213_100009814007 [0,1,0,0,0,0|3,0,0]=4 3457 B14R1.677 CC(=O)OCCSc1ccc(cc1)F 62a_100009814007_100000211213 [0,1,0,0,0,0|3,0,0]=4 3458 B14R1.677 CC(=O)OCCSc1ccc(cc1)N 62a_100000185761_100009814007 [0,1,0,0,0,0|3,0,0]=4 3459 B14R1.677 CC(=O)OCCSc1ccc(cc1)N 62a_100009814007_100000185761 [0,1,0,0,0,0|3,0,0]=4 3460 B14R1.677 CC(=O)OCCSc1ccc(cc1)O 62a_100009814007_100000185759 [0,1,0,0,0,0|3,0,0]=4 3461 B14R1.677 CC(=O)OCNCc1ccc(cc1)Br 34a_100000174875_100009813279 [0,1,0,0,0,0|3,0,0]=4 3462 B14R1.677 CC(=O)OCNCc1ccc(cc1)C 34a_100000174908_100009813279 [0,1,0,0,0,0|3,0,0]=4 3463 B14R1.677 CC(=O)OCNCc1ccc(cc1)Cl 34a_100000174871_100009813279 [0,1,0,0,0,0|3,0,0]=4 3464 B14R1.677 CC(=O)OCNCc1ccc(cc1)F 34a_100000174882_100009813279 [0,1,0,0,0,0|3,0,0]=4 3465 B14R1.677 CC(=O)OCNCc1ccc(cc1)I 34a_100016989417_100009813279 [0,1,0,0,0,0|3,0,0]=4 3466 B14R1.677 CC(=O)OCNCc1ccc(cc1)O 34a_100000185549_100009813279 [0,1,0,0,0,0|3,0,0]=4 3467 B14R1.677 CC(=O)OCOCc1ccc(cc1)Br 34a_100000695286_100009813279 [0,1,0,0,0,0|3,0,0]=4 3468 B14R1.677 CC(=O)OCOCc1ccc(cc1)C 34a_100011215236_100009813279 [0,1,0,0,0,0|3,0,0]=4 3469 B14R1.677 CC(=O)OCOCc1ccc(cc1)Cl 34a_100000211118_100009813279 [0,1,0,0,0,0|3,0,0]=4 3470 B14R1.677 CC(=O)OCOCc1ccc(cc1)F 34a_100000210977_100009813279 [0,1,0,0,0,0|3,0,0]=4 3471 B14R1.677 CC(=O)OCOCc1ccc(cc1)I 34a_100000690907_100009813279 [0,1,0,0,0,0|3,0,0]=4 3472 B14R1.677 CC(=O)OCOCc1ccc(cc1)N 34a_100011215238_100009813279 [0,1,0,0,0,0|3,0,0]=4 3473 B14R1.677 CC(=O)OCSCc1ccc(cc1)Br 62a_100000076356_100000189115 [0,1,0,0,0,0|3,0,0]=4 3474 B14R1.677 CC(=O)OCSCc1ccc(cc1)Br 62a_100000189115_100000076356 [0,1,0,0,0,0|3,0,0]=4 3475 B14R1.677 CC(=O)OCSCc1ccc(cc1)C 62a_100000076356_100000210814 [0,1,0,0,0,0|3,0,0]=4 3476 B14R1.677 CC(=O)OCSCc1ccc(cc1)C 62a_100000210814_100000076356 [0,1,0,0,0,0|3,0,0]=4 3477 B14R1.677 CC(=O)OCSCc1ccc(cc1)Cl 62a_100000076356_100000187161 [0,1,0,0,0,0|3,0,0]=4 3478 B14R1.677 CC(=O)OCSCc1ccc(cc1)Cl 62a_100000187161_100000076356 [0,1,0,0,0,0|3,0,0]=4 3479 B14R1.677 CC(=O)OCSCc1ccc(cc1)F 62a_100000076356_100000187164 [0,1,0,0,0,0|3,0,0]=4 3480 B14R1.677 CC(=O)OCSCc1ccc(cc1)F 62a_100000198546_100000076356 [0,1,0,0,0,0|3,0,0]=4 3481 B14R1.677 CC(=O)OCSCc1ccc(cc1)I 62a_100000076356_100000189116 [0,1,0,0,0,0|3,0,0]=4 3482 B14R1.677 CC(=O)OCSCc1ccc(cc1)I 62a_100000189116_100000076356 [0,1,0,0,0,0|3,0,0]=4 3483 B14R1.677 CC(O)CCCNc1ccc(cc1)Br 2230a_100000210018_200000718107 [0,1,0,0,0,0|2,0,1]=4 3484 B14R1.677 CC(O)CCCNc1ccc(cc1)Br 34a_100000210018_200000718107 [0,1,0,0,0,0|2,0,1]=4 3485 B14R1.677 CC(O)CCCNc1ccc(cc1)Cl 2230a_100000210052_200000718107 [0,1,0,0,0,0|2,0,1]=4 3486 B14R1.677 CC(O)CCCNc1ccc(cc1)Cl 34a_100000210052_200000718107 [0,1,0,0,0,0|2,0,1]=4 3487 B14R1.677 CC(O)CCCNc1ccc(cc1)F 34a_100000185862_200000718107 [0,1,0,0,0,0|2,0,1]=4 3488 B14R1.677 CC(O)CCCNc1ccc(cc1)I 34a_100000185761_200000718107 [0,1,0,0,0,0|2,0,1]=4 3489 B14R1.677 CC(O)CCCNc1ccc(cc1)O 34a_100000185829_200000718107 [0,1,0,0,0,0|2,0,1]=4 3490 B14R1.677 CC(O)CCCOc1ccc(cc1)Br 34a_100000185759_200000718107 [0,1,0,0,0,0|2,0,1]=4 3491 B14R1.677 CC(O)CCCOc1ccc(cc1)Br 7a_100000185759_200000718107 [0,1,0,0,0,0|2,0,1]=4 3492 B14R1.677 CC(O)CCCOc1ccc(cc1)Cl 34a_100000210216_200000718107 [0,1,0,0,0,0|2,0,1]=4 3493 B14R1.677 CC(O)CCCOc1ccc(cc1)Cl 7a_100000210216_200000718107 [0,1,0,0,0,0|2,0,1]=4 3494 B14R1.677 CC(O)CCCOc1ccc(cc1)F 34a_100000210339_200000718107 [0,1,0,0,0,0|2,0,1]=4 3495 B14R1.677 CC(O)CCCOc1ccc(cc1)I 34a_100000212066_200000718107 [0,1,0,0,0,0|2,0,1]=4 3496 B14R1.677 CC(O)CCCOc1ccc(cc1)I 7a_100000212066_200000718107 [0,1,0,0,0,0|2,0,1]=4 3497 B14R1.677 CC(O)CCCOc1ccc(cc1)N 34a_100000185829_200000718107 [0,1,0,0,0,0|2,0,1]=4 3498 B14R1.677 CC(O)CCCSc1ccc(cc1)Br 62a_100000752885_200000718107 [0,1,0,0,0,0|2,0,1]=4 3499 B14R1.677 CC(O)CCCSc1ccc(cc1)Br 62a_200000718107_100000752885 [0,1,0,0,0,0|2,0,1]=4 3500 B14R1.677 CC(O)CCCSc1ccc(cc1)Cl 62a_100000755918_200000718107 [0,1,0,0,0,0|2,0,1]=4 3501 B14R1.677 CC(O)CCCSc1ccc(cc1)Cl 62a_200000718107_100000755918 [0,1,0,0,0,0|2,0,1]=4 3502 B14R1.677 CC(O)CCCSc1ccc(cc1)F 62a_100000211213_200000718107 [0,1,0,0,0,0|2,0,1]=4 3503 B14R1.677 CC(O)CCCSc1ccc(cc1)F 62a_200000718107_100000211213 [0,1,0,0,0,0|2,0,1]=4 3504 B14R1.677 CC(O)CCCSc1ccc(cc1)N 62a_100000185761_200000718107 [0,1,0,0,0,0|2,0,1]=4 3505 B14R1.677 CC(O)CCCSc1ccc(cc1)N 62a_200000718107_100000185761 [0,1,0,0,0,0|2,0,1]=4 3506 B14R1.677 CC(O)CCCSc1ccc(cc1)O 62a_200000718107_100000185759 [0,1,0,0,0,0|2,0,1]=4 3507 B14R1.677 CC(O)CCNCc1ccc(cc1)Br 207a_200000755665_100000186029 [0,1,0,0,0,0|2,0,1]=4 3508 B14R1.677 CC(O)CCNCc1ccc(cc1)Br 2230a_100000174875_100012276601 [0,1,0,0,0,0|2,0,1]=4 3509 B14R1.677 CC(O)CCNCc1ccc(cc1)Br 2230a_200000755665_100011217064 [0,1,0,0,0,0|2,0,1]=4 3510 B14R1.677 CC(O)CCNCc1ccc(cc1)Br 270004a_200000755665_100000186029 [0,1,0,0,0,0|2,0,1]=4 3511 B14R1.677 CC(O)CCNCc1ccc(cc1)Br 34a_100000174875_100012276601 [0,1,0,0,0,0|2,0,1]=4 3512 B14R1.677 CC(O)CCNCc1ccc(cc1)Cl 207a_200000755665_100000189385 [0,1,0,0,0,0|2,0,1]=4 3513 B14R1.677 CC(O)CCNCc1ccc(cc1)Cl 2230a_100000174871_100012276601 [0,1,0,0,0,0|2,0,1]=4 3514 B14R1.677 CC(O)CCNCc1ccc(cc1)Cl 2230a_200000755665_100000694040 [0,1,0,0,0,0|2,0,1]=4 3515 B14R1.677 CC(O)CCNCc1ccc(cc1)Cl 270004a_200000755665_100000189385 [0,1,0,0,0,0|2,0,1]=4 3516 B14R1.677 CC(O)CCNCc1ccc(cc1)Cl 34a_100000174871_100012276601 [0,1,0,0,0,0|2,0,1]=4 3517 B14R1.677 CC(O)CCNCc1ccc(cc1)F 207a_200000755665_100000210084 [0,1,0,0,0,0|2,0,1]=4 3518 B14R1.677 CC(O)CCNCc1ccc(cc1)F 2230a_100000174882_100012276601 [0,1,0,0,0,0|2,0,1]=4 3519 B14R1.677 CC(O)CCNCc1ccc(cc1)F 2230a_200000755665_100000198546 [0,1,0,0,0,0|2,0,1]=4 3520 B14R1.677 CC(O)CCNCc1ccc(cc1)F 270004a_200000755665_100000210084 [0,1,0,0,0,0|2,0,1]=4 3521 B14R1.677 CC(O)CCNCc1ccc(cc1)F 34a_100000174882_100012276601 [0,1,0,0,0,0|2,0,1]=4 3522 B14R1.677 CC(O)CCNCc1ccc(cc1)I 207a_200000755665_100000188517 [0,1,0,0,0,0|2,0,1]=4 3523 B14R1.677 CC(O)CCNCc1ccc(cc1)I 2230a_100016989417_100012276601 [0,1,0,0,0,0|2,0,1]=4 3524 B14R1.677 CC(O)CCNCc1ccc(cc1)I 2230a_200000755665_100000189116 [0,1,0,0,0,0|2,0,1]=4 3525 B14R1.677 CC(O)CCNCc1ccc(cc1)I 34a_100016989417_100012276601 [0,1,0,0,0,0|2,0,1]=4 3526 B14R1.677 CC(O)CCNCc1ccc(cc1)O 34a_100000185549_100012276601 [0,1,0,0,0,0|2,0,1]=4 3527 B14R1.677 CC(O)CCOCc1ccc(cc1)Br 34a_100000695286_100012276601 [0,1,0,0,0,0|2,0,1]=4 3528 B14R1.677 CC(O)CCOCc1ccc(cc1)Cl 34a_100000211118_100012276601 [0,1,0,0,0,0|2,0,1]=4 3529 B14R1.677 CC(O)CCOCc1ccc(cc1)Cl 7a_100000211118_100012276601 [0,1,0,0,0,0|2,0,1]=4 3530 B14R1.677 CC(O)CCOCc1ccc(cc1)F 34a_100000210977_100012276601 [0,1,0,0,0,0|2,0,1]=4 3531 B14R1.677 CC(O)CCOCc1ccc(cc1)F 7a_100000210977_100012276601 [0,1,0,0,0,0|2,0,1]=4 3532 B14R1.677 CC(O)CCOCc1ccc(cc1)I 34a_100000690907_100012276601 [0,1,0,0,0,0|2,0,1]=4 3533 B14R1.677 CC(O)CCOCc1ccc(cc1)I 7a_100000690907_100012276601 [0,1,0,0,0,0|2,0,1]=4 3534 B14R1.677 CC(O)CCOCc1ccc(cc1)N 34a_100011215238_100012276601 [0,1,0,0,0,0|2,0,1]=4 3535 B14R1.677 CC(O)CCSCc1ccc(cc1)Br 62a_100000189115_100012276601 [0,1,0,0,0,0|2,0,1]=4 3536 B14R1.677 CC(O)CCSCc1ccc(cc1)Br 62a_100012276601_100000189115 [0,1,0,0,0,0|2,0,1]=4 3537 B14R1.677 CC(O)CCSCc1ccc(cc1)Cl 62a_100000187161_100012276601 [0,1,0,0,0,0|2,0,1]=4 3538 B14R1.677 CC(O)CCSCc1ccc(cc1)Cl 62a_100012276601_100000187161 [0,1,0,0,0,0|2,0,1]=4 3539 B14R1.677 CC(O)CCSCc1ccc(cc1)F 62a_100000198546_100012276601 [0,1,0,0,0,0|2,0,1]=4 3540 B14R1.677 CC(O)CCSCc1ccc(cc1)F 62a_100012276601_100000187164 [0,1,0,0,0,0|2,0,1]=4 3541 B14R1.677 CC(O)CCSCc1ccc(cc1)I 62a_100000189116_100012276601 [0,1,0,0,0,0|2,0,1]=4 3542 B14R1.677 CC(O)CCSCc1ccc(cc1)I 62a_100012276601_100000189116 [0,1,0,0,0,0|2,0,1]=4 3543 B14R1.677 CC(O)CNCCc1ccc(cc1)Br 2230a_100000210904_100011740612 [0,1,0,0,0,0|2,0,1]=4 3544 B14R1.677 CC(O)CNCCc1ccc(cc1)Br 2230a_100000755846_100011218427 [0,1,0,0,0,0|2,0,1]=4 3545 B14R1.677 CC(O)CNCCc1ccc(cc1)Br 34a_100000210904_100011740612 [0,1,0,0,0,0|2,0,1]=4 3546 B14R1.677 CC(O)CNCCc1ccc(cc1)Br 34a_100000755846_100011218427 [0,1,0,0,0,0|2,0,1]=4 3547 B14R1.677 CC(O)CNCCc1ccc(cc1)Cl 2230a_100000185265_100011218427 [0,1,0,0,0,0|2,0,1]=4 3548 B14R1.677 CC(O)CNCCc1ccc(cc1)Cl 2230a_100000210904_100011713675 [0,1,0,0,0,0|2,0,1]=4 3549 B14R1.677 CC(O)CNCCc1ccc(cc1)Cl 34a_100000185265_100011218427 [0,1,0,0,0,0|2,0,1]=4 3550 B14R1.677 CC(O)CNCCc1ccc(cc1)Cl 34a_100000210904_100011713675 [0,1,0,0,0,0|2,0,1]=4 3551 B14R1.677 CC(O)CNCCc1ccc(cc1)F 2230a_100000199005_100011218427 [0,1,0,0,0,0|2,0,1]=4 3552 B14R1.677 CC(O)CNCCc1ccc(cc1)F 2230a_100000210904_100011217392 [0,1,0,0,0,0|2,0,1]=4 3553 B14R1.677 CC(O)CNCCc1ccc(cc1)F 34a_100000199005_100011218427 [0,1,0,0,0,0|2,0,1]=4 3554 B14R1.677 CC(O)CNCCc1ccc(cc1)F 34a_100000210904_100011217392 [0,1,0,0,0,0|2,0,1]=4 3555 B14R1.677 CC(O)CNCCc1ccc(cc1)O 2230a_100000210904_100009816426 [0,1,0,0,0,0|2,0,1]=4 3556 B14R1.677 CC(O)CNCCc1ccc(cc1)O 34a_100000743037_100011218427 [0,1,0,0,0,0|2,0,1]=4 3557 B14R1.677 CC(O)COCCc1ccc(cc1)Br 34a_100000766406_100011218427 [0,1,0,0,0,0|2,0,1]=4 3558 B14R1.677 CC(O)COCCc1ccc(cc1)Br 7a_100000766406_100011218427 [0,1,0,0,0,0|2,0,1]=4 3559 B14R1.677 CC(O)COCCc1ccc(cc1)Cl 34a_100011219627_100011218427 [0,1,0,0,0,0|2,0,1]=4 3560 B14R1.677 CC(O)COCCc1ccc(cc1)Cl 7a_100011219627_100011218427 [0,1,0,0,0,0|2,0,1]=4 3561 B14R1.677 CC(O)COCCc1ccc(cc1)F 34a_100000754732_100011218427 [0,1,0,0,0,0|2,0,1]=4 3562 B14R1.677 CC(O)COCCc1ccc(cc1)F 7a_100000754732_100011218427 [0,1,0,0,0,0|2,0,1]=4 3563 B14R1.677 CC(O)COCCc1ccc(cc1)I 34a_100012291149_100011218427 [0,1,0,0,0,0|2,0,1]=4 3564 B14R1.677 CC(O)COCCc1ccc(cc1)I 7a_100012291149_100011218427 [0,1,0,0,0,0|2,0,1]=4 3565 B14R1.677 CC(O)COCCc1ccc(cc1)N 34a_100011204434_100011218427 [0,1,0,0,0,0|2,0,1]=4 3566 B14R1.677 CC(O)CSCCc1ccc(cc1)Br 62a_100011218427_100011740612 [0,1,0,0,0,0|2,0,1]=4 3567 B14R1.677 CC(O)CSCCc1ccc(cc1)Br 62a_100011740612_100011218427 [0,1,0,0,0,0|2,0,1]=4 3568 B14R1.677 CC(O)CSCCc1ccc(cc1)Cl 62a_100011218427_100011713675 [0,1,0,0,0,0|2,0,1]=4 3569 B14R1.677 CC(O)CSCCc1ccc(cc1)Cl 62a_100011713675_100011218427 [0,1,0,0,0,0|2,0,1]=4 3570 B14R1.677 CC(O)CSCCc1ccc(cc1)F 62a_100011217392_100011218427 [0,1,0,0,0,0|2,0,1]=4 3571 B14R1.677 CC(O)CSCCc1ccc(cc1)F 62a_100011218427_100011217392 [0,1,0,0,0,0|2,0,1]=4 3572 B14R1.677 CC(O)CSCCc1ccc(cc1)O 62a_100009816426_100011218427 [0,1,0,0,0,0|2,0,1]=4 3573 B14R1.677 CC(O)CSCCc1ccc(cc1)O 62a_100011218427_100009816426 [0,1,0,0,0,0|2,0,1]=4 3574 B14R1.677 CN(C)CCCCc1ccc(cc1)Br 2230a_100102631434_200012094861 [0,1,0,0,0,0|3,0,0]=4 3575 B14R1.677 CN(C)CCCCc1ccc(cc1)Br 269982a_100102631434_200012094861 [0,1,0,0,0,0|3,0,0]=4 3576 B14R1.677 CN(C)CCCCc1ccc(cc1)F 2230a_100102631434_100012093538 [0,1,0,0,0,0|3,0,0]=4 3577 B14R1.677 CN(C)CCCCc1ccc(cc1)F 269982a_100102631434_100012093538 [0,1,0,0,0,0|3,0,0]=4 3578 B14R1.677 C[C@@H](O)CNCCc1ccc(cc1)Br 2230a_100000755846_100009817552 [0,1,0,0,0,0|2,0,1]=4 3579 B14R1.677 C[C@@H](O)CNCCc1ccc(cc1)Br 34a_100000755846_100009817552 [0,1,0,0,0,0|2,0,1]=4 3580 B14R1.677 C[C@@H](O)CNCCc1ccc(cc1)Cl 2230a_100000185265_100009817552 [0,1,0,0,0,0|2,0,1]=4 3581 B14R1.677 C[C@@H](O)CNCCc1ccc(cc1)Cl 34a_100000185265_100009817552 [0,1,0,0,0,0|2,0,1]=4 3582 B14R1.677 C[C@@H](O)CNCCc1ccc(cc1)F 2230a_100000199005_100009817552 [0,1,0,0,0,0|2,0,1]=4 3583 B14R1.677 C[C@@H](O)CNCCc1ccc(cc1)F 34a_100000199005_100009817552 [0,1,0,0,0,0|2,0,1]=4 3584 B14R1.677 C[C@@H](O)CNCCc1ccc(cc1)O 34a_100000743037_100009817552 [0,1,0,0,0,0|2,0,1]=4 3585 B14R1.677 C[C@@H](O)COCCc1ccc(cc1)Br 34a_100000766406_100009817552 [0,1,0,0,0,0|2,0,1]=4 3586 B14R1.677 C[C@@H](O)COCCc1ccc(cc1)Br 7a_100000766406_100009817552 [0,1,0,0,0,0|2,0,1]=4 3587 B14R1.677 C[C@@H](O)COCCc1ccc(cc1)Cl 34a_100011219627_100009817552 [0,1,0,0,0,0|2,0,1]=4 3588 B14R1.677 C[C@@H](O)COCCc1ccc(cc1)Cl 7a_100011219627_100009817552 [0,1,0,0,0,0|2,0,1]=4 3589 B14R1.677 C[C@@H](O)COCCc1ccc(cc1)F 34a_100000754732_100009817552 [0,1,0,0,0,0|2,0,1]=4 3590 B14R1.677 C[C@@H](O)COCCc1ccc(cc1)F 7a_100000754732_100009817552 [0,1,0,0,0,0|2,0,1]=4 3591 B14R1.677 C[C@@H](O)COCCc1ccc(cc1)I 34a_100012291149_100009817552 [0,1,0,0,0,0|2,0,1]=4 3592 B14R1.677 C[C@@H](O)COCCc1ccc(cc1)I 7a_100012291149_100009817552 [0,1,0,0,0,0|2,0,1]=4 3593 B14R1.677 C[C@@H](O)COCCc1ccc(cc1)N 34a_100011204434_100009817552 [0,1,0,0,0,0|2,0,1]=4 3594 B14R1.677 C[C@@H](O)CSCCc1ccc(cc1)Br 62a_100009817552_100011740612 [0,1,0,0,0,0|2,0,1]=4 3595 B14R1.677 C[C@@H](O)CSCCc1ccc(cc1)Br 62a_100011740612_100009817552 [0,1,0,0,0,0|2,0,1]=4 3596 B14R1.677 C[C@@H](O)CSCCc1ccc(cc1)Cl 62a_100009817552_100011713675 [0,1,0,0,0,0|2,0,1]=4 3597 B14R1.677 C[C@@H](O)CSCCc1ccc(cc1)Cl 62a_100011713675_100009817552 [0,1,0,0,0,0|2,0,1]=4 3598 B14R1.677 C[C@@H](O)CSCCc1ccc(cc1)F 62a_100009817552_100011217392 [0,1,0,0,0,0|2,0,1]=4 3599 B14R1.677 C[C@@H](O)CSCCc1ccc(cc1)F 62a_100011217392_100009817552 [0,1,0,0,0,0|2,0,1]=4 3600 B14R1.677 C[C@@H](O)CSCCc1ccc(cc1)O 62a_100009816426_100009817552 [0,1,0,0,0,0|2,0,1]=4 3601 B14R1.677 C[C@@H](O)CSCCc1ccc(cc1)O 62a_100009817552_100009816426 [0,1,0,0,0,0|2,0,1]=4 3602 B14R1.677 C[n+]1ccc(cc1)COCCC(=O)N 34a_100009831711_100000731001 [0,1,0,0,0,0|3,0,0]=4 3603 B14R1.677 Cc1ccc(cc1)CCNCC(=O)N 2230a_100000705350_100000747473 [0,1,0,0,0,0|2,0,0]=3 3604 B14R1.677 Cc1ccc(cc1)CCNCC(=O)N 2230a_100000711301_100011713686 [0,1,0,0,0,0|2,0,0]=3 3605 B14R1.677 Cc1ccc(cc1)CCNCC(=O)N 34a_100000705350_100000187820 [0,1,0,0,0,0|2,0,0]=3 3606 B14R1.677 Cc1ccc(cc1)CCNCC(=O)O 269956a_100016091260_100011713686 [0,1,0,0,0,0|1,0,0]=2 3607 B14R1.677 Cc1ccc(cc1)CCNCC(=O)[O-] 34a_100000705350_100020667443 [0,1,0,0,0,0|1,0,1]=3 3608 B14R1.677 Cc1ccc(cc1)CCNCC(C)O 2230a_100000210904_100011713686 [0,1,0,0,0,0|2,0,1]=4 3609 B14R1.677 Cc1ccc(cc1)CCNCC(C)O 2230a_100000705350_100011218427 [0,1,0,0,0,0|2,0,1]=4 3610 B14R1.677 Cc1ccc(cc1)CCNCC(C)O 34a_100000210904_100011713686 [0,1,0,0,0,0|2,0,1]=4 3611 B14R1.677 Cc1ccc(cc1)CCNCC(C)O 34a_100000705350_100011218427 [0,1,0,0,0,0|2,0,1]=4 3612 B14R1.677 Cc1ccc(cc1)CCNC[C@@H](C)O 2230a_100000705350_100009817552 [0,1,0,0,0,0|2,0,1]=4 3613 B14R1.677 Cc1ccc(cc1)CCNC[C@@H](C)O 34a_100000705350_100009817552 [0,1,0,0,0,0|2,0,1]=4 3614 B14R1.677 Cc1ccc(cc1)CCNC[N+](=O)[O-] 34a_100000705350_100000761209 [0,1,0,0,0,0|2,0,1]=4 3615 B14R1.677 Cc1ccc(cc1)CCOCC(=O)N 34a_100000756670_100000187820 [0,1,0,0,0,0|2,0,0]=3 3616 B14R1.677 Cc1ccc(cc1)CCOCC(=O)N 7a_100000756670_100000187820 [0,1,0,0,0,0|2,0,0]=3 3617 B14R1.677 Cc1ccc(cc1)CCOCC(=O)[O-] 34a_100000756670_100020667443 [0,1,0,0,0,0|1,0,1]=3 3618 B14R1.677 Cc1ccc(cc1)CCOCC(C)O 34a_100000756670_100011218427 [0,1,0,0,0,0|2,0,1]=4 3619 B14R1.677 Cc1ccc(cc1)CCOCC(C)O 7a_100000756670_100011218427 [0,1,0,0,0,0|2,0,1]=4 3620 B14R1.677 Cc1ccc(cc1)CCOC[C@@H](C)O 34a_100000756670_100009817552 [0,1,0,0,0,0|2,0,1]=4 3621 B14R1.677 Cc1ccc(cc1)CCOC[C@@H](C)O 7a_100000756670_100009817552 [0,1,0,0,0,0|2,0,1]=4 3622 B14R1.677 Cc1ccc(cc1)CCOC[N+](=O)[O-] 34a_100000756670_100000761209 [0,1,0,0,0,0|2,0,1]=4 3623 B14R1.677 Cc1ccc(cc1)CCSCC(=O)N 62a_100000747473_100011713686 [0,1,0,0,0,0|2,0,0]=3 3624 B14R1.677 Cc1ccc(cc1)CCSCC(=O)N 62a_100011713686_100000747473 [0,1,0,0,0,0|2,0,0]=3 3625 B14R1.677 Cc1ccc(cc1)CCSCC(=O)[O-] 62a_100011713686_100020667443 [0,1,0,0,0,0|1,0,1]=3 3626 B14R1.677 Cc1ccc(cc1)CCSCC(=O)[O-] 62a_100020667443_100011713686 [0,1,0,0,0,0|1,0,1]=3 3627 B14R1.677 Cc1ccc(cc1)CCSCC(C)O 62a_100011218427_100011713686 [0,1,0,0,0,0|2,0,1]=4 3628 B14R1.677 Cc1ccc(cc1)CCSCC(C)O 62a_100011713686_100011218427 [0,1,0,0,0,0|2,0,1]=4 3629 B14R1.677 Cc1ccc(cc1)CCSC[C@@H](C)O 62a_100009817552_100011713686 [0,1,0,0,0,0|2,0,1]=4 3630 B14R1.677 Cc1ccc(cc1)CCSC[C@@H](C)O 62a_100011713686_100009817552 [0,1,0,0,0,0|2,0,1]=4 3631 B14R1.677 Cc1ccc(cc1)CCSC[N+](=O)[O-] 62a_100011713686_100000761209 [0,1,0,0,0,0|2,0,1]=4 3632 B14R1.677 Cc1ccc(cc1)CNCCC(=O)N 207a_100000740010_100000211033 [0,1,0,0,0,0|2,0,0]=3 3633 B14R1.677 Cc1ccc(cc1)CNCCC(=O)N 2230a_100000174908_100000744528 [0,1,0,0,0,0|2,0,0]=3 3634 B14R1.677 Cc1ccc(cc1)CNCCC(=O)N 34a_100000174908_100000731001 [0,1,0,0,0,0|2,0,0]=3 3635 B14R1.677 Cc1ccc(cc1)CNCCC(C)O 207a_200000755665_100000211033 [0,1,0,0,0,0|2,0,1]=4 3636 B14R1.677 Cc1ccc(cc1)CNCCC(C)O 2230a_100000174908_100012276601 [0,1,0,0,0,0|2,0,1]=4 3637 B14R1.677 Cc1ccc(cc1)CNCCC(C)O 2230a_200000755665_100000210814 [0,1,0,0,0,0|2,0,1]=4 3638 B14R1.677 Cc1ccc(cc1)CNCCC(C)O 270004a_200000755665_100000211033 [0,1,0,0,0,0|2,0,1]=4 3639 B14R1.677 Cc1ccc(cc1)CNCCC(C)O 34a_100000174908_100012276601 [0,1,0,0,0,0|2,0,1]=4 3640 B14R1.677 Cc1ccc(cc1)CNOCC(=O)O 269956a_100000106656_100000210814 [0,1,0,0,0,0|2,0,0]=3 3641 B14R1.677 Cc1ccc(cc1)COCCC(=O)N 34a_100000757172_100000210814 [0,1,0,0,0,0|2,0,0]=3 3642 B14R1.677 Cc1ccc(cc1)COCCC(=O)N 34a_100011215236_100000731001 [0,1,0,0,0,0|2,0,0]=3 3643 B14R1.677 Cc1ccc(cc1)COCCC(=O)N 7a_100000757172_100000210814 [0,1,0,0,0,0|2,0,0]=3 3644 B14R1.677 Cc1ccc(cc1)COCCC(=O)N 7a_100011215236_100000744528 [0,1,0,0,0,0|2,0,0]=3 3645 B14R1.677 Cc1ccc(cc1)COCCC(C)O 34a_100011215236_100012276601 [0,1,0,0,0,0|2,0,1]=4 3646 B14R1.677 Cc1ccc(cc1)COCCC(C)O 7a_100011215236_100012276601 [0,1,0,0,0,0|2,0,1]=4 3647 B14R1.677 Cc1ccc(cc1)CSCCC(=O)N 62a_100000210814_100000744528 [0,1,0,0,0,0|2,0,0]=3 3648 B14R1.677 Cc1ccc(cc1)CSCCC(=O)N 62a_100000744528_100000210814 [0,1,0,0,0,0|2,0,0]=3 3649 B14R1.677 Cc1ccc(cc1)CSCCC(=O)[13CH3] 1458a_200000173737_200025704644 [0,1,0,0,0,0|2,0,0]=3 3650 B14R1.677 Cc1ccc(cc1)CSCCC(C)O 62a_100000210814_100012276601 [0,1,0,0,0,0|2,0,1]=4 3651 B14R1.677 Cc1ccc(cc1)CSCCC(C)O 62a_100012276601_100000210814 [0,1,0,0,0,0|2,0,1]=4 3652 B14R1.677 Cc1ccc(cc1)NCCCC(=O)N 34a_100000124888_100102525003 [0,1,0,0,0,0|2,0,0]=3 3653 B14R1.677 Cc1ccc(cc1)NCCCC(C)O 34a_100000124888_200000718107 [0,1,0,0,0,0|2,0,1]=4 3654 B14R1.677 Cc1ccc(cc1)NCCOC(=O)N 34a_100000124888_200011214921 [0,1,0,0,0,0|3,0,0]=4 3655 B14R1.677 Cc1ccc(cc1)OCCCC(=O)N 34a_100000210336_100102525003 [0,1,0,0,0,0|2,0,0]=3 3656 B14R1.677 Cc1ccc(cc1)OCCCC(=O)N 7a_100000210336_100102525003 [0,1,0,0,0,0|2,0,0]=3 3657 B14R1.677 Cc1ccc(cc1)OCCCC(=O)[13CH3] 1458a_100000182836_200025704644 [0,1,0,0,0,0|2,0,0]=3 3658 B14R1.677 Cc1ccc(cc1)OCCCC(C)O 34a_100000210336_200000718107 [0,1,0,0,0,0|2,0,1]=4 3659 B14R1.677 Cc1ccc(cc1)OCCCC(C)O 7a_100000210336_200000718107 [0,1,0,0,0,0|2,0,1]=4 3660 B14R1.677 Cc1ccc(cc1)OCCNC(=O)N 7a_100000210336_200000034859 [0,1,0,0,0,0|3,0,0]=4 3661 B14R1.677 Cc1ccc(cc1)OCCOC(=O)N 34a_100000210336_200011214921 [0,1,0,0,0,0|3,0,0]=4 3662 B14R1.677 Cc1ccc(cc1)OCCOC(=O)N 7a_100000210336_200011214921 [0,1,0,0,0,0|3,0,0]=4 3663 B14R1.677 Cc1ccc(cc1)SCCCC(=O)N 62a_100000186775_100102525003 [0,1,0,0,0,0|2,0,0]=3 3664 B14R1.677 Cc1ccc(cc1)SCCCC(=O)N 62a_100102525003_100000186775 [0,1,0,0,0,0|2,0,0]=3 3665 B14R1.677 Cc1ccc(cc1)SCCCC(C)O 62a_100000186775_200000718107 [0,1,0,0,0,0|2,0,1]=4 3666 B14R1.677 Cc1ccc(cc1)SCCCC(C)O 62a_200000718107_100000186775 [0,1,0,0,0,0|2,0,1]=4 3667 B14R1.677 Cc1ccc(cc1)SCCNC(=O)N 62a_100000186775_200000034859 [0,1,0,0,0,0|3,0,0]=4 3668 B14R1.677 Cc1ccc(cc1)SCCNC(=O)N 62a_200000034859_100000186775 [0,1,0,0,0,0|3,0,0]=4 3669 B14R1.677 Cc1ccc(cc1)SCCOC(=O)N 62a_100000186775_200011214921 [0,1,0,0,0,0|3,0,0]=4 3670 B14R1.677 Cc1ccc(cc1)SCCOC(=O)N 62a_200011214921_100000186775 [0,1,0,0,0,0|3,0,0]=4 3671 B14R1.677 Cc1ccc(cn1)CCOCC(=O)N 34a_100011815783_100000187820 [0,1,0,0,0,0|3,0,0]=4 3672 B14R1.677 Cc1ccc(cn1)CCOCC(=O)[O-] 34a_100011815783_100020667443 [0,1,0,0,0,0|2,0,1]=4 3673 B14R1.677 Cc1ccc(cn1)CNCCC(=O)N 34a_100000740942_100000731001 [0,1,0,0,0,0|3,0,0]=4 3674 B14R1.677 Cc1ccc(cn1)CNOCC(=O)O 269956a_100000106656_100016987292 [0,1,0,0,0,0|3,0,0]=4 3675 B14R1.677 Cc1ccc(cn1)COCCC(=O)N 34a_100000757172_100016987292 [0,1,0,0,0,0|3,0,0]=4 3676 B14R1.677 Cc1ccc(cn1)COCCC(=O)N 34a_100011248133_100000731001 [0,1,0,0,0,0|3,0,0]=4 3677 B14R1.677 Cc1ccc(cn1)COCCC(=O)N 7a_100000757172_100016987292 [0,1,0,0,0,0|3,0,0]=4 3678 B14R1.677 Cc1ccc(cn1)CSCCC(=O)N 62a_100000744528_100016987292 [0,1,0,0,0,0|3,0,0]=4 3679 B14R1.677 Cc1ccc(cn1)CSCCC(=O)N 62a_100016987292_100000744528 [0,1,0,0,0,0|3,0,0]=4 3680 B14R1.677 Cc1ccc(cn1)OCCCC(=O)N 34a_100000745506_100102525003 [0,1,0,0,0,0|3,0,0]=4 3681 B14R1.677 Cc1ccc(cn1)OCCCC(=O)N 7a_100000745506_100102525003 [0,1,0,0,0,0|3,0,0]=4 3682 B14R1.677 Cc1ccc(cn1)SCCCC(=O)N 62a_100000751577_100102525003 [0,1,0,0,0,0|3,0,0]=4 3683 B14R1.677 Cc1ccc(cn1)SCCCC(=O)N 62a_100102525003_100000751577 [0,1,0,0,0,0|3,0,0]=4 3684 B14R1.677 Cc1ccc(nc1)CNCCC(=O)N 207a_100000740010_100000050478 [0,1,0,0,0,0|3,0,0]=4 3685 B14R1.677 Cc1ccc(nc1)CNCCC(=O)N 34a_100015187455_100000731001 [0,1,0,0,0,0|3,0,0]=4 3686 B14R1.677 Cc1ccc(nc1)CNOCC(=O)O 269956a_100000106656_100000691093 [0,1,0,0,0,0|3,0,0]=4 3687 B14R1.677 Cc1ccc(nc1)COCCC(=O)N 34a_100000757172_100000691093 [0,1,0,0,0,0|3,0,0]=4 3688 B14R1.677 Cc1ccc(nc1)COCCC(=O)N 34a_100012001401_100000731001 [0,1,0,0,0,0|3,0,0]=4 3689 B14R1.677 Cc1ccc(nc1)COCCC(=O)N 7a_100000757172_100000691093 [0,1,0,0,0,0|3,0,0]=4 3690 B14R1.677 Cc1ccc(nc1)CSCCC(=O)N 62a_100000691093_100000744528 [0,1,0,0,0,0|3,0,0]=4 3691 B14R1.677 Cc1ccc(nc1)CSCCC(=O)N 62a_100000744528_100000691093 [0,1,0,0,0,0|3,0,0]=4 3692 B14R1.677 Cc1ccc(nc1)OCCCC(=O)N 34a_100000759353_100102525003 [0,1,0,0,0,0|3,0,0]=4 3693 B14R1.677 Cc1ccc(nc1)SCCCC(=O)N 62a_100011192072_100102525003 [0,1,0,0,0,0|3,0,0]=4 3694 B14R1.677 Cc1ccc(nc1)SCCCC(=O)N 62a_100102525003_100000754016 [0,1,0,0,0,0|3,0,0]=4 3695 B14R1.677 NC(=O)CCCNc1ccc(cc1)Br 34a_100000210018_100102525003 [0,1,0,0,0,0|2,0,0]=3 3696 B14R1.677 NC(=O)CCCNc1ccc(cc1)Cl 34a_100000210052_100102525003 [0,1,0,0,0,0|2,0,0]=3 3697 B14R1.677 NC(=O)CCCNc1ccc(cc1)F 34a_100000185862_100102525003 [0,1,0,0,0,0|2,0,0]=3 3698 B14R1.677 NC(=O)CCCNc1ccc(cc1)I 34a_100000185761_100102525003 [0,1,0,0,0,0|2,0,0]=3 3699 B14R1.677 NC(=O)CCCNc1ccc(cc1)O 34a_100000185829_100102525003 [0,1,0,0,0,0|2,0,0]=3 3700 B14R1.677 NC(=O)CCCNc1ccc(cn1)Br 27a_100000739312_100000686858 [0,1,0,0,0,0|3,0,0]=4 3701 B14R1.677 NC(=O)CCCOc1ccc(=O)[nH]c1 34a_100000075641_100102525003 [0,1,0,0,0,0|3,0,0]=4 3702 B14R1.677 NC(=O)CCCOc1ccc(cc1)Br 34a_100000185759_100102525003 [0,1,0,0,0,0|2,0,0]=3 3703 B14R1.677 NC(=O)CCCOc1ccc(cc1)Br 7a_100000185759_100102525003 [0,1,0,0,0,0|2,0,0]=3 3704 B14R1.677 NC(=O)CCCOc1ccc(cc1)Cl 34a_100000210216_100102525003 [0,1,0,0,0,0|2,0,0]=3 3705 B14R1.677 NC(=O)CCCOc1ccc(cc1)Cl 7a_100000210216_100102525003 [0,1,0,0,0,0|2,0,0]=3 3706 B14R1.677 NC(=O)CCCOc1ccc(cc1)F 34a_100000210339_100102525003 [0,1,0,0,0,0|2,0,0]=3 3707 B14R1.677 NC(=O)CCCOc1ccc(cc1)I 34a_100000212066_100102525003 [0,1,0,0,0,0|2,0,0]=3 3708 B14R1.677 NC(=O)CCCOc1ccc(cc1)I 7a_100000212066_100102525003 [0,1,0,0,0,0|2,0,0]=3 3709 B14R1.677 NC(=O)CCCOc1ccc(cc1)N 34a_100000185829_100102525003 [0,1,0,0,0,0|2,0,0]=3 3710 B14R1.677 NC(=O)CCCOc1ccc(cn1)Cl 34a_100011215309_100102525003 [0,1,0,0,0,0|3,0,0]=4 3711 B14R1.677 NC(=O)CCCOc1ccc(cn1)F 34a_100000742473_100102525003 [0,1,0,0,0,0|3,0,0]=4 3712 B14R1.677 NC(=O)CCCOc1ccc(cn1)N 34a_100000729260_100102525003 [0,1,0,0,0,0|3,0,0]=4 3713 B14R1.677 NC(=O)CCCOc1ccc(nc1)Br 34a_100000685995_100102525003 [0,1,0,0,0,0|3,0,0]=4 3714 B14R1.677 NC(=O)CCCOc1ccc(nc1)Br 7a_100000685995_100102525003 [0,1,0,0,0,0|3,0,0]=4 3715 B14R1.677 NC(=O)CCCOc1ccc(nc1)Cl 34a_100000744096_100102525003 [0,1,0,0,0,0|3,0,0]=4 3716 B14R1.677 NC(=O)CCCOc1ccc(nc1)Cl 7a_100000744096_100102525003 [0,1,0,0,0,0|3,0,0]=4 3717 B14R1.677 NC(=O)CCCOc1ccc(nc1)F 34a_100000688820_100102525003 [0,1,0,0,0,0|3,0,0]=4 3718 B14R1.677 NC(=O)CCCOc1ccc(nc1)F 7a_100000688820_100102525003 [0,1,0,0,0,0|3,0,0]=4 3719 B14R1.677 NC(=O)CCCOc1ccc(nc1)I 34a_100000687607_100102525003 [0,1,0,0,0,0|3,0,0]=4 3720 B14R1.677 NC(=O)CCCOc1ccc(nc1)I 7a_100000687607_100102525003 [0,1,0,0,0,0|3,0,0]=4 3721 B14R1.677 NC(=O)CCCOc1ccc(nc1)N 34a_100015188713_100102525003 [0,1,0,0,0,0|3,0,0]=4 3722 B14R1.677 NC(=O)CCCOc1ccc(nc1)N 7a_100015188713_100102525003 [0,1,0,0,0,0|3,0,0]=4 3723 B14R1.677 NC(=O)CCCSc1cc[n+](cc1)[O-] 62a_100102525003_100000039755 [0,1,0,0,0,0|3,0,0]=4 3724 B14R1.677 NC(=O)CCCSc1ccc(=O)[nH]c1 62a_100000212171_100102525003 [0,1,0,0,0,0|3,0,0]=4 3725 B14R1.677 NC(=O)CCCSc1ccc(=O)[nH]c1 62a_100102525003_100000212171 [0,1,0,0,0,0|3,0,0]=4 3726 B14R1.677 NC(=O)CCCSc1ccc(cc1)Br 62a_100000752885_100102525003 [0,1,0,0,0,0|2,0,0]=3 3727 B14R1.677 NC(=O)CCCSc1ccc(cc1)Br 62a_100102525003_100000752885 [0,1,0,0,0,0|2,0,0]=3 3728 B14R1.677 NC(=O)CCCSc1ccc(cc1)Cl 62a_100000755918_100102525003 [0,1,0,0,0,0|2,0,0]=3 3729 B14R1.677 NC(=O)CCCSc1ccc(cc1)Cl 62a_100102525003_100000755918 [0,1,0,0,0,0|2,0,0]=3 3730 B14R1.677 NC(=O)CCCSc1ccc(cc1)F 62a_100000211213_100102525003 [0,1,0,0,0,0|2,0,0]=3 3731 B14R1.677 NC(=O)CCCSc1ccc(cc1)F 62a_100102525003_100000211213 [0,1,0,0,0,0|2,0,0]=3 3732 B14R1.677 NC(=O)CCCSc1ccc(cc1)N 62a_100000185761_100102525003 [0,1,0,0,0,0|2,0,0]=3 3733 B14R1.677 NC(=O)CCCSc1ccc(cc1)N 62a_100102525003_100000185761 [0,1,0,0,0,0|2,0,0]=3 3734 B14R1.677 NC(=O)CCCSc1ccc(cc1)O 62a_100102525003_100000185759 [0,1,0,0,0,0|2,0,0]=3 3735 B14R1.677 NC(=O)CCCSc1ccc(cn1)Br 62a_100000686858_100102525003 [0,1,0,0,0,0|3,0,0]=4 3736 B14R1.677 NC(=O)CCCSc1ccc(cn1)Br 62a_100102525003_100000686858 [0,1,0,0,0,0|3,0,0]=4 3737 B14R1.677 NC(=O)CCCSc1ccc(cn1)Cl 62a_100011356976_100102525003 [0,1,0,0,0,0|3,0,0]=4 3738 B14R1.677 NC(=O)CCCSc1ccc(cn1)Cl 62a_100102525003_100011356976 [0,1,0,0,0,0|3,0,0]=4 3739 B14R1.677 NC(=O)CCCSc1ccc(cn1)F 62a_100000744514_100102525003 [0,1,0,0,0,0|3,0,0]=4 3740 B14R1.677 NC(=O)CCCSc1ccc(cn1)F 62a_100102525003_100000744514 [0,1,0,0,0,0|3,0,0]=4 3741 B14R1.677 NC(=O)CCCSc1ccc(cn1)N 62a_100000737798_100102525003 [0,1,0,0,0,0|3,0,0]=4 3742 B14R1.677 NC(=O)CCCSc1ccc(cn1)N 62a_100102525003_100000737798 [0,1,0,0,0,0|3,0,0]=4 3743 B14R1.677 NC(=O)CCCSc1ccc(cn1)O 62a_100000685995_100102525003 [0,1,0,0,0,0|3,0,0]=4 3744 B14R1.677 NC(=O)CCCSc1ccc(cn1)O 62a_100102525003_100000744096 [0,1,0,0,0,0|3,0,0]=4 3745 B14R1.677 NC(=O)CCCSc1ccc(nc1)Br 62a_100009814638_100102525003 [0,1,0,0,0,0|3,0,0]=4 3746 B14R1.677 NC(=O)CCCSc1ccc(nc1)Br 62a_100102525003_100009814638 [0,1,0,0,0,0|3,0,0]=4 3747 B14R1.677 NC(=O)CCCSc1ccc(nc1)Cl 62a_100000034144_100102525003 [0,1,0,0,0,0|3,0,0]=4 3748 B14R1.677 NC(=O)CCCSc1ccc(nc1)Cl 62a_100102525003_100000034144 [0,1,0,0,0,0|3,0,0]=4 3749 B14R1.677 NC(=O)CCCSc1ccc(nc1)F 62a_100000042367_100102525003 [0,1,0,0,0,0|3,0,0]=4 3750 B14R1.677 NC(=O)CCCSc1ccc(nc1)F 62a_100102525003_100000042367 [0,1,0,0,0,0|3,0,0]=4 3751 B14R1.677 NC(=O)CCCSc1ccc(nc1)N 62a_100000187370_100102525003 [0,1,0,0,0,0|3,0,0]=4 3752 B14R1.677 NC(=O)CCCSc1ccc(nc1)N 62a_100102525003_100000187370 [0,1,0,0,0,0|3,0,0]=4 3753 B14R1.677 NC(=O)CCNCc1ccc(cc1)Br 207a_100000740010_100000186029 [0,1,0,0,0,0|2,0,0]=3 3754 B14R1.677 NC(=O)CCNCc1ccc(cc1)Br 2230a_100000174875_100000744528 [0,1,0,0,0,0|2,0,0]=3 3755 B14R1.677 NC(=O)CCNCc1ccc(cc1)Br 34a_100000174875_100000731001 [0,1,0,0,0,0|2,0,0]=3 3756 B14R1.677 NC(=O)CCNCc1ccc(cc1)Cl 207a_100000740010_100000189385 [0,1,0,0,0,0|2,0,0]=3 3757 B14R1.677 NC(=O)CCNCc1ccc(cc1)Cl 2230a_100000174871_100000744528 [0,1,0,0,0,0|2,0,0]=3 3758 B14R1.677 NC(=O)CCNCc1ccc(cc1)Cl 34a_100000174871_100000731001 [0,1,0,0,0,0|2,0,0]=3 3759 B14R1.677 NC(=O)CCNCc1ccc(cc1)F 207a_100000740010_100000210084 [0,1,0,0,0,0|2,0,0]=3 3760 B14R1.677 NC(=O)CCNCc1ccc(cc1)F 2230a_100000174882_100000744528 [0,1,0,0,0,0|2,0,0]=3 3761 B14R1.677 NC(=O)CCNCc1ccc(cc1)F 34a_100000174882_100000731001 [0,1,0,0,0,0|2,0,0]=3 3762 B14R1.677 NC(=O)CCNCc1ccc(cc1)I 207a_100000740010_100000188517 [0,1,0,0,0,0|2,0,0]=3 3763 B14R1.677 NC(=O)CCNCc1ccc(cc1)I 2230a_100016989417_100000744528 [0,1,0,0,0,0|2,0,0]=3 3764 B14R1.677 NC(=O)CCNCc1ccc(cc1)I 34a_100016989417_100000731001 [0,1,0,0,0,0|2,0,0]=3 3765 B14R1.677 NC(=O)CCNCc1ccc(cc1)O 34a_100000185549_100000731001 [0,1,0,0,0,0|2,0,0]=3 3766 B14R1.677 NC(=O)CCNCc1ccc(cn1)Br 207a_100000740010_100000754260 [0,1,0,0,0,0|3,0,0]=4 3767 B14R1.677 NC(=O)CCNCc1ccc(cn1)Br 34a_100015188789_100000731001 [0,1,0,0,0,0|3,0,0]=4 3768 B14R1.677 NC(=O)CCNCc1ccc(cn1)Cl 207a_100000740010_100011361569 [0,1,0,0,0,0|3,0,0]=4 3769 B14R1.677 NC(=O)CCNCc1ccc(cn1)Cl 34a_100000697193_100000731001 [0,1,0,0,0,0|3,0,0]=4 3770 B14R1.677 NC(=O)CCNCc1ccc(cn1)F 207a_100000740010_100011934744 [0,1,0,0,0,0|3,0,0]=4 3771 B14R1.677 NC(=O)CCNCc1ccc(cn1)F 34a_100020620131_100000731001 [0,1,0,0,0,0|3,0,0]=4 3772 B14R1.677 NC(=O)CCNCc1ccc(nc1)Br 2230a_100009817727_100000744528 [0,1,0,0,0,0|3,0,0]=4 3773 B14R1.677 NC(=O)CCNCc1ccc(nc1)Br 34a_100009817727_100000731001 [0,1,0,0,0,0|3,0,0]=4 3774 B14R1.677 NC(=O)CCNCc1ccc(nc1)Cl 2230a_100000735879_100000744528 [0,1,0,0,0,0|3,0,0]=4 3775 B14R1.677 NC(=O)CCNCc1ccc(nc1)Cl 34a_100000735879_100000731001 [0,1,0,0,0,0|3,0,0]=4 3776 B14R1.677 NC(=O)CCNCc1ccc(nc1)F 2230a_100000101913_100000744528 [0,1,0,0,0,0|3,0,0]=4 3777 B14R1.677 NC(=O)CCNCc1ccc(nc1)F 34a_100000101913_100000731001 [0,1,0,0,0,0|3,0,0]=4 3778 B14R1.677 NC(=O)CCNCc1ccc(nc1)O 207a_100000740010_100011361521 [0,1,0,0,0,0|3,0,0]=4 3779 B14R1.677 NC(=O)CCNCc1ccc(nc1)O 2230a_100000757128_100000744528 [0,1,0,0,0,0|3,0,0]=4 3780 B14R1.677 NC(=O)CCOCc1cc[n+](cc1)[O-] 34a_100000031831_100000731001 [0,1,0,0,0,0|3,0,0]=4 3781 B14R1.677 NC(=O)CCOCc1cc[n+](cc1)[O-] 7a_100000031831_100000744528 [0,1,0,0,0,0|3,0,0]=4 3782 B14R1.677 NC(=O)CCOCc1ccc(=O)[nH]c1 34a_100011999846_100000731001 [0,1,0,0,0,0|3,0,0]=4 3783 B14R1.677 NC(=O)CCOCc1ccc(cc1)Br 34a_100000695286_100000731001 [0,1,0,0,0,0|2,0,0]=3 3784 B14R1.677 NC(=O)CCOCc1ccc(cc1)Br 34a_100000757172_100000189115 [0,1,0,0,0,0|2,0,0]=3 3785 B14R1.677 NC(=O)CCOCc1ccc(cc1)Br 7a_100000757172_100011217064 [0,1,0,0,0,0|2,0,0]=3 3786 B14R1.677 NC(=O)CCOCc1ccc(cc1)Cl 34a_100000211118_100000731001 [0,1,0,0,0,0|2,0,0]=3 3787 B14R1.677 NC(=O)CCOCc1ccc(cc1)Cl 34a_100000757172_100000694040 [0,1,0,0,0,0|2,0,0]=3 3788 B14R1.677 NC(=O)CCOCc1ccc(cc1)Cl 7a_100000211118_100000744528 [0,1,0,0,0,0|2,0,0]=3 3789 B14R1.677 NC(=O)CCOCc1ccc(cc1)Cl 7a_100000757172_100000187161 [0,1,0,0,0,0|2,0,0]=3 3790 B14R1.677 NC(=O)CCOCc1ccc(cc1)F 34a_100000210977_100000731001 [0,1,0,0,0,0|2,0,0]=3 3791 B14R1.677 NC(=O)CCOCc1ccc(cc1)F 34a_100000757172_100000198546 [0,1,0,0,0,0|2,0,0]=3 3792 B14R1.677 NC(=O)CCOCc1ccc(cc1)F 7a_100000210977_100000744528 [0,1,0,0,0,0|2,0,0]=3 3793 B14R1.677 NC(=O)CCOCc1ccc(cc1)F 7a_100000757172_100000198546 [0,1,0,0,0,0|2,0,0]=3 3794 B14R1.677 NC(=O)CCOCc1ccc(cc1)I 34a_100000690907_100000731001 [0,1,0,0,0,0|2,0,0]=3 3795 B14R1.677 NC(=O)CCOCc1ccc(cc1)I 34a_100000757172_100000189116 [0,1,0,0,0,0|2,0,0]=3 3796 B14R1.677 NC(=O)CCOCc1ccc(cc1)I 7a_100000690907_100000744528 [0,1,0,0,0,0|2,0,0]=3 3797 B14R1.677 NC(=O)CCOCc1ccc(cc1)I 7a_100000757172_100000189116 [0,1,0,0,0,0|2,0,0]=3 3798 B14R1.677 NC(=O)CCOCc1ccc(cc1)N 34a_100011215238_100000731001 [0,1,0,0,0,0|2,0,0]=3 3799 B14R1.677 NC(=O)CCOCc1ccc(cn1)Br 34a_100000754261_100000731001 [0,1,0,0,0,0|3,0,0]=4 3800 B14R1.677 NC(=O)CCOCc1ccc(cn1)Br 34a_100000757172_100000702658 [0,1,0,0,0,0|3,0,0]=4 3801 B14R1.677 NC(=O)CCOCc1ccc(cn1)Br 7a_100000757172_100000702658 [0,1,0,0,0,0|3,0,0]=4 3802 B14R1.677 NC(=O)CCOCc1ccc(cn1)Cl 34a_100000703999_100000731001 [0,1,0,0,0,0|3,0,0]=4 3803 B14R1.677 NC(=O)CCOCc1ccc(cn1)Cl 34a_100000757172_100012066911 [0,1,0,0,0,0|3,0,0]=4 3804 B14R1.677 NC(=O)CCOCc1ccc(cn1)Cl 7a_100000757172_100012066911 [0,1,0,0,0,0|3,0,0]=4 3805 B14R1.677 NC(=O)CCOCc1ccc(cn1)F 34a_100000757172_100000703193 [0,1,0,0,0,0|3,0,0]=4 3806 B14R1.677 NC(=O)CCOCc1ccc(cn1)F 34a_100011999454_100000731001 [0,1,0,0,0,0|3,0,0]=4 3807 B14R1.677 NC(=O)CCOCc1ccc(cn1)F 7a_100000757172_100000703193 [0,1,0,0,0,0|3,0,0]=4 3808 B14R1.677 NC(=O)CCOCc1ccc(cn1)N 34a_100011998161_100000731001 [0,1,0,0,0,0|3,0,0]=4 3809 B14R1.677 NC(=O)CCOCc1ccc(nc1)Br 34a_100000757172_100009831999 [0,1,0,0,0,0|3,0,0]=4 3810 B14R1.677 NC(=O)CCOCc1ccc(nc1)Br 34a_100009816760_100000731001 [0,1,0,0,0,0|3,0,0]=4 3811 B14R1.677 NC(=O)CCOCc1ccc(nc1)Br 7a_100000757172_100009831999 [0,1,0,0,0,0|3,0,0]=4 3812 B14R1.677 NC(=O)CCOCc1ccc(nc1)Br 7a_100009816760_100000744528 [0,1,0,0,0,0|3,0,0]=4 3813 B14R1.677 NC(=O)CCOCc1ccc(nc1)Cl 34a_100000755211_100000731001 [0,1,0,0,0,0|3,0,0]=4 3814 B14R1.677 NC(=O)CCOCc1ccc(nc1)Cl 34a_100000757172_100000735431 [0,1,0,0,0,0|3,0,0]=4 3815 B14R1.677 NC(=O)CCOCc1ccc(nc1)Cl 7a_100000755211_100000744528 [0,1,0,0,0,0|3,0,0]=4 3816 B14R1.677 NC(=O)CCOCc1ccc(nc1)Cl 7a_100000757172_100000735431 [0,1,0,0,0,0|3,0,0]=4 3817 B14R1.677 NC(=O)CCOCc1ccc(nc1)F 34a_100000079959_100000731001 [0,1,0,0,0,0|3,0,0]=4 3818 B14R1.677 NC(=O)CCOCc1ccc(nc1)F 34a_100000757172_100000099788 [0,1,0,0,0,0|3,0,0]=4 3819 B14R1.677 NC(=O)CCOCc1ccc(nc1)F 7a_100000757172_100009820150 [0,1,0,0,0,0|3,0,0]=4 3820 B14R1.677 NC(=O)CCOCc1ccc(nc1)N 34a_100000704267_100000731001 [0,1,0,0,0,0|3,0,0]=4 3821 B14R1.677 NC(=O)CCSCc1ccc(cc1)Br 62a_100000189115_100000744528 [0,1,0,0,0,0|2,0,0]=3 3822 B14R1.677 NC(=O)CCSCc1ccc(cc1)Br 62a_100000744528_100000189115 [0,1,0,0,0,0|2,0,0]=3 3823 B14R1.677 NC(=O)CCSCc1ccc(cc1)Cl 62a_100000187161_100000744528 [0,1,0,0,0,0|2,0,0]=3 3824 B14R1.677 NC(=O)CCSCc1ccc(cc1)Cl 62a_100000744528_100000187161 [0,1,0,0,0,0|2,0,0]=3 3825 B14R1.677 NC(=O)CCSCc1ccc(cc1)F 62a_100000198546_100000744528 [0,1,0,0,0,0|2,0,0]=3 3826 B14R1.677 NC(=O)CCSCc1ccc(cc1)F 62a_100000744528_100000187164 [0,1,0,0,0,0|2,0,0]=3 3827 B14R1.677 NC(=O)CCSCc1ccc(cc1)I 62a_100000189116_100000744528 [0,1,0,0,0,0|2,0,0]=3 3828 B14R1.677 NC(=O)CCSCc1ccc(cc1)I 62a_100000744528_100000189116 [0,1,0,0,0,0|2,0,0]=3 3829 B14R1.677 NC(=O)CCSCc1ccc(cn1)Br 62a_100000702658_100000744528 [0,1,0,0,0,0|3,0,0]=4 3830 B14R1.677 NC(=O)CCSCc1ccc(cn1)Br 62a_100000744528_100000702658 [0,1,0,0,0,0|3,0,0]=4 3831 B14R1.677 NC(=O)CCSCc1ccc(cn1)Cl 62a_100000744528_100000697101 [0,1,0,0,0,0|3,0,0]=4 3832 B14R1.677 NC(=O)CCSCc1ccc(cn1)Cl 62a_100012066911_100000744528 [0,1,0,0,0,0|3,0,0]=4 3833 B14R1.677 NC(=O)CCSCc1ccc(cn1)F 62a_100000703193_100000744528 [0,1,0,0,0,0|3,0,0]=4 3834 B14R1.677 NC(=O)CCSCc1ccc(cn1)F 62a_100000744528_100000703193 [0,1,0,0,0,0|3,0,0]=4 3835 B14R1.677 NC(=O)CCSCc1ccc(nc1)Br 62a_100000744528_100009831999 [0,1,0,0,0,0|3,0,0]=4 3836 B14R1.677 NC(=O)CCSCc1ccc(nc1)Br 62a_100009831999_100000744528 [0,1,0,0,0,0|3,0,0]=4 3837 B14R1.677 NC(=O)CCSCc1ccc(nc1)Cl 62a_100000735431_100000744528 [0,1,0,0,0,0|3,0,0]=4 3838 B14R1.677 NC(=O)CCSCc1ccc(nc1)Cl 62a_100000744528_100000735431 [0,1,0,0,0,0|3,0,0]=4 3839 B14R1.677 NC(=O)CCSCc1ccc(nc1)F 62a_100000744528_100000099788 [0,1,0,0,0,0|3,0,0]=4 3840 B14R1.677 NC(=O)CCSCc1ccc(nc1)F 62a_100009820150_100000744528 [0,1,0,0,0,0|3,0,0]=4 3841 B14R1.677 NC(=O)CNCCc1ccc(cc1)Br 2230a_100000711301_100011740612 [0,1,0,0,0,0|2,0,0]=3 3842 B14R1.677 NC(=O)CNCCc1ccc(cc1)Br 2230a_100000755846_100000747473 [0,1,0,0,0,0|2,0,0]=3 3843 B14R1.677 NC(=O)CNCCc1ccc(cc1)Br 34a_100000755846_100000187820 [0,1,0,0,0,0|2,0,0]=3 3844 B14R1.677 NC(=O)CNCCc1ccc(cc1)Cl 2230a_100000185265_100000747473 [0,1,0,0,0,0|2,0,0]=3 3845 B14R1.677 NC(=O)CNCCc1ccc(cc1)Cl 2230a_100000711301_100011713675 [0,1,0,0,0,0|2,0,0]=3 3846 B14R1.677 NC(=O)CNCCc1ccc(cc1)Cl 34a_100000185265_100000187820 [0,1,0,0,0,0|2,0,0]=3 3847 B14R1.677 NC(=O)CNCCc1ccc(cc1)F 2230a_100000199005_100000747473 [0,1,0,0,0,0|2,0,0]=3 3848 B14R1.677 NC(=O)CNCCc1ccc(cc1)F 2230a_100000711301_100011217392 [0,1,0,0,0,0|2,0,0]=3 3849 B14R1.677 NC(=O)CNCCc1ccc(cc1)F 34a_100000199005_100000187820 [0,1,0,0,0,0|2,0,0]=3 3850 B14R1.677 NC(=O)CNCCc1ccc(cc1)O 2230a_100000711301_100009816426 [0,1,0,0,0,0|2,0,0]=3 3851 B14R1.677 NC(=O)CNCCc1ccc(cc1)O 34a_100000743037_100000187820 [0,1,0,0,0,0|2,0,0]=3 3852 B14R1.677 NC(=O)COCCc1ccc(cc1)Br 34a_100000766406_100000187820 [0,1,0,0,0,0|2,0,0]=3 3853 B14R1.677 NC(=O)COCCc1ccc(cc1)Br 7a_100000766406_100000187820 [0,1,0,0,0,0|2,0,0]=3 3854 B14R1.677 NC(=O)COCCc1ccc(cc1)Cl 34a_100011219627_100000187820 [0,1,0,0,0,0|2,0,0]=3 3855 B14R1.677 NC(=O)COCCc1ccc(cc1)Cl 7a_100011219627_100000187820 [0,1,0,0,0,0|2,0,0]=3 3856 B14R1.677 NC(=O)COCCc1ccc(cc1)F 34a_100000754732_100000187820 [0,1,0,0,0,0|2,0,0]=3 3857 B14R1.677 NC(=O)COCCc1ccc(cc1)F 7a_100000754732_100000187820 [0,1,0,0,0,0|2,0,0]=3 3858 B14R1.677 NC(=O)COCCc1ccc(cc1)I 34a_100012291149_100000187820 [0,1,0,0,0,0|2,0,0]=3 3859 B14R1.677 NC(=O)COCCc1ccc(cc1)I 7a_100012291149_100000187820 [0,1,0,0,0,0|2,0,0]=3 3860 B14R1.677 NC(=O)COCCc1ccc(cc1)N 34a_100011204434_100000187820 [0,1,0,0,0,0|2,0,0]=3 3861 B14R1.677 NC(=O)COCCc1ccc(cn1)Br 34a_100012357577_100000187820 [0,1,0,0,0,0|3,0,0]=4 3862 B14R1.677 NC(=O)COCCc1ccc(nc1)Cl 34a_100009880866_100000187820 [0,1,0,0,0,0|3,0,0]=4 3863 B14R1.677 NC(=O)COCCc1ccc(nc1)Cl 7a_100009880866_100000187820 [0,1,0,0,0,0|3,0,0]=4 3864 B14R1.677 NC(=O)CSCCc1ccc(cc1)Br 62a_100000747473_100011740612 [0,1,0,0,0,0|2,0,0]=3 3865 B14R1.677 NC(=O)CSCCc1ccc(cc1)Br 62a_100011740612_100000747473 [0,1,0,0,0,0|2,0,0]=3 3866 B14R1.677 NC(=O)CSCCc1ccc(cc1)Cl 62a_100000747473_100011713675 [0,1,0,0,0,0|2,0,0]=3 3867 B14R1.677 NC(=O)CSCCc1ccc(cc1)Cl 62a_100011713675_100000747473 [0,1,0,0,0,0|2,0,0]=3 3868 B14R1.677 NC(=O)CSCCc1ccc(cc1)F 62a_100000747473_100011217392 [0,1,0,0,0,0|2,0,0]=3 3869 B14R1.677 NC(=O)CSCCc1ccc(cc1)F 62a_100011217392_100000747473 [0,1,0,0,0,0|2,0,0]=3 3870 B14R1.677 NC(=O)CSCCc1ccc(cc1)O 62a_100000747473_100009816426 [0,1,0,0,0,0|2,0,0]=3 3871 B14R1.677 NC(=O)CSCCc1ccc(cc1)O 62a_100009816426_100000747473 [0,1,0,0,0,0|2,0,0]=3 3872 B14R1.677 NC(=O)NCCNc1ccc(cc1)Br 2230a_100000210018_200000034859 [0,1,0,0,0,0|3,0,0]=4 3873 B14R1.677 NC(=O)NCCNc1ccc(cc1)Cl 2230a_100000210052_200000034859 [0,1,0,0,0,0|3,0,0]=4 3874 B14R1.677 NC(=O)NCCOc1ccc(cc1)Br 7a_100000185759_200000034859 [0,1,0,0,0,0|3,0,0]=4 3875 B14R1.677 NC(=O)NCCOc1ccc(cc1)Cl 7a_100000210216_200000034859 [0,1,0,0,0,0|3,0,0]=4 3876 B14R1.677 NC(=O)NCCOc1ccc(cc1)I 7a_100000212066_200000034859 [0,1,0,0,0,0|3,0,0]=4 3877 B14R1.677 NC(=O)NCCSc1ccc(cc1)Br 62a_100000752885_200000034859 [0,1,0,0,0,0|3,0,0]=4 3878 B14R1.677 NC(=O)NCCSc1ccc(cc1)Br 62a_200000034859_100000752885 [0,1,0,0,0,0|3,0,0]=4 3879 B14R1.677 NC(=O)NCCSc1ccc(cc1)Cl 62a_100000755918_200000034859 [0,1,0,0,0,0|3,0,0]=4 3880 B14R1.677 NC(=O)NCCSc1ccc(cc1)Cl 62a_200000034859_100000755918 [0,1,0,0,0,0|3,0,0]=4 3881 B14R1.677 NC(=O)NCCSc1ccc(cc1)F 62a_100000211213_200000034859 [0,1,0,0,0,0|3,0,0]=4 3882 B14R1.677 NC(=O)NCCSc1ccc(cc1)F 62a_200000034859_100000211213 [0,1,0,0,0,0|3,0,0]=4 3883 B14R1.677 NC(=O)NCCSc1ccc(cc1)N 62a_100000185761_200000034859 [0,1,0,0,0,0|3,0,0]=4 3884 B14R1.677 NC(=O)NCCSc1ccc(cc1)N 62a_200000034859_100000185761 [0,1,0,0,0,0|3,0,0]=4 3885 B14R1.677 NC(=O)NCCSc1ccc(cc1)O 62a_200000034859_100000185759 [0,1,0,0,0,0|3,0,0]=4 3886 B14R1.677 NC(=O)OCCNc1ccc(cc1)Br 34a_100000210018_200011214921 [0,1,0,0,0,0|3,0,0]=4 3887 B14R1.677 NC(=O)OCCNc1ccc(cc1)Cl 34a_100000210052_200011214921 [0,1,0,0,0,0|3,0,0]=4 3888 B14R1.677 NC(=O)OCCNc1ccc(cc1)F 34a_100000185862_200011214921 [0,1,0,0,0,0|3,0,0]=4 3889 B14R1.677 NC(=O)OCCNc1ccc(cc1)I 34a_100000185761_200011214921 [0,1,0,0,0,0|3,0,0]=4 3890 B14R1.677 NC(=O)OCCNc1ccc(cc1)O 34a_100000185829_200011214921 [0,1,0,0,0,0|3,0,0]=4 3891 B14R1.677 NC(=O)OCCOc1ccc(cc1)Br 34a_100000185759_200011214921 [0,1,0,0,0,0|3,0,0]=4 3892 B14R1.677 NC(=O)OCCOc1ccc(cc1)Br 7a_100000185759_200011214921 [0,1,0,0,0,0|3,0,0]=4 3893 B14R1.677 NC(=O)OCCOc1ccc(cc1)Cl 34a_100000210216_200011214921 [0,1,0,0,0,0|3,0,0]=4 3894 B14R1.677 NC(=O)OCCOc1ccc(cc1)Cl 7a_100000210216_200011214921 [0,1,0,0,0,0|3,0,0]=4 3895 B14R1.677 NC(=O)OCCOc1ccc(cc1)F 34a_100000210339_200011214921 [0,1,0,0,0,0|3,0,0]=4 3896 B14R1.677 NC(=O)OCCOc1ccc(cc1)I 34a_100000212066_200011214921 [0,1,0,0,0,0|3,0,0]=4 3897 B14R1.677 NC(=O)OCCOc1ccc(cc1)I 7a_100000212066_200011214921 [0,1,0,0,0,0|3,0,0]=4 3898 B14R1.677 NC(=O)OCCOc1ccc(cc1)N 34a_100000185829_200011214921 [0,1,0,0,0,0|3,0,0]=4 3899 B14R1.677 NC(=O)OCCSc1ccc(cc1)Br 62a_100000752885_200011214921 [0,1,0,0,0,0|3,0,0]=4 3900 B14R1.677 NC(=O)OCCSc1ccc(cc1)Br 62a_200011214921_100000752885 [0,1,0,0,0,0|3,0,0]=4 3901 B14R1.677 NC(=O)OCCSc1ccc(cc1)Cl 62a_100000755918_200011214921 [0,1,0,0,0,0|3,0,0]=4 3902 B14R1.677 NC(=O)OCCSc1ccc(cc1)Cl 62a_200011214921_100000755918 [0,1,0,0,0,0|3,0,0]=4 3903 B14R1.677 NC(=O)OCCSc1ccc(cc1)F 62a_100000211213_200011214921 [0,1,0,0,0,0|3,0,0]=4 3904 B14R1.677 NC(=O)OCCSc1ccc(cc1)F 62a_200011214921_100000211213 [0,1,0,0,0,0|3,0,0]=4 3905 B14R1.677 NC(=O)OCCSc1ccc(cc1)N 62a_100000185761_200011214921 [0,1,0,0,0,0|3,0,0]=4 3906 B14R1.677 NC(=O)OCCSc1ccc(cc1)N 62a_200011214921_100000185761 [0,1,0,0,0,0|3,0,0]=4 3907 B14R1.677 NC(=O)OCCSc1ccc(cc1)O 62a_200011214921_100000185759 [0,1,0,0,0,0|3,0,0]=4 3908 B14R1.677 Nc1ccc(cc1)CCOCC(=O)[O-] 34a_100011204434_100020667443 [0,1,0,0,0,0|1,0,1]=3 3909 B14R1.677 Nc1ccc(cc1)CCOC[N+](=O)[O-] 34a_100011204434_100000761209 [0,1,0,0,0,0|2,0,1]=4 3910 B14R1.677 O=C(O)CNCCc1ccc(cc1)Br 269956a_100016091260_100011740612 [0,1,0,0,0,0|1,0,0]=2 3911 B14R1.677 O=C(O)CNCCc1ccc(cc1)Cl 269956a_100016091260_100011713675 [0,1,0,0,0,0|1,0,0]=2 3912 B14R1.677 O=C(O)CNCCc1ccc(cc1)F 269956a_100016091260_100011217392 [0,1,0,0,0,0|1,0,0]=2 3913 B14R1.677 O=C(O)CNCCc1ccc(cc1)O 269956a_100016091260_100009816426 [0,1,0,0,0,0|1,0,0]=2 3914 B14R1.677 O=C(O)CONCc1ccc(cc1)Br 269956a_100000106656_100011217064 [0,1,0,0,0,0|2,0,0]=3 3915 B14R1.677 O=C(O)CONCc1ccc(cc1)Cl 269956a_100000106656_100000187161 [0,1,0,0,0,0|2,0,0]=3 3916 B14R1.677 O=C(O)CONCc1ccc(cc1)F 269956a_100000106656_100000198546 [0,1,0,0,0,0|2,0,0]=3 3917 B14R1.677 O=C(O)CONCc1ccc(cc1)I 269956a_100000106656_100000189116 [0,1,0,0,0,0|2,0,0]=3 3918 B14R1.677 O=C(O)CONCc1ccc(cn1)Br 269956a_100000106656_100000702658 [0,1,0,0,0,0|3,0,0]=4 3919 B14R1.677 O=C(O)CONCc1ccc(cn1)Cl 269956a_100000106656_100012066911 [0,1,0,0,0,0|3,0,0]=4 3920 B14R1.677 O=C(O)CONCc1ccc(cn1)F 269956a_100000106656_100000703193 [0,1,0,0,0,0|3,0,0]=4 3921 B14R1.677 O=C(O)CONCc1ccc(nc1)Br 269956a_100000106656_100009831999 [0,1,0,0,0,0|3,0,0]=4 3922 B14R1.677 O=C(O)CONCc1ccc(nc1)Cl 269956a_100000106656_100000735431 [0,1,0,0,0,0|3,0,0]=4 3923 B14R1.677 O=C(O)CONCc1ccc(nc1)F 269956a_100000106656_100009820150 [0,1,0,0,0,0|3,0,0]=4 3924 B14R1.677 O=C([O-])CNCCc1ccc(cc1)Br 34a_100000755846_100020667443 [0,1,0,0,0,0|1,0,1]=3 3925 B14R1.677 O=C([O-])CNCCc1ccc(cc1)Cl 34a_100000185265_100020667443 [0,1,0,0,0,0|1,0,1]=3 3926 B14R1.677 O=C([O-])CNCCc1ccc(cc1)F 34a_100000199005_100020667443 [0,1,0,0,0,0|1,0,1]=3 3927 B14R1.677 O=C([O-])CNCCc1ccc(cc1)O 34a_100000743037_100020667443 [0,1,0,0,0,0|1,0,1]=3 3928 B14R1.677 O=C([O-])COCCc1ccc(cc1)Br 34a_100000766406_100020667443 [0,1,0,0,0,0|1,0,1]=3 3929 B14R1.677 O=C([O-])COCCc1ccc(cc1)Cl 34a_100011219627_100020667443 [0,1,0,0,0,0|1,0,1]=3 3930 B14R1.677 O=C([O-])COCCc1ccc(cc1)F 34a_100000754732_100020667443 [0,1,0,0,0,0|1,0,1]=3 3931 B14R1.677 O=C([O-])COCCc1ccc(cc1)I 34a_100012291149_100020667443 [0,1,0,0,0,0|1,0,1]=3 3932 B14R1.677 O=C([O-])COCCc1ccc(cn1)Br 34a_100012357577_100020667443 [0,1,0,0,0,0|2,0,1]=4 3933 B14R1.677 O=C([O-])COCCc1ccc(nc1)Cl 34a_100009880866_100020667443 [0,1,0,0,0,0|2,0,1]=4 3934 B14R1.677 O=C([O-])CSCCc1ccc(cc1)Br 62a_100011740612_100020667443 [0,1,0,0,0,0|1,0,1]=3 3935 B14R1.677 O=C([O-])CSCCc1ccc(cc1)Br 62a_100020667443_100011740612 [0,1,0,0,0,0|1,0,1]=3 3936 B14R1.677 O=C([O-])CSCCc1ccc(cc1)Cl 62a_100011713675_100020667443 [0,1,0,0,0,0|1,0,1]=3 3937 B14R1.677 O=C([O-])CSCCc1ccc(cc1)Cl 62a_100020667443_100011713675 [0,1,0,0,0,0|1,0,1]=3 3938 B14R1.677 O=C([O-])CSCCc1ccc(cc1)F 62a_100011217392_100020667443 [0,1,0,0,0,0|1,0,1]=3 3939 B14R1.677 O=C([O-])CSCCc1ccc(cc1)F 62a_100020667443_100011217392 [0,1,0,0,0,0|1,0,1]=3 3940 B14R1.677 O=C([O-])CSCCc1ccc(cc1)O 62a_100009816426_100020667443 [0,1,0,0,0,0|1,0,1]=3 3941 B14R1.677 O=C([O-])CSCCc1ccc(cc1)O 62a_100020667443_100009816426 [0,1,0,0,0,0|1,0,1]=3 3942 B14R1.677 O=[N+]([O-])CNCCc1ccc(cc1)Br 34a_100000755846_100000761209 [0,1,0,0,0,0|2,0,1]=4 3943 B14R1.677 O=[N+]([O-])CNCCc1ccc(cc1)Cl 34a_100000185265_100000761209 [0,1,0,0,0,0|2,0,1]=4 3944 B14R1.677 O=[N+]([O-])CNCCc1ccc(cc1)F 34a_100000199005_100000761209 [0,1,0,0,0,0|2,0,1]=4 3945 B14R1.677 O=[N+]([O-])CNCCc1ccc(cc1)O 34a_100000743037_100000761209 [0,1,0,0,0,0|2,0,1]=4 3946 B14R1.677 O=[N+]([O-])COCCc1ccc(cc1)Br 34a_100000766406_100000761209 [0,1,0,0,0,0|2,0,1]=4 3947 B14R1.677 O=[N+]([O-])COCCc1ccc(cc1)Cl 34a_100011219627_100000761209 [0,1,0,0,0,0|2,0,1]=4 3948 B14R1.677 O=[N+]([O-])COCCc1ccc(cc1)F 34a_100000754732_100000761209 [0,1,0,0,0,0|2,0,1]=4 3949 B14R1.677 O=[N+]([O-])COCCc1ccc(cc1)I 34a_100012291149_100000761209 [0,1,0,0,0,0|2,0,1]=4 3950 B14R1.677 O=[N+]([O-])CSCCc1ccc(cc1)Br 62a_100011740612_100000761209 [0,1,0,0,0,0|2,0,1]=4 3951 B14R1.677 O=[N+]([O-])CSCCc1ccc(cc1)Cl 62a_100011713675_100000761209 [0,1,0,0,0,0|2,0,1]=4 3952 B14R1.677 O=[N+]([O-])CSCCc1ccc(cc1)F 62a_100011217392_100000761209 [0,1,0,0,0,0|2,0,1]=4 3953 B14R1.677 O=[N+]([O-])CSCCc1ccc(cc1)O 62a_100009816426_100000761209 [0,1,0,0,0,0|2,0,1]=4 3954 B14R1.677 [13CH3]C(=O)CCCCc1ccc(cc1)Br 1458a_100000741018_200025704644 [0,1,0,0,0,0|1,0,0]=2 3955 B14R1.677 [13CH3]C(=O)CCCCc1ccc(cc1)Cl 1458a_100000684701_200025704644 [0,1,0,0,0,0|1,0,0]=2 3956 B14R1.677 [13CH3]C(=O)CCCCc1ccc(cc1)F 1458a_100000703604_200025704644 [0,1,0,0,0,0|1,0,0]=2 3957 B14R1.677 [13CH3]C(=O)CCCCc1ccc(cc1)I 1458a_100000749853_200025704644 [0,1,0,0,0,0|1,0,0]=2 3958 B14R1.677 [13CH3]C(=O)CCCCc1ccc(cc1)O 1458a_100000047048_200025704644 [0,1,0,0,0,0|1,0,0]=2 3959 B14R1.677 [13CH3]C(=O)CCCOc1ccc(cc1)Br 1458a_100000183208_200025704644 [0,1,0,0,0,0|2,0,0]=3 3960 B14R1.677 [13CH3]C(=O)CCCOc1ccc(cc1)Cl 1458a_100000741531_200025704644 [0,1,0,0,0,0|2,0,0]=3 3961 B14R1.677 [13CH3]C(=O)CCCOc1ccc(cc1)F 1458a_100000735736_200025704644 [0,1,0,0,0,0|2,0,0]=3 3962 B14R1.677 [13CH3]C(=O)CCCOc1ccc(cc1)I 1458a_100000744034_200025704644 [0,1,0,0,0,0|2,0,0]=3 3963 B14R1.677 [13CH3]C(=O)CCCSc1ccc(cc1)Br 1458a_100000753536_200025704644 [0,1,0,0,0,0|2,0,0]=3 3964 B14R1.677 [13CH3]C(=O)CCCSc1ccc(cc1)Cl 1458a_100000182790_200025704644 [0,1,0,0,0,0|2,0,0]=3 3965 B14R1.716 C#CC(=O)CCCCc1ccccc1 1458a_100000211873_100000701786 [0,1,0,0,0,0|1,0,0]=2 3966 B14R1.716 C#CC(=O)CCCCc1ccncc1 1458a_100000211873_100020630000 [0,1,0,0,0,0|2,0,0]=3 3967 B14R1.716 C#CC(=O)CCCOc1ccccc1 1458a_100000211873_100000199009 [0,1,0,0,0,0|2,0,0]=3 3968 B14R1.716 C#CC(=O)CCCSc1ccccc1 1458a_100000211873_200011203293 [0,1,0,0,0,0|2,0,0]=3 3969 B14R1.716 C#CC(=O)CCOCc1ccccc1 1458a_100000211873_100000234347 [0,1,0,0,0,0|2,0,0]=3 3970 B14R1.716 C#CC(=O)CCSCc1ccccc1 1458a_100000211873_200011297719 [0,1,0,0,0,0|2,0,0]=3 3971 B14R1.716 C=C(C#N)CNCCc1ccccc1 2230a_100000106460_100000694840 [0,1,0,0,0,0|3,0,0]=4 3972 B14R1.716 C=C(C#N)CNCCc1ccccc1 34a_100000106460_100000694840 [0,1,0,0,0,0|3,0,0]=4 3973 B14R1.716 C=C(C#N)COCCc1ccccc1 34a_100000210268_100000694840 [0,1,0,0,0,0|3,0,0]=4 3974 B14R1.716 C=C(C#N)CSCCc1ccccc1 62a_100000765856_100000694840 [0,1,0,0,0,0|3,0,0]=4 3975 B14R1.716 C=CC(=O)CCCCc1ccccc1 1458a_100000185746_100000701786 [0,1,0,0,0,0|1,0,0]=2 3976 B14R1.716 C=CC(=O)CCCCc1ccncc1 1458a_100000185746_100020630000 [0,1,0,0,0,0|2,0,0]=3 3977 B14R1.716 C=CC(=O)CCCOc1ccccc1 1458a_100000185746_100000199009 [0,1,0,0,0,0|2,0,0]=3 3978 B14R1.716 C=CC(=O)CCCSc1ccccc1 1458a_100000185746_200011203293 [0,1,0,0,0,0|2,0,0]=3 3979 B14R1.716 C=CC(=O)CCOCc1ccccc1 1458a_100000185746_100000234347 [0,1,0,0,0,0|2,0,0]=3 3980 B14R1.716 C=CC(=O)CCSCc1ccccc1 1458a_100000185746_200011297719 [0,1,0,0,0,0|2,0,0]=3 3981 B14R1.716 C=CC(=O)NCCCc1ccccc1 1626a_100000211184_100000185746 [0,1,0,0,0,0|2,0,0]=3 3982 B14R1.716 C=CC(=O)NCCCc1ccccc1 240690a_100000211184_200121576911 [0,1,0,0,0,0|2,0,0]=3 3983 B14R1.716 C=CC(=O)NCCCc1ccccn1 1626a_100000689020_100000185746 [0,1,0,0,0,0|3,0,0]=4 3984 B14R1.716 C=CC(=O)NCCCc1ccccn1 240690a_100000689020_200121576911 [0,1,0,0,0,0|3,0,0]=4 3985 B14R1.716 C=CC(=O)NCCCc1cccnc1 240690a_100011532358_200121576911 [0,1,0,0,0,0|3,0,0]=4 3986 B14R1.716 C=CC(=O)NCCCc1ccncc1 1626a_100011275580_100000185746 [0,1,0,0,0,0|3,0,0]=4 3987 B14R1.716 C=CC(=O)NCCCc1ccncc1 240690a_100011275580_200121576911 [0,1,0,0,0,0|3,0,0]=4 3988 B14R1.716 C=CC(=O)NCCOc1ccccc1 1626a_100000174943_100000185746 [0,1,0,0,0,0|3,0,0]=4 3989 B14R1.716 C=CC(=O)NCCOc1ccccc1 240690a_100000174943_200121576911 [0,1,0,0,0,0|3,0,0]=4 3990 B14R1.716 C=CC(=O)NCCSc1ccccc1 240690a_100000189519_200121576911 [0,1,0,0,0,0|3,0,0]=4 3991 B14R1.716 C=CC(=O)NNCCc1ccccc1 22a_100000740470_100000185746 [0,1,0,0,0,0|3,0,0]=4 3992 B14R1.716 C=CC(=O)OCCNc1ccccc1 34a_100000106764_100009813456 [0,1,0,0,0,0|3,0,0]=4 3993 B14R1.716 C=CC(=O)OCCOc1ccccc1 34a_100000210340_100009813456 [0,1,0,0,0,0|3,0,0]=4 3994 B14R1.716 C=CC(=O)OCCOc1ccccc1 7a_100000210340_100009813456 [0,1,0,0,0,0|3,0,0]=4 3995 B14R1.716 C=CC(=O)OCCSc1ccccc1 62a_100000719477_100009813456 [0,1,0,0,0,0|3,0,0]=4 3996 B14R1.716 C=CC(=O)OCCSc1ccccc1 62a_100009813456_100000041952 [0,1,0,0,0,0|3,0,0]=4 3997 B14R1.716 C=CC(O)CNCCc1ccccc1 2230a_100000106460_100000730141 [0,1,0,0,0,0|2,0,1]=4 3998 B14R1.716 C=CC(O)CNCCc1ccccc1 34a_100000106460_100000730141 [0,1,0,0,0,0|2,0,1]=4 3999 B14R1.716 C=CC(O)COCCc1ccccc1 34a_100000210268_100000730141 [0,1,0,0,0,0|2,0,1]=4 4000 B14R1.716 C=CC(O)COCCc1ccccc1 7a_100000210268_100000730141 [0,1,0,0,0,0|2,0,1]=4 4001 B14R1.716 C=CC(O)CSCCc1ccccc1 62a_100000730141_100011218657 [0,1,0,0,0,0|2,0,1]=4 4002 B14R1.716 C=CC(O)CSCCc1ccccc1 62a_100000765856_100000730141 [0,1,0,0,0,0|2,0,1]=4 4003 B14R1.716 CC(=NNCCc1ccccc1)CO 4a_100000740470_100000211253 [0,1,0,0,0,0|3,0,0]=4 4004 B14R1.716 CC(CO)CCNCc1ccccc1 207a_106354213184_100015611070 [0,1,0,0,0,0|2,0,1]=4 4005 B14R1.716 CC(CO)CCNCc1ccccc1 2230a_106354213184_100015291786 [0,1,0,0,0,0|2,0,1]=4 4006 B14R1.716 CC(CO)CCNCc1ccccc1 270004a_106354213184_100015611070 [0,1,0,0,0,0|2,0,1]=4 4007 B14R1.716 CC(CO)CCNCc1ccccc1 34a_106354213184_100015291786 [0,1,0,0,0,0|2,0,1]=4 4008 B14R1.716 CC(CO)CNCCc1ccccc1 34a_100000744482_100000765856 [0,1,0,0,0,0|2,0,1]=4 4009 B14R1.716 CC(CO)NCCCc1ccccc1 2230a_100000211184_100012180447 [0,1,0,0,0,0|2,0,1]=4 4010 B14R1.716 CC(CO)NCCCc1ccccc1 34a_100000211184_100012180447 [0,1,0,0,0,0|2,0,1]=4 4011 B14R1.716 CC(CO)OCCCc1ccccc1 34a_100000210828_100012180447 [0,1,0,0,0,0|2,0,1]=4 4012 B14R1.716 CC(CO)OCCCc1ccccc1 7a_100000210828_100012180447 [0,1,0,0,0,0|2,0,1]=4 4013 B14R1.716 CC(CO)SCCCc1ccccc1 62a_100012180447_100000211621 [0,1,0,0,0,0|2,0,1]=4 4014 B14R1.716 CCC(=O)C=CCCc1ccccc1 1458a_100016484021_100000210202 [0,1,0,0,0,0|1,0,2]=4 4015 B14R1.716 CCC(=O)CCCCc1ccccc1 1458a_100000210414_100000701786 [0,1,0,0,0,0|1,0,0]=2 4016 B14R1.716 CCC(=O)CCCCc1ccccc1 1458a_100011215911_100000210202 [0,1,0,0,0,0|1,0,0]=2 4017 B14R1.716 CCC(=O)CCCCc1ccncc1 1458a_100000210414_100020630000 [0,1,0,0,0,0|2,0,0]=3 4018 B14R1.716 CCC(=O)CCCOc1ccccc1 1458a_100000210414_100000199009 [0,1,0,0,0,0|2,0,0]=3 4019 B14R1.716 CCC(=O)CCCOc1ccccc1 1458a_100000212059_100000210202 [0,1,0,0,0,0|2,0,0]=3 4020 B14R1.716 CCC(=O)CCCSc1ccccc1 1458a_100000182835_100000210202 [0,1,0,0,0,0|2,0,0]=3 4021 B14R1.716 CCC(=O)CCCSc1ccccc1 1458a_100000210414_200011203293 [0,1,0,0,0,0|2,0,0]=3 4022 B14R1.716 CCC(=O)CCOCc1ccccc1 1458a_100000210414_100000234347 [0,1,0,0,0,0|2,0,0]=3 4023 B14R1.716 CCC(=O)CCOCc1ccccc1 1458a_100000743319_100000210202 [0,1,0,0,0,0|2,0,0]=3 4024 B14R1.716 CCC(=O)CCSCc1ccccc1 1458a_100000173759_100000210202 [0,1,0,0,0,0|2,0,0]=3 4025 B14R1.716 CCC(=O)CCSCc1ccccc1 1458a_100000210414_200011297719 [0,1,0,0,0,0|2,0,0]=3 4026 B14R1.716 CCC(=O)CCSCc1ccccn1 1458a_100000742633_100000210202 [0,1,0,0,0,0|3,0,0]=4 4027 B14R1.716 CCC(=O)COCCc1ccccc1 34a_100000725409_100000765856 [0,1,0,0,0,0|2,0,0]=3 4028 B14R1.716 CCC(=O)COCCc1ccccc1 7a_100000210268_100000747405 [0,1,0,0,0,0|2,0,0]=3 4029 B14R1.716 CCC(=O)CSCCc1ccccc1 62a_100000747405_100011218657 [0,1,0,0,0,0|2,0,0]=3 4030 B14R1.716 CCC(=O)CSCCc1ccccc1 62a_100000765856_100000747405 [0,1,0,0,0,0|2,0,0]=3 4031 B14R1.716 CCC(=O)CSCCc1ccccn1 62a_100000747405_100015183660 [0,1,0,0,0,0|3,0,0]=4 4032 B14R1.716 CCC(=O)CSCCc1ccccn1 62a_100015183660_100000747405 [0,1,0,0,0,0|3,0,0]=4 4033 B14R1.716 CCC(=O)CSCCc1cccnc1 62a_100000747405_200011713674 [0,1,0,0,0,0|3,0,0]=4 4034 B14R1.716 CCC(=O)CSCCc1cccnc1 62a_200011713674_100000747405 [0,1,0,0,0,0|3,0,0]=4 4035 B14R1.716 CCC(=O)CSCCc1ccncc1 62a_100000723409_100000747405 [0,1,0,0,0,0|3,0,0]=4 4036 B14R1.716 CCC(=O)CSCCc1ccncc1 62a_100000747405_100000723409 [0,1,0,0,0,0|3,0,0]=4 4037 B14R1.716 CCC(=O)CSCSc1ccccc1 62a_100000747405_100011218342 [0,1,0,0,0,0|3,0,0]=4 4038 B14R1.716 CCC(=O)CSCSc1ccccc1 62a_100011218342_100000747405 [0,1,0,0,0,0|3,0,0]=4 4039 B14R1.716 CCC(=O)NCCCc1ccccc1 11a_100000211184_100000210414 [0,1,0,0,0,0|2,0,0]=3 4040 B14R1.716 CCC(=O)NCCCc1ccccc1 1626a_100000211184_100000210414 [0,1,0,0,0,0|2,0,0]=3 4041 B14R1.716 CCC(=O)NCCCc1ccccc1 240690a_100000211184_100000210414 [0,1,0,0,0,0|2,0,0]=3 4042 B14R1.716 CCC(=O)NCCCc1ccccc1 527a_100000211184_100000210414 [0,1,0,0,0,0|2,0,0]=3 4043 B14R1.716 CCC(=O)NCCCc1ccccn1 11a_100000689020_100000210414 [0,1,0,0,0,0|3,0,0]=4 4044 B14R1.716 CCC(=O)NCCCc1ccccn1 1626a_100000689020_100000210414 [0,1,0,0,0,0|3,0,0]=4 4045 B14R1.716 CCC(=O)NCCCc1ccccn1 240690a_100000689020_100000210414 [0,1,0,0,0,0|3,0,0]=4 4046 B14R1.716 CCC(=O)NCCCc1ccccn1 527a_100000689020_100000210414 [0,1,0,0,0,0|3,0,0]=4 4047 B14R1.716 CCC(=O)NCCCc1cccnc1 11a_100011532358_100000210414 [0,1,0,0,0,0|3,0,0]=4 4048 B14R1.716 CCC(=O)NCCCc1cccnc1 240690a_100011532358_100000210414 [0,1,0,0,0,0|3,0,0]=4 4049 B14R1.716 CCC(=O)NCCCc1ccncc1 1626a_100011275580_100000210414 [0,1,0,0,0,0|3,0,0]=4 4050 B14R1.716 CCC(=O)NCCCc1ccncc1 240690a_100011275580_100000210414 [0,1,0,0,0,0|3,0,0]=4 4051 B14R1.716 CCC(=O)NCCCc1ccncc1 527a_100011275580_100000210414 [0,1,0,0,0,0|3,0,0]=4 4052 B14R1.716 CCC(=O)NCCOc1ccccc1 11a_100000174943_100000210414 [0,1,0,0,0,0|3,0,0]=4 4053 B14R1.716 CCC(=O)NCCOc1ccccc1 1626a_100000174943_100000210414 [0,1,0,0,0,0|3,0,0]=4 4054 B14R1.716 CCC(=O)NCCOc1ccccc1 240690a_100000174943_100000210414 [0,1,0,0,0,0|3,0,0]=4 4055 B14R1.716 CCC(=O)NCCOc1ccccc1 527a_100000174943_100000210414 [0,1,0,0,0,0|3,0,0]=4 4056 B14R1.716 CCC(=O)NCCSc1ccccc1 240690a_100000189519_100000210414 [0,1,0,0,0,0|3,0,0]=4 4057 B14R1.716 CCC(=O)NCCSc1ccccc1 527a_100000189519_100000210414 [0,1,0,0,0,0|3,0,0]=4 4058 B14R1.716 CCC(=O)NNCCc1ccccc1 22a_100000740470_100000210414 [0,1,0,0,0,0|3,0,0]=4 4059 B14R1.716 CCC(O)CNCCc1ccccc1 2230a_100000106460_100011218378 [0,1,0,0,0,0|2,0,1]=4 4060 B14R1.716 CCC(O)CNCCc1ccccc1 2230a_100011218483_100000765856 [0,1,0,0,0,0|2,0,1]=4 4061 B14R1.716 CCC(O)CNCCc1ccccc1 34a_100000106460_100011218378 [0,1,0,0,0,0|2,0,1]=4 4062 B14R1.716 CCC(O)COCCc1ccccc1 34a_100000210268_100011218378 [0,1,0,0,0,0|2,0,1]=4 4063 B14R1.716 CCC(O)COCCc1ccccc1 7a_100000210268_100011218378 [0,1,0,0,0,0|2,0,1]=4 4064 B14R1.716 CCC(O)CSCCc1ccccc1 62a_100000765856_100011218378 [0,1,0,0,0,0|2,0,1]=4 4065 B14R1.716 CCC(O)CSCCc1ccccc1 62a_100011218378_100011218657 [0,1,0,0,0,0|2,0,1]=4 4066 B14R1.716 CCN(C)CCCCc1ccccc1 2230a_100000225621_100000701786 [0,1,0,0,0,0|3,0,0]=4 4067 B14R1.716 CCN(C)CCCCc1ccccc1 2230a_100000741445_100000210202 [0,1,0,0,0,0|3,0,0]=4 4068 B14R1.716 CCN(C)CCCCc1ccccc1 269982a_100000225621_100000701786 [0,1,0,0,0,0|3,0,0]=4 4069 B14R1.716 CCN(C)CCCCc1ccccc1 269982a_100000741445_100000204670 [0,1,0,0,0,0|3,0,0]=4 4070 B14R1.716 CCN(C)CCCCc1ccccc1 34a_100000741445_100000210202 [0,1,0,0,0,0|3,0,0]=4 4071 B14R1.716 CN(CF)CCCCc1ccccc1 269982a_100000741445_100015361967 [0,1,0,0,0,0|3,0,0]=4 4072 B14R1.716 CN(CF)CCCCc1ccccc1 34a_100000741445_100015361967 [0,1,0,0,0,0|3,0,0]=4 4073 B14R1.716 CNC(=O)C=CCCc1ccccc1 11a_106832991635_100016484021 [0,1,0,0,0,0|1,0,2]=4 4074 B14R1.716 CNC(=O)C=CCCc1ccccc1 1626a_100102657272_100016484021 [0,1,0,0,0,0|1,0,2]=4 4075 B14R1.716 CNC(=O)C=CCCc1ccccc1 240690a_100102657272_100016484021 [0,1,0,0,0,0|1,0,2]=4 4076 B14R1.716 CNC(=O)CCCCc1ccccc1 11a_106832991635_100011215911 [0,1,0,0,0,0|1,0,0]=2 4077 B14R1.716 CNC(=O)CCCCc1ccccc1 1626a_100102657272_100011215911 [0,1,0,0,0,0|1,0,0]=2 4078 B14R1.716 CNC(=O)CCCCc1ccccc1 240690a_100102657272_100011215911 [0,1,0,0,0,0|1,0,0]=2 4079 B14R1.716 CNC(=O)CCCCc1ccccc1 527a_100102657272_100011215911 [0,1,0,0,0,0|1,0,0]=2 4080 B14R1.716 CNC(=O)CCCNc1ccccc1 34a_100000106764_100000741757 [0,1,0,0,0,0|2,0,0]=3 4081 B14R1.716 CNC(=O)CCCOc1ccccc1 11a_106832991635_100000212059 [0,1,0,0,0,0|2,0,0]=3 4082 B14R1.716 CNC(=O)CCCOc1ccccc1 1626a_100102657272_100000212059 [0,1,0,0,0,0|2,0,0]=3 4083 B14R1.716 CNC(=O)CCCOc1ccccc1 240690a_100102657272_100000212059 [0,1,0,0,0,0|2,0,0]=3 4084 B14R1.716 CNC(=O)CCCOc1ccccc1 34a_100000210340_100000741757 [0,1,0,0,0,0|2,0,0]=3 4085 B14R1.716 CNC(=O)CCCOc1ccccc1 527a_100102657272_100000212059 [0,1,0,0,0,0|2,0,0]=3 4086 B14R1.716 CNC(=O)CCCOc1ccccc1 7a_100000210340_100000741757 [0,1,0,0,0,0|2,0,0]=3 4087 B14R1.716 CNC(=O)CCCOc1cccnc1 34a_100000210849_100000741757 [0,1,0,0,0,0|3,0,0]=4 4088 B14R1.716 CNC(=O)CCCOc1cccnc1 7a_100000210849_100000741757 [0,1,0,0,0,0|3,0,0]=4 4089 B14R1.716 CNC(=O)CCCOc1ccncc1 34a_100000212176_100000741757 [0,1,0,0,0,0|3,0,0]=4 4090 B14R1.716 CNC(=O)CCCSc1ccccc1 11a_106832991635_100000182835 [0,1,0,0,0,0|2,0,0]=3 4091 B14R1.716 CNC(=O)CCCSc1ccccc1 1626a_100102657272_100000182835 [0,1,0,0,0,0|2,0,0]=3 4092 B14R1.716 CNC(=O)CCCSc1ccccc1 240690a_100102657272_100000182835 [0,1,0,0,0,0|2,0,0]=3 4093 B14R1.716 CNC(=O)CCCSc1ccccc1 527a_100102657272_100000182835 [0,1,0,0,0,0|2,0,0]=3 4094 B14R1.716 CNC(=O)CCCSc1ccccc1 62a_100000719477_100000741757 [0,1,0,0,0,0|2,0,0]=3 4095 B14R1.716 CNC(=O)CCCSc1ccccc1 62a_100000741757_100000041952 [0,1,0,0,0,0|2,0,0]=3 4096 B14R1.716 CNC(=O)CCCSc1ccccn1 62a_100000741757_100011216584 [0,1,0,0,0,0|3,0,0]=4 4097 B14R1.716 CNC(=O)CCCSc1ccccn1 62a_100011216584_100000741757 [0,1,0,0,0,0|3,0,0]=4 4098 B14R1.716 CNC(=O)CCCSc1cccnc1 62a_100000210063_100000741757 [0,1,0,0,0,0|3,0,0]=4 4099 B14R1.716 CNC(=O)CCCSc1cccnc1 62a_100000741757_100000210063 [0,1,0,0,0,0|3,0,0]=4 4100 B14R1.716 CNC(=O)CCCSc1ccncc1 62a_100000728582_100000741757 [0,1,0,0,0,0|3,0,0]=4 4101 B14R1.716 CNC(=O)CCCSc1ccncc1 62a_100000741757_100000728582 [0,1,0,0,0,0|3,0,0]=4 4102 B14R1.716 CNC(=O)CCNCc1ccccc1 207a_100000738227_100015611070 [0,1,0,0,0,0|2,0,0]=3 4103 B14R1.716 CNC(=O)CCNCc1ccccc1 2230a_100000738227_100015291786 [0,1,0,0,0,0|2,0,0]=3 4104 B14R1.716 CNC(=O)CCNCc1ccccc1 2230a_100015324214_100000737683 [0,1,0,0,0,0|2,0,0]=3 4105 B14R1.716 CNC(=O)CCNCc1ccccc1 270004a_100000738227_100015611070 [0,1,0,0,0,0|2,0,0]=3 4106 B14R1.716 CNC(=O)CCNCc1ccccc1 34a_100000738227_100015291786 [0,1,0,0,0,0|2,0,0]=3 4107 B14R1.716 CNC(=O)CCNCc1ccccc1 34a_100015324214_100012179268 [0,1,0,0,0,0|2,0,0]=3 4108 B14R1.716 CNC(=O)CCNCc1ccccn1 207a_100000738227_100000209966 [0,1,0,0,0,0|3,0,0]=4 4109 B14R1.716 CNC(=O)CCNCc1ccccn1 2230a_100000738227_100000721315 [0,1,0,0,0,0|3,0,0]=4 4110 B14R1.716 CNC(=O)CCNCc1ccccn1 270004a_100000738227_100000209966 [0,1,0,0,0,0|3,0,0]=4 4111 B14R1.716 CNC(=O)CCNCc1ccccn1 34a_100000738227_100000721315 [0,1,0,0,0,0|3,0,0]=4 4112 B14R1.716 CNC(=O)CCNCc1cccnc1 207a_100000738227_100000209961 [0,1,0,0,0,0|3,0,0]=4 4113 B14R1.716 CNC(=O)CCNCc1cccnc1 2230a_100000738227_100000741622 [0,1,0,0,0,0|3,0,0]=4 4114 B14R1.716 CNC(=O)CCNCc1cccnc1 270004a_100000738227_100000209961 [0,1,0,0,0,0|3,0,0]=4 4115 B14R1.716 CNC(=O)CCNCc1cccnc1 34a_100000738227_100000733263 [0,1,0,0,0,0|3,0,0]=4 4116 B14R1.716 CNC(=O)CCNCc1ccncc1 207a_100000738227_100000186114 [0,1,0,0,0,0|3,0,0]=4 4117 B14R1.716 CNC(=O)CCNCc1ccncc1 2230a_100000738227_100015193705 [0,1,0,0,0,0|3,0,0]=4 4118 B14R1.716 CNC(=O)CCOCc1ccccc1 11a_106832991635_100000743319 [0,1,0,0,0,0|2,0,0]=3 4119 B14R1.716 CNC(=O)CCOCc1ccccc1 1626a_100102657272_100000743319 [0,1,0,0,0,0|2,0,0]=3 4120 B14R1.716 CNC(=O)CCOCc1ccccc1 240690a_100102657272_100000743319 [0,1,0,0,0,0|2,0,0]=3 4121 B14R1.716 CNC(=O)CCOCc1ccccc1 34a_100000210790_100012179268 [0,1,0,0,0,0|2,0,0]=3 4122 B14R1.716 CNC(=O)CCOCc1ccccc1 34a_100000754576_100015291786 [0,1,0,0,0,0|2,0,0]=3 4123 B14R1.716 CNC(=O)CCOCc1ccccc1 527a_100102657272_100000743319 [0,1,0,0,0,0|2,0,0]=3 4124 B14R1.716 CNC(=O)CCOCc1ccccc1 7a_100000210790_100000737683 [0,1,0,0,0,0|2,0,0]=3 4125 B14R1.716 CNC(=O)CCOCc1ccccn1 34a_100000754576_100000721315 [0,1,0,0,0,0|3,0,0]=4 4126 B14R1.716 CNC(=O)CCOCc1cccnc1 34a_100000754576_100000733263 [0,1,0,0,0,0|3,0,0]=4 4127 B14R1.716 CNC(=O)CCSCc1ccccc1 11a_106832991635_100000173759 [0,1,0,0,0,0|2,0,0]=3 4128 B14R1.716 CNC(=O)CCSCc1ccccc1 1626a_100102657272_100000173759 [0,1,0,0,0,0|2,0,0]=3 4129 B14R1.716 CNC(=O)CCSCc1ccccc1 240690a_100102657272_100000173759 [0,1,0,0,0,0|2,0,0]=3 4130 B14R1.716 CNC(=O)CCSCc1ccccc1 527a_100102657272_100000173759 [0,1,0,0,0,0|2,0,0]=3 4131 B14R1.716 CNC(=O)CCSCc1ccccc1 62a_100000211182_100000737683 [0,1,0,0,0,0|2,0,0]=3 4132 B14R1.716 CNC(=O)CCSCc1ccccc1 62a_100000737683_100015291786 [0,1,0,0,0,0|2,0,0]=3 4133 B14R1.716 CNC(=O)CCSCc1ccccn1 11a_106832991635_100000742633 [0,1,0,0,0,0|3,0,0]=4 4134 B14R1.716 CNC(=O)CCSCc1ccccn1 1626a_100102657272_100000742633 [0,1,0,0,0,0|3,0,0]=4 4135 B14R1.716 CNC(=O)CCSCc1ccccn1 240690a_100102657272_100000742633 [0,1,0,0,0,0|3,0,0]=4 4136 B14R1.716 CNC(=O)CCSCc1ccccn1 62a_100000721315_100000737683 [0,1,0,0,0,0|3,0,0]=4 4137 B14R1.716 CNC(=O)CCSCc1ccccn1 62a_100000737683_100000721315 [0,1,0,0,0,0|3,0,0]=4 4138 B14R1.716 CNC(=O)CCSCc1cccnc1 62a_100000737683_100000741622 [0,1,0,0,0,0|3,0,0]=4 4139 B14R1.716 CNC(=O)CCSCc1cccnc1 62a_100000741622_100000737683 [0,1,0,0,0,0|3,0,0]=4 4140 B14R1.716 CNC(=O)CCSCc1ccncc1 62a_100000737683_100015193705 [0,1,0,0,0,0|3,0,0]=4 4141 B14R1.716 CNC(=O)CCSCc1ccncc1 62a_100015193705_100000737683 [0,1,0,0,0,0|3,0,0]=4 4142 B14R1.716 CNC(=O)CNCCc1ccccc1 2230a_100000106460_100000183359 [0,1,0,0,0,0|2,0,0]=3 4143 B14R1.716 CNC(=O)CNCCc1ccccc1 2230a_100000693194_100000765856 [0,1,0,0,0,0|2,0,0]=3 4144 B14R1.716 CNC(=O)CNCCc1ccccc1 34a_100000106460_100000183359 [0,1,0,0,0,0|2,0,0]=3 4145 B14R1.716 CNC(=O)CNCCc1ccccn1 2230a_100000693194_100015183660 [0,1,0,0,0,0|3,0,0]=4 4146 B14R1.716 CNC(=O)CNCCc1cccnc1 2230a_100000693194_200011713674 [0,1,0,0,0,0|3,0,0]=4 4147 B14R1.716 CNC(=O)CNCCc1cccnc1 2230a_100000736294_100000183359 [0,1,0,0,0,0|3,0,0]=4 4148 B14R1.716 CNC(=O)CNCCc1ccncc1 2230a_100000693194_100000723409 [0,1,0,0,0,0|3,0,0]=4 4149 B14R1.716 CNC(=O)CNCSc1ccccc1 2230a_100000693194_100011218342 [0,1,0,0,0,0|3,0,0]=4 4150 B14R1.716 CNC(=O)COCCc1ccccc1 34a_100000210268_100000183359 [0,1,0,0,0,0|2,0,0]=3 4151 B14R1.716 CNC(=O)COCCc1ccccc1 34a_100000750040_100000765856 [0,1,0,0,0,0|2,0,0]=3 4152 B14R1.716 CNC(=O)COCCc1ccccc1 7a_100000210268_100000183359 [0,1,0,0,0,0|2,0,0]=3 4153 B14R1.716 CNC(=O)COCCc1ccccn1 34a_100000210271_100000183359 [0,1,0,0,0,0|3,0,0]=4 4154 B14R1.716 CNC(=O)COCCc1cccnc1 34a_100011217484_100000183359 [0,1,0,0,0,0|3,0,0]=4 4155 B14R1.716 CNC(=O)COCCc1ccncc1 34a_100011216225_100000183359 [0,1,0,0,0,0|3,0,0]=4 4156 B14R1.716 CNC(=O)CSCCc1ccccc1 62a_100000183359_100011218657 [0,1,0,0,0,0|2,0,0]=3 4157 B14R1.716 CNC(=O)CSCCc1ccccc1 62a_100000765856_100000183359 [0,1,0,0,0,0|2,0,0]=3 4158 B14R1.716 CNC(=O)CSCCc1ccccn1 62a_100000183359_100015183660 [0,1,0,0,0,0|3,0,0]=4 4159 B14R1.716 CNC(=O)CSCCc1ccccn1 62a_100015183660_100000183359 [0,1,0,0,0,0|3,0,0]=4 4160 B14R1.716 CNC(=O)CSCCc1cccnc1 62a_100000183359_200011713674 [0,1,0,0,0,0|3,0,0]=4 4161 B14R1.716 CNC(=O)CSCCc1cccnc1 62a_200011713674_100000183359 [0,1,0,0,0,0|3,0,0]=4 4162 B14R1.716 CNC(=O)CSCCc1ccncc1 62a_100000183359_100000723409 [0,1,0,0,0,0|3,0,0]=4 4163 B14R1.716 CNC(=O)CSCCc1ccncc1 62a_100000723409_100000183359 [0,1,0,0,0,0|3,0,0]=4 4164 B14R1.716 CNC(=O)CSCSc1ccccc1 62a_100000183359_100011218342 [0,1,0,0,0,0|3,0,0]=4 4165 B14R1.716 CNC(=O)CSCSc1ccccc1 62a_100011218342_100000183359 [0,1,0,0,0,0|3,0,0]=4 4166 B14R1.716 CNC(=O)NCCCc1ccccc1 2708a_100000211184_106832991635 [0,1,0,0,0,0|2,0,0]=3 4167 B14R1.716 CNC(=O)NCCCc1ccccc1 2708a_100102657272_100000211184 [0,1,0,0,0,0|2,0,0]=3 4168 B14R1.716 CNC(=O)NCCCc1ccccc1 273464a_100000211184_100102657272 [0,1,0,0,0,0|2,0,0]=3 4169 B14R1.716 CNC(=O)NCCCc1ccccc1 273464a_100102657272_100000211184 [0,1,0,0,0,0|2,0,0]=3 4170 B14R1.716 CNC(=O)NCCCc1ccccc1 512a_100000211184_100102657272 [0,1,0,0,0,0|2,0,0]=3 4171 B14R1.716 CNC(=O)NCCCc1ccccc1 512a_106832991638_100000211184 [0,1,0,0,0,0|2,0,0]=3 4172 B14R1.716 CNC(=O)NCCCc1ccccn1 2708a_100000689020_106832991635 [0,1,0,0,0,0|3,0,0]=4 4173 B14R1.716 CNC(=O)NCCCc1ccccn1 2708a_100102657272_100000689020 [0,1,0,0,0,0|3,0,0]=4 4174 B14R1.716 CNC(=O)NCCCc1ccccn1 273464a_100000689020_100102657272 [0,1,0,0,0,0|3,0,0]=4 4175 B14R1.716 CNC(=O)NCCCc1ccccn1 273464a_100102657272_100000689020 [0,1,0,0,0,0|3,0,0]=4 4176 B14R1.716 CNC(=O)NCCCc1ccccn1 512a_106832991638_100000689020 [0,1,0,0,0,0|3,0,0]=4 4177 B14R1.716 CNC(=O)NCCCc1cccnc1 2708a_100011532358_106832991635 [0,1,0,0,0,0|3,0,0]=4 4178 B14R1.716 CNC(=O)NCCCc1cccnc1 2708a_100102657272_100011532358 [0,1,0,0,0,0|3,0,0]=4 4179 B14R1.716 CNC(=O)NCCCc1cccnc1 273464a_100011532358_100102657272 [0,1,0,0,0,0|3,0,0]=4 4180 B14R1.716 CNC(=O)NCCCc1cccnc1 273464a_100102657272_100011532358 [0,1,0,0,0,0|3,0,0]=4 4181 B14R1.716 CNC(=O)NCCCc1cccnc1 512a_100011532358_100102657272 [0,1,0,0,0,0|3,0,0]=4 4182 B14R1.716 CNC(=O)NCCCc1cccnc1 512a_106832991638_100011532358 [0,1,0,0,0,0|3,0,0]=4 4183 B14R1.716 CNC(=O)NCCCc1ccncc1 2708a_100011275580_106832991635 [0,1,0,0,0,0|3,0,0]=4 4184 B14R1.716 CNC(=O)NCCCc1ccncc1 2708a_100102657272_100011275580 [0,1,0,0,0,0|3,0,0]=4 4185 B14R1.716 CNC(=O)NCCCc1ccncc1 273464a_100011275580_100102657272 [0,1,0,0,0,0|3,0,0]=4 4186 B14R1.716 CNC(=O)NCCCc1ccncc1 273464a_100102657272_100011275580 [0,1,0,0,0,0|3,0,0]=4 4187 B14R1.716 CNC(=O)NCCCc1ccncc1 512a_100011275580_100102657272 [0,1,0,0,0,0|3,0,0]=4 4188 B14R1.716 CNC(=O)NCCCc1ccncc1 512a_106832991638_100011275580 [0,1,0,0,0,0|3,0,0]=4 4189 B14R1.716 CNC(=O)NCCOc1ccccc1 2708a_100000174943_106832991635 [0,1,0,0,0,0|3,0,0]=4 4190 B14R1.716 CNC(=O)NCCOc1ccccc1 2708a_100102657272_100000174943 [0,1,0,0,0,0|3,0,0]=4 4191 B14R1.716 CNC(=O)NCCOc1ccccc1 273464a_100000174943_100102657272 [0,1,0,0,0,0|3,0,0]=4 4192 B14R1.716 CNC(=O)NCCOc1ccccc1 273464a_100102657272_100000174943 [0,1,0,0,0,0|3,0,0]=4 4193 B14R1.716 CNC(=O)NCCOc1ccccc1 512a_100000174943_100102657272 [0,1,0,0,0,0|3,0,0]=4 4194 B14R1.716 CNC(=O)NCCOc1ccccc1 512a_106832991638_100000174943 [0,1,0,0,0,0|3,0,0]=4 4195 B14R1.716 CNC(=O)NCCSc1ccccc1 2708a_100000189519_106832991635 [0,1,0,0,0,0|3,0,0]=4 4196 B14R1.716 CNC(=O)NCCSc1ccccc1 2708a_100102657272_100000189519 [0,1,0,0,0,0|3,0,0]=4 4197 B14R1.716 CNC(=O)NCCSc1ccccc1 273464a_100000189519_100102657272 [0,1,0,0,0,0|3,0,0]=4 4198 B14R1.716 CNC(=O)NCCSc1ccccc1 273464a_100102657272_100000189519 [0,1,0,0,0,0|3,0,0]=4 4199 B14R1.716 CNC(=O)NCCSc1ccccc1 512a_100000189519_100102657272 [0,1,0,0,0,0|3,0,0]=4 4200 B14R1.716 CNC(=O)NCCSc1ccccc1 512a_106832991638_100000189519 [0,1,0,0,0,0|3,0,0]=4 4201 B14R1.716 CNC(=O)NNCCc1ccccc1 273464a_100102657272_100000740470 [0,1,0,0,0,0|3,0,0]=4 4202 B14R1.716 CNC(=O)NNCCc1ccccc1 512a_100000740470_100102657272 [0,1,0,0,0,0|3,0,0]=4 4203 B14R1.716 CNC(=O)NNCCc1ccccc1 512a_106832991638_100000740470 [0,1,0,0,0,0|3,0,0]=4 4204 B14R1.716 CNC(=O)OCCNc1ccccc1 34a_100000106764_200011997002 [0,1,0,0,0,0|3,0,0]=4 4205 B14R1.716 CNC(=O)OCCOc1ccccc1 34a_100000210340_200011997002 [0,1,0,0,0,0|3,0,0]=4 4206 B14R1.716 CNC(=O)OCCOc1ccccc1 7a_100000210340_200011997002 [0,1,0,0,0,0|3,0,0]=4 4207 B14R1.716 CNC(=O)OCCSc1ccccc1 62a_100000719477_200011997002 [0,1,0,0,0,0|3,0,0]=4 4208 B14R1.716 CNC(=O)OCCSc1ccccc1 62a_200011997002_100000041952 [0,1,0,0,0,0|3,0,0]=4 4209 B14R1.716 CNC(C)CCCCc1ccccc1 270004a_106832991635_200011485782 [0,1,0,0,0,0|2,0,1]=4 4210 B14R1.716 COC(=O)/C=C/CNc1ccccc1 34a_100000106764_100000742655 [0,1,0,0,0,0|1,0,2]=4 4211 B14R1.716 COC(=O)/C=C/COc1ccccc1 34a_100000210340_100000742655 [0,1,0,0,0,0|1,0,2]=4 4212 B14R1.716 COC(=O)/C=C/COc1ccccc1 7a_100000210340_100000742655 [0,1,0,0,0,0|1,0,2]=4 4213 B14R1.716 COC(=O)/C=C/CSc1ccccc1 62a_100000719477_100000742655 [0,1,0,0,0,0|1,0,2]=4 4214 B14R1.716 COC(=O)/C=C/CSc1ccccc1 62a_100000742655_100000041952 [0,1,0,0,0,0|1,0,2]=4 4215 B14R1.716 COC(=O)C=NNCc1ccccc1 4a_100000007032_200011823558 [0,1,0,0,0,0|2,0,1]=4 4216 B14R1.716 COC(=O)CC=NNc1ccccc1 4a_100015195140_200011552997 [0,1,0,0,0,0|2,0,1]=4 4217 B14R1.716 COC(=O)CCCNc1ccccc1 34a_100000106764_100000742333 [0,1,0,0,0,0|1,0,0]=2 4218 B14R1.716 COC(=O)CCCOc1ccccc1 34a_100000210340_100000742333 [0,1,0,0,0,0|1,0,0]=2 4219 B14R1.716 COC(=O)CCCOc1ccccc1 7a_100000210340_100011218270 [0,1,0,0,0,0|1,0,0]=2 4220 B14R1.716 COC(=O)CCCOc1cccnc1 34a_100000210849_100000742333 [0,1,0,0,0,0|2,0,0]=3 4221 B14R1.716 COC(=O)CCCOc1cccnc1 7a_100000210849_100011218270 [0,1,0,0,0,0|2,0,0]=3 4222 B14R1.716 COC(=O)CCCOc1ccncc1 34a_100000212176_100000742333 [0,1,0,0,0,0|2,0,0]=3 4223 B14R1.716 COC(=O)CCCOc1ccnnc1 34a_100015204005_100000742333 [0,1,0,0,0,0|3,0,0]=4 4224 B14R1.716 COC(=O)CCCOc1cncnc1 7a_100000754086_100011218270 [0,1,0,0,0,0|3,0,0]=4 4225 B14R1.716 COC(=O)CCCSc1ccccc1 62a_100000719477_100011218270 [0,1,0,0,0,0|1,0,0]=2 4226 B14R1.716 COC(=O)CCCSc1ccccc1 62a_100011218270_100000041952 [0,1,0,0,0,0|1,0,0]=2 4227 B14R1.716 COC(=O)CCCSc1ccccn1 62a_100011216584_100011218270 [0,1,0,0,0,0|2,0,0]=3 4228 B14R1.716 COC(=O)CCCSc1ccccn1 62a_100011218270_100011216584 [0,1,0,0,0,0|2,0,0]=3 4229 B14R1.716 COC(=O)CCCSc1cccnc1 62a_100000210063_100011218270 [0,1,0,0,0,0|2,0,0]=3 4230 B14R1.716 COC(=O)CCCSc1cccnc1 62a_100011218270_100000210063 [0,1,0,0,0,0|2,0,0]=3 4231 B14R1.716 COC(=O)CCCSc1cccnn1 62a_100011218270_100016991348 [0,1,0,0,0,0|3,0,0]=4 4232 B14R1.716 COC(=O)CCCSc1cccnn1 62a_100016991348_100011218270 [0,1,0,0,0,0|3,0,0]=4 4233 B14R1.716 COC(=O)CCCSc1ccncc1 62a_100000728582_100011218270 [0,1,0,0,0,0|2,0,0]=3 4234 B14R1.716 COC(=O)CCCSc1ccncc1 62a_100011218270_100000728582 [0,1,0,0,0,0|2,0,0]=3 4235 B14R1.716 COC(=O)CCCSc1ccncn1 62a_100000703185_100011218270 [0,1,0,0,0,0|3,0,0]=4 4236 B14R1.716 COC(=O)CCCSc1ccncn1 62a_100011218270_100000703185 [0,1,0,0,0,0|3,0,0]=4 4237 B14R1.716 COC(=O)CCCSc1ccnnc1 62a_100000732662_100011218270 [0,1,0,0,0,0|3,0,0]=4 4238 B14R1.716 COC(=O)CCCSc1ccnnc1 62a_100011218270_100000732662 [0,1,0,0,0,0|3,0,0]=4 4239 B14R1.716 COC(=O)CCCSc1cnccn1 62a_100000211759_100011218270 [0,1,0,0,0,0|3,0,0]=4 4240 B14R1.716 COC(=O)CCCSc1cnccn1 62a_100011218270_100000211759 [0,1,0,0,0,0|3,0,0]=4 4241 B14R1.716 COC(=O)CCCSc1cncnc1 62a_100011206942_100011218270 [0,1,0,0,0,0|3,0,0]=4 4242 B14R1.716 COC(=O)CCCSc1cncnc1 62a_100011218270_100011206942 [0,1,0,0,0,0|3,0,0]=4 4243 B14R1.716 COC(=O)CCCSc1ncccn1 62a_100000211032_100011218270 [0,1,0,0,0,0|3,0,0]=4 4244 B14R1.716 COC(=O)CCCSc1ncccn1 62a_100011218270_100000211032 [0,1,0,0,0,0|3,0,0]=4 4245 B14R1.716 COC(=O)CCNCc1ccccc1 2230a_100015324214_100000204255 [0,1,0,0,0,0|1,0,0]=2 4246 B14R1.716 COC(=O)CCNCc1ccccc1 34a_100015324214_100000742370 [0,1,0,0,0,0|1,0,0]=2 4247 B14R1.716 COC(=O)CCNCc1cccnn1 2230a_100159270163_100000204255 [0,1,0,0,0,0|3,0,0]=4 4248 B14R1.716 COC(=O)CCNCc1cncnc1 2230a_100011243677_100000204255 [0,1,0,0,0,0|3,0,0]=4 4249 B14R1.716 COC(=O)CCOCc1ccccc1 34a_100000210790_100000742370 [0,1,0,0,0,0|1,0,0]=2 4250 B14R1.716 COC(=O)CCOCc1ccccc1 7a_100000210790_100000204255 [0,1,0,0,0,0|1,0,0]=2 4251 B14R1.716 COC(=O)CCSCc1ccccc1 62a_100000204255_100015291786 [0,1,0,0,0,0|1,0,0]=2 4252 B14R1.716 COC(=O)CCSCc1ccccc1 62a_100000211182_100000204255 [0,1,0,0,0,0|1,0,0]=2 4253 B14R1.716 COC(=O)CCSCc1ccccn1 62a_100000204255_100000721315 [0,1,0,0,0,0|2,0,0]=3 4254 B14R1.716 COC(=O)CCSCc1ccccn1 62a_100000721315_100000204255 [0,1,0,0,0,0|2,0,0]=3 4255 B14R1.716 COC(=O)CCSCc1cccnc1 62a_100000204255_100000741622 [0,1,0,0,0,0|2,0,0]=3 4256 B14R1.716 COC(=O)CCSCc1cccnc1 62a_100000741622_100000204255 [0,1,0,0,0,0|2,0,0]=3 4257 B14R1.716 COC(=O)CCSCc1cccnn1 62a_100000204255_100016990269 [0,1,0,0,0,0|3,0,0]=4 4258 B14R1.716 COC(=O)CCSCc1cccnn1 62a_100016990269_100000204255 [0,1,0,0,0,0|3,0,0]=4 4259 B14R1.716 COC(=O)CCSCc1ccncc1 62a_100000204255_100015193705 [0,1,0,0,0,0|2,0,0]=3 4260 B14R1.716 COC(=O)CCSCc1ccncc1 62a_100015193705_100000204255 [0,1,0,0,0,0|2,0,0]=3 4261 B14R1.716 COC(=O)CCSCc1cnccn1 62a_100000204255_100016995436 [0,1,0,0,0,0|3,0,0]=4 4262 B14R1.716 COC(=O)CCSCc1cnccn1 62a_100016995436_100000204255 [0,1,0,0,0,0|3,0,0]=4 4263 B14R1.716 COC(=O)CCSCc1cncnc1 62a_100000204255_100015196519 [0,1,0,0,0,0|3,0,0]=4 4264 B14R1.716 COC(=O)CCSCc1cncnc1 62a_100015196519_100000204255 [0,1,0,0,0,0|3,0,0]=4 4265 B14R1.716 COC(=O)CCSCc1ncccn1 62a_100000204255_100000703007 [0,1,0,0,0,0|3,0,0]=4 4266 B14R1.716 COC(=O)CCSCc1ncccn1 62a_100000703007_100000204255 [0,1,0,0,0,0|3,0,0]=4 4267 B14R1.716 COC(=O)CNCCc1ccccc1 2230a_100000106460_100000747449 [0,1,0,0,0,0|1,0,0]=2 4268 B14R1.716 COC(=O)CNCCc1ccccc1 34a_100000106460_100000747449 [0,1,0,0,0,0|1,0,0]=2 4269 B14R1.716 COC(=O)CNCCc1cccnc1 2230a_100000736294_100000747449 [0,1,0,0,0,0|2,0,0]=3 4270 B14R1.716 COC(=O)COCCc1ccccc1 34a_100000210268_100000747449 [0,1,0,0,0,0|1,0,0]=2 4271 B14R1.716 COC(=O)COCCc1ccccc1 7a_100000210268_100000747449 [0,1,0,0,0,0|1,0,0]=2 4272 B14R1.716 COC(=O)COCCc1ccccn1 34a_100000210271_100000747449 [0,1,0,0,0,0|2,0,0]=3 4273 B14R1.716 COC(=O)COCCc1cccnc1 34a_100011217484_100000747449 [0,1,0,0,0,0|2,0,0]=3 4274 B14R1.716 COC(=O)COCCc1ccncc1 34a_100011216225_100000747449 [0,1,0,0,0,0|2,0,0]=3 4275 B14R1.716 COC(=O)COCCc1cnccn1 34a_100011349526_100000747449 [0,1,0,0,0,0|3,0,0]=4 4276 B14R1.716 COC(=O)COCCc1cncnc1 34a_100011709255_100000747449 [0,1,0,0,0,0|3,0,0]=4 4277 B14R1.716 COC(=O)CSCCc1ccccc1 62a_100000747449_100011218657 [0,1,0,0,0,0|1,0,0]=2 4278 B14R1.716 COC(=O)CSCCc1ccccc1 62a_100000765856_100000747449 [0,1,0,0,0,0|1,0,0]=2 4279 B14R1.716 COC(=O)CSCCc1ccccn1 62a_100000747449_100015183660 [0,1,0,0,0,0|2,0,0]=3 4280 B14R1.716 COC(=O)CSCCc1ccccn1 62a_100015183660_100000747449 [0,1,0,0,0,0|2,0,0]=3 4281 B14R1.716 COC(=O)CSCCc1cccnc1 62a_100000747449_200011713674 [0,1,0,0,0,0|2,0,0]=3 4282 B14R1.716 COC(=O)CSCCc1cccnc1 62a_200011713674_100000747449 [0,1,0,0,0,0|2,0,0]=3 4283 B14R1.716 COC(=O)CSCCc1ccncc1 62a_100000723409_100000747449 [0,1,0,0,0,0|2,0,0]=3 4284 B14R1.716 COC(=O)CSCCc1ccncc1 62a_100000747449_100000723409 [0,1,0,0,0,0|2,0,0]=3 4285 B14R1.716 COC(=O)CSCSc1ccccc1 62a_100000747449_100011218342 [0,1,0,0,0,0|2,0,0]=3 4286 B14R1.716 COC(=O)CSCSc1ccccc1 62a_100011218342_100000747449 [0,1,0,0,0,0|2,0,0]=3 4287 B14R1.716 COC(=O)OCSCc1ccccc1 62a_100000211182_100000139417 [0,1,0,0,0,0|2,0,0]=3 4288 B14R1.716 COC(=O)OCSCc1ccccn1 62a_100000721315_100000139417 [0,1,0,0,0,0|3,0,0]=4 4289 B14R1.716 COC(=O)OCSCc1cccnc1 62a_100000741622_100000139417 [0,1,0,0,0,0|3,0,0]=4 4290 B14R1.716 COC(=O)OCSCc1ccncc1 62a_100015193705_100000139417 [0,1,0,0,0,0|3,0,0]=4 4291 B14R1.716 COC(C)CCOCc1ccccc1 7a_100000764861_100000211182 [0,1,0,0,0,0|2,0,1]=4 4292 B14R1.716 COC(C)COCCc1ccccc1 34a_100000690652_100000765856 [0,1,0,0,0,0|2,0,1]=4 4293 B14R1.716 COC(C)SCCCc1ccccc1 62a_100000211621_100009879195 [0,1,0,0,0,0|2,0,1]=4 4294 B14R1.716 COC(C)SCCCc1ccccc1 62a_100009879195_100000211621 [0,1,0,0,0,0|2,0,1]=4 4295 B14R1.716 CO[C@H](C)CNCCc1ccccc1 2230a_100020591295_100000765856 [0,1,0,0,0,0|2,0,1]=4 4296 B14R1.716 C[C@@H](CO)CNCCc1ccccc1 2230a_100000106460_100000059175 [0,1,0,0,0,0|2,0,1]=4 4297 B14R1.716 C[C@@H](CO)CNCCc1ccccc1 34a_100000106460_100000059175 [0,1,0,0,0,0|2,0,1]=4 4298 B14R1.716 C[C@@H](CO)COCCc1ccccc1 34a_100000210268_100000059175 [0,1,0,0,0,0|2,0,1]=4 4299 B14R1.716 C[C@@H](CO)COCCc1ccccc1 7a_100000210268_100000059175 [0,1,0,0,0,0|2,0,1]=4 4300 B14R1.716 C[C@@H](CO)CSCCc1ccccc1 62a_100000059175_100011218657 [0,1,0,0,0,0|2,0,1]=4 4301 B14R1.716 C[C@@H](CO)CSCCc1ccccc1 62a_100000765856_100000059175 [0,1,0,0,0,0|2,0,1]=4 4302 B14R1.716 C[C@H](CO)NCCCc1ccccc1 2230a_100000737577_100000211621 [0,1,0,0,0,0|2,0,1]=4 4303 B14R1.716 C[C@H](CO)SCCCc1ccccc1 62a_100000211621_100016084084 [0,1,0,0,0,0|2,0,1]=4 4304 B14R1.716 C[C@H](CO)SCCCc1ccccc1 62a_100016084084_100000211621 [0,1,0,0,0,0|2,0,1]=4 4305 B14R1.716 NC(=NO)CCOCc1ccccc1 34a_100000749954_100015291786 [0,1,0,0,0,0|2,0,0]=3 4306 B14R1.716 NC(=NO)CCOCc1ccccn1 34a_100000749954_100000721315 [0,1,0,0,0,0|3,0,0]=4 4307 B14R1.716 NC(=NO)CCOCc1cccnc1 34a_100000749954_100000733263 [0,1,0,0,0,0|3,0,0]=4 4308 B14R1.716 O=C(C=CCCc1ccccc1)CF 1458a_100016484021_100015361967 [0,1,0,0,0,0|1,0,2]=4 4309 B14R1.716 O=C(CF)CCCCc1ccccc1 1458a_100011215911_100015361967 [0,1,0,0,0,0|1,0,0]=2 4310 B14R1.716 O=C(CF)CCCOc1ccccc1 1458a_100000212059_100015361967 [0,1,0,0,0,0|2,0,0]=3 4311 B14R1.716 O=C(CF)CCCSc1ccccc1 1458a_100000182835_100015361967 [0,1,0,0,0,0|2,0,0]=3 4312 B14R1.716 O=C(CF)CCOCc1ccccc1 1458a_100000743319_100015361967 [0,1,0,0,0,0|2,0,0]=3 4313 B14R1.716 O=C(CF)CCSCc1ccccc1 1458a_100000173759_100015361967 [0,1,0,0,0,0|2,0,0]=3 4314 B14R1.716 O=C(CF)CCSCc1ccccn1 1458a_100000742633_100015361967 [0,1,0,0,0,0|3,0,0]=4 4315 B14R1.716 O=C(CO)CCCCc1ccccc1 1458a_100000210174_100000701786 [0,1,0,0,0,0|0,0,0]=1 4316 B14R1.716 O=C(CO)CCCCc1ccncc1 1458a_100000210174_100020630000 [0,1,0,0,0,0|1,0,0]=2 4317 B14R1.716 O=C(CO)CCCOc1ccccc1 1458a_100000210174_100000199009 [0,1,0,0,0,0|1,0,0]=2 4318 B14R1.716 O=C(CO)CCCSc1ccccc1 1458a_100000210174_200011203293 [0,1,0,0,0,0|1,0,0]=2 4319 B14R1.716 O=C(CO)CCOCc1ccccc1 1458a_100000210174_100000234347 [0,1,0,0,0,0|1,0,0]=2 4320 B14R1.716 O=C(CO)CCSCc1ccccc1 1458a_100000210174_200011297719 [0,1,0,0,0,0|1,0,0]=2 4321 B14R1.716 O=C(CO)NC/C=C/c1ccccc1 240690a_100020603302_100000210174 [0,1,0,0,0,0|1,0,2]=4 4322 B14R1.716 O=C(CO)NC/C=C/c1ccccc1 527a_100020603302_100000210174 [0,1,0,0,0,0|1,0,2]=4 4323 B14R1.716 O=C(CO)NCC#Cc1ccccc1 240690a_100000735379_100000210174 [0,1,0,0,0,0|1,0,2]=4 4324 B14R1.716 O=C(CO)NCC#Cc1ccccc1 527a_100000735379_100000210174 [0,1,0,0,0,0|1,0,2]=4 4325 B14R1.716 O=C(CO)NCCCc1ccccc1 240690a_100000211184_100000210174 [0,1,0,0,0,0|1,0,0]=2 4326 B14R1.716 O=C(CO)NCCCc1ccccc1 527a_100000211184_100000210174 [0,1,0,0,0,0|1,0,0]=2 4327 B14R1.716 O=C(CO)NCCCc1ccccn1 240690a_100000689020_100000210174 [0,1,0,0,0,0|2,0,0]=3 4328 B14R1.716 O=C(CO)NCCCc1ccccn1 527a_100000689020_100000210174 [0,1,0,0,0,0|2,0,0]=3 4329 B14R1.716 O=C(CO)NCCCc1cccnc1 240690a_100011532358_100000210174 [0,1,0,0,0,0|2,0,0]=3 4330 B14R1.716 O=C(CO)NCCCc1ccncc1 240690a_100011275580_100000210174 [0,1,0,0,0,0|2,0,0]=3 4331 B14R1.716 O=C(CO)NCCCc1ccncc1 527a_100011275580_100000210174 [0,1,0,0,0,0|2,0,0]=3 4332 B14R1.716 O=C(CO)NCCOc1ccccc1 240690a_100000174943_100000210174 [0,1,0,0,0,0|2,0,0]=3 4333 B14R1.716 O=C(CO)NCCOc1ccccc1 527a_100000174943_100000210174 [0,1,0,0,0,0|2,0,0]=3 4334 B14R1.716 O=C(CO)NCCOc1ccccn1 240690a_106741647558_100000210174 [0,1,0,0,0,0|3,0,0]=4 4335 B14R1.716 O=C(CO)NCCOc1ccccn1 527a_106741647558_100000210174 [0,1,0,0,0,0|3,0,0]=4 4336 B14R1.716 O=C(CO)NCCOc1cccnc1 240690a_100000754688_100000210174 [0,1,0,0,0,0|3,0,0]=4 4337 B14R1.716 O=C(CO)NCCOc1cccnc1 527a_100000754688_100000210174 [0,1,0,0,0,0|3,0,0]=4 4338 B14R1.716 O=C(CO)NCCOc1ccncc1 240690a_100025717301_100000210174 [0,1,0,0,0,0|3,0,0]=4 4339 B14R1.716 O=C(CO)NCCOc1ccncc1 527a_100025717301_100000210174 [0,1,0,0,0,0|3,0,0]=4 4340 B14R1.716 O=C(CO)NCCSc1ccccc1 240690a_100000189519_100000210174 [0,1,0,0,0,0|2,0,0]=3 4341 B14R1.716 O=C(CO)NCCSc1ccccc1 527a_100000189519_100000210174 [0,1,0,0,0,0|2,0,0]=3 4342 B14R1.716 O=C(CO)NNCCc1ccccc1 22a_100000740470_100000210174 [0,1,0,0,0,0|2,0,0]=3 4343 B14R1.716 OCC(O)CNCCc1ccccc1 2230a_100000106460_100011219619 [0,1,0,0,0,0|1,0,2]=4 4344 B14R1.716 OCC(O)CNCCc1ccccc1 34a_100000106460_100011219619 [0,1,0,0,0,0|1,0,2]=4 4345 B14R1.716 OCC(O)COCCc1ccccc1 34a_100000210268_100011219619 [0,1,0,0,0,0|1,0,2]=4 4346 B14R1.716 OCC(O)COCCc1ccccc1 7a_100000210268_100011219619 [0,1,0,0,0,0|1,0,2]=4 4347 B14R1.716 OCC(O)CSCCc1ccccc1 62a_100000765856_100011219619 [0,1,0,0,0,0|1,0,2]=4 4348 B14R1.716 OCC(O)CSCCc1ccccc1 62a_100011219619_100011218657 [0,1,0,0,0,0|1,0,2]=4 4349 B14R1.716 OC[C@@H](O)CNCCc1ccccc1 2230a_100020644852_100000765856 [0,1,0,0,0,0|1,0,2]=4 4350 B14R1.716 OC[C@H](F)CNCCc1ccccc1 34a_100015665980_100000765856 [0,1,0,0,0,0|2,0,1]=4 4351 B14R1.716 OC[C@H](O)CNCCc1ccccc1 2230a_100000106460_100009815848 [0,1,0,0,0,0|1,0,2]=4 4352 B14R1.716 OC[C@H](O)CNCCc1ccccc1 34a_100000106460_100009815848 [0,1,0,0,0,0|1,0,2]=4 4353 B14R1.716 OC[C@H](O)COCCc1ccccc1 34a_100000210268_100009815848 [0,1,0,0,0,0|1,0,2]=4 4354 B14R1.716 OC[C@H](O)COCCc1ccccc1 7a_100000210268_100009815848 [0,1,0,0,0,0|1,0,2]=4 4355 B14R1.716 OC[C@H](O)CSCCc1ccccc1 62a_100000765856_100009815848 [0,1,0,0,0,0|1,0,2]=4 4356 B14R1.716 OC[C@H](O)CSCCc1ccccc1 62a_100009815848_100011218657 [0,1,0,0,0,0|1,0,2]=4 4357 B14R1.716 O[C@@H](CF)CNCCc1ccccc1 2230a_100000106460_100015614560 [0,1,0,0,0,0|2,0,1]=4 4358 B14R1.716 O[C@@H](CF)CNCCc1ccccc1 34a_100000106460_100015614560 [0,1,0,0,0,0|2,0,1]=4 4359 B14R1.716 O[C@@H](CF)COCCc1ccccc1 34a_100000210268_100015614560 [0,1,0,0,0,0|2,0,1]=4 4360 B14R1.716 O[C@@H](CF)COCCc1ccccc1 7a_100000210268_100015614560 [0,1,0,0,0,0|2,0,1]=4 4361 B14R1.716 O[C@@H](CF)CSCCc1ccccc1 62a_100000765856_100015614560 [0,1,0,0,0,0|2,0,1]=4 4362 B14R1.716 O[C@@H](CF)CSCCc1ccccc1 62a_100015614560_100011218657 [0,1,0,0,0,0|2,0,1]=4 4363 B14R1.818 C=C(C)CC(=O)CCc1ccccc1 1458a_100000185753_100000748629 [0,1,0,0,0,0|2,0,1]=4 4364 B14R1.818 C=C(C)CN(C)CCc1ccccc1 2230a_100000207497_100000748629 [0,1,0,0,0,0|3,0,0]=4 4365 B14R1.818 C=C(C)CN(C)CCc1ccccc1 2230a_100000225649_100000765856 [0,1,0,0,0,0|3,0,0]=4 4366 B14R1.818 C=C(C)CN(C)CCc1ccccc1 269982a_100000207497_100000748629 [0,1,0,0,0,0|3,0,0]=4 4367 B14R1.818 C=C(C)CN(C)CCc1ccccc1 269982a_100000225649_100000765856 [0,1,0,0,0,0|3,0,0]=4 4368 B14R1.818 C=C(F)CC(=O)CCc1ccccc1 1458a_100000185753_100009893438 [0,1,0,0,0,0|2,0,1]=4 4369 B14R1.818 C=C(F)CN(C)CCc1ccccc1 2230a_100000207497_100009893438 [0,1,0,0,0,0|3,0,0]=4 4370 B14R1.818 C=C(F)CN(C)CCc1ccccc1 269982a_100000207497_100009893438 [0,1,0,0,0,0|3,0,0]=4 4371 B14R1.818 CC(=O)CC(=O)CCc1ccccc1 1458a_100000070787_100012361361 [0,1,0,0,0,0|1,0,1]=3 4372 B14R1.818 CC(=O)CC(=O)NCc1ccccc1 1458a_100000070787_100000183539 [0,1,0,0,0,0|2,0,1]=4 4373 B14R1.818 CC(=O)CC(=O)OCc1ccccc1 1458a_100000037839_200000210301 [0,1,0,0,0,0|2,0,1]=4 4374 B14R1.818 CC(=O)CC(=O)OCc1ccccc1 1458a_100000070787_100000753625 [0,1,0,0,0,0|2,0,1]=4 4375 B14R1.818 CC(=O)NC(C)CCc1ccccc1 11a_100000210798_100015343762 [0,1,0,0,0,0|2,0,0]=3 4376 B14R1.818 CC(=O)NC(C)CCc1ccccc1 1626a_100000210798_100015343762 [0,1,0,0,0,0|2,0,0]=3 4377 B14R1.818 CC(=O)NC(C)CCc1ccccc1 240690a_100000210798_100015343762 [0,1,0,0,0,0|2,0,0]=3 4378 B14R1.818 CC(=O)NC(C)CCc1ccccc1 527a_100000210798_100103153847 [0,1,0,0,0,0|2,0,0]=3 4379 B14R1.818 CC(=O)NC(C)COc1ccccc1 11a_100000746794_100015343762 [0,1,0,0,0,0|3,0,0]=4 4380 B14R1.818 CC(=O)NC(C)COc1ccccc1 1626a_100000746794_100015343762 [0,1,0,0,0,0|3,0,0]=4 4381 B14R1.818 CC(=O)NC(C)COc1ccccc1 240690a_100000746794_100015343762 [0,1,0,0,0,0|3,0,0]=4 4382 B14R1.818 CC(=O)NC(C)COc1ccccc1 527a_100000746794_100103153847 [0,1,0,0,0,0|3,0,0]=4 4383 B14R1.818 CC(=O)OC(C)SCc1ccccc1 62a_100000211182_100009818208 [0,1,0,0,0,0|3,0,0]=4 4384 B14R1.818 CC(=O)OC(C)SCc1ccccc1 62a_100009818208_100015291786 [0,1,0,0,0,0|3,0,0]=4 4385 B14R1.818 CC(O)CC(=O)CCc1ccccc1 1458a_100000185753_100011218427 [0,1,0,0,0,0|1,0,2]=4 4386 B14R1.818 CC(O)CN(C)CCc1ccccc1 2230a_100000207497_100011218427 [0,1,0,0,0,0|2,0,1]=4 4387 B14R1.818 CC(O)CN(C)CCc1ccccc1 2230a_100000227577_100000765856 [0,1,0,0,0,0|2,0,1]=4 4388 B14R1.818 CC(O)CN(C)CCc1ccccc1 269982a_100000207497_100011218427 [0,1,0,0,0,0|2,0,1]=4 4389 B14R1.818 CC(O)CN(C)CCc1ccccc1 269982a_100000227577_100000765856 [0,1,0,0,0,0|2,0,1]=4 4390 B14R1.818 CN(CCc1ccccc1)CC(=O)N 2230a_100000207497_100000747473 [0,1,0,0,0,0|2,0,0]=3 4391 B14R1.818 CN(CCc1ccccc1)CC(=O)N 2230a_100000739694_100000765856 [0,1,0,0,0,0|2,0,0]=3 4392 B14R1.818 CN(CCc1ccccc1)CC(=O)N 269982a_100000207497_100000187820 [0,1,0,0,0,0|2,0,0]=3 4393 B14R1.818 CN(CCc1ccccc1)CC(=O)O 269956a_100000746989_100000765856 [0,1,0,0,0,0|1,0,0]=2 4394 B14R1.818 CN(CCc1ccccc1)CC(=O)[O-] 269982a_100000207497_100020667443 [0,1,0,0,0,0|1,0,1]=3 4395 B14R1.818 CN(CCc1ccccc1)C[N+](=O)[O-] 269982a_100000207497_100000761209 [0,1,0,0,0,0|2,0,1]=4 4396 B14R1.818 CN(CCc1ccccn1)CC(=O)N 2230a_100000737206_100000747473 [0,1,0,0,0,0|3,0,0]=4 4397 B14R1.818 CN(CCc1ccccn1)CC(=O)N 2230a_100000739694_100015183660 [0,1,0,0,0,0|3,0,0]=4 4398 B14R1.818 CN(CCc1ccccn1)CC(=O)N 269982a_100000737206_100000187820 [0,1,0,0,0,0|3,0,0]=4 4399 B14R1.818 CN(CCc1ccccn1)CC(=O)O 269956a_100000746989_100015183660 [0,1,0,0,0,0|2,0,0]=3 4400 B14R1.818 CN(CCc1ccccn1)CC(=O)[O-] 269982a_100000737206_100020667443 [0,1,0,0,0,0|2,0,1]=4 4401 B14R1.818 CN(CCc1cccnc1)CC(=O)N 2230a_100000739694_200011713674 [0,1,0,0,0,0|3,0,0]=4 4402 B14R1.818 CN(CCc1cccnc1)CC(=O)N 2230a_100000763209_100000747473 [0,1,0,0,0,0|3,0,0]=4 4403 B14R1.818 CN(CCc1cccnc1)CC(=O)N 269982a_100000763209_100000187820 [0,1,0,0,0,0|3,0,0]=4 4404 B14R1.818 CN(CCc1cccnc1)CC(=O)O 269956a_100000746989_200011713674 [0,1,0,0,0,0|2,0,0]=3 4405 B14R1.818 CN(CCc1cccnc1)CC(=O)[O-] 269982a_100000763209_100020667443 [0,1,0,0,0,0|2,0,1]=4 4406 B14R1.818 CN(CCc1ccncc1)CC(=O)N 2230a_100000739694_100000723409 [0,1,0,0,0,0|3,0,0]=4 4407 B14R1.818 CN(CCc1ccncc1)CC(=O)N 2230a_100000742850_100000747473 [0,1,0,0,0,0|3,0,0]=4 4408 B14R1.818 CN(CCc1ccncc1)CC(=O)N 269982a_100000742850_100000187820 [0,1,0,0,0,0|3,0,0]=4 4409 B14R1.818 CN(CCc1ccncc1)CC(=O)O 269956a_100000746989_100000723409 [0,1,0,0,0,0|2,0,0]=3 4410 B14R1.818 CN(CCc1ccncc1)CC(=O)[O-] 269982a_100000742850_100020667443 [0,1,0,0,0,0|2,0,1]=4 4411 B14R1.818 CN(CSc1ccccc1)CC(=O)N 2230a_100000739694_100011218342 [0,1,0,0,0,0|3,0,0]=4 4412 B14R1.818 CN(CSc1ccccc1)CC(=O)O 269956a_100000746989_100011218342 [0,1,0,0,0,0|2,0,0]=3 4413 B14R1.818 C[C@@H](O)CC(=O)CCc1ccccc1 1458a_100011933948_100000765856 [0,1,0,0,0,0|1,0,2]=4 4414 B14R1.818 C[C@@H](O)CN(C)CCc1ccccc1 2230a_100000207497_100009817552 [0,1,0,0,0,0|2,0,1]=4 4415 B14R1.818 C[C@@H](O)CN(C)CCc1ccccc1 269982a_100000207497_100009817552 [0,1,0,0,0,0|2,0,1]=4 4416 B14R1.818 NC(=O)CC(=O)CCc1ccccc1 1458a_100000185753_100000187820 [0,1,0,0,0,0|1,0,1]=3 4417 B14R1.818 NC(=O)CC(=O)CCc1ccccc1 1458a_100134613110_100000765856 [0,1,0,0,0,0|1,0,1]=3 4418 B14R1.818 NC(=O)CC(=O)CCc1ccccn1 1458a_100015195070_100000187820 [0,1,0,0,0,0|2,0,1]=4 4419 B14R1.818 NC(=O)CC(=O)CCc1ccccn1 1458a_100134613110_100015183660 [0,1,0,0,0,0|2,0,1]=4 4420 B14R1.818 NC(=O)CC(=O)CCc1cccnc1 1458a_100000198484_100000187820 [0,1,0,0,0,0|2,0,1]=4 4421 B14R1.818 NC(=O)CC(=O)CCc1cccnc1 1458a_100134613110_200011713674 [0,1,0,0,0,0|2,0,1]=4 4422 B14R1.818 NC(=O)CC(=O)CCc1ccncc1 1458a_100011225043_100000187820 [0,1,0,0,0,0|2,0,1]=4 4423 B14R1.818 NC(=O)CC(=O)CCc1ccncc1 1458a_100134613110_100000723409 [0,1,0,0,0,0|2,0,1]=4 4424 B14R1.818 NC(=O)CC(=O)COc1ccccc1 1458a_100000186222_100000187820 [0,1,0,0,0,0|2,0,1]=4 4425 B14R1.818 NC(=O)CC(=O)CSc1ccccc1 1458a_100000211596_100000187820 [0,1,0,0,0,0|2,0,1]=4 4426 B14R1.818 NC(=O)CC(=O)NCc1ccccc1 240690a_100015324214_100134613110 [0,1,0,0,0,0|2,0,1]=4 4427 B14R1.818 NC(=O)CC(=O)NCc1ccccc1 527a_100015324214_100134613110 [0,1,0,0,0,0|2,0,1]=4 4428 B14R1.818 O=C(CCc1ccccc1)C[N+](=O)[O-] 1458a_100000185753_100000761209 [0,1,0,0,0,0|1,0,2]=4 4429 B14R1.818 O=C([O-])CC(=O)CCc1ccccc1 1458a_100000185753_100020667443 [0,1,0,0,0,0|0,0,2]=3 4430 B14R1.818 O=C([O-])CC(=O)CCc1ccccn1 1458a_100015195070_100020667443 [0,1,0,0,0,0|1,0,2]=4 4431 B14R1.818 O=C([O-])CC(=O)CCc1cccnc1 1458a_100000198484_100020667443 [0,1,0,0,0,0|1,0,2]=4 4432 B14R1.818 O=C([O-])CC(=O)CCc1ccncc1 1458a_100011225043_100020667443 [0,1,0,0,0,0|1,0,2]=4 4433 B14R1.818 O=C([O-])CC(=O)COc1ccccc1 1458a_100000186222_100020667443 [0,1,0,0,0,0|1,0,2]=4 4434 B14R1.818 O=C([O-])CC(=O)CSc1ccccc1 1458a_100000211596_100020667443 [0,1,0,0,0,0|1,0,2]=4 4435 B14R1.818 [13CH3]C(=O)CC(=O)OCc1ccccc1 1458a_100000037839_200025704644 [0,1,0,0,0,0|2,0,1]=4 4436 B14R1.3331 CC(C)(O)CCCNc1ccccc1 34a_100000106764_100009888830 [0,1,0,0,0,0|2,0,1]=4 4437 B14R1.3331 CC(C)(O)CCCOc1ccccc1 34a_100000210340_100009888830 [0,1,0,0,0,0|2,0,1]=4 4438 B14R1.3331 CC(C)(O)CCCOc1ccccc1 7a_100000210340_100009888830 [0,1,0,0,0,0|2,0,1]=4 4439 B14R1.3331 CC(C)(O)CCCSc1ccccc1 62a_100000719477_100009888830 [0,1,0,0,0,0|2,0,1]=4 4440 B14R1.3331 CC(C)(O)CCCSc1ccccc1 62a_100009888830_100000041952 [0,1,0,0,0,0|2,0,1]=4 4441 B14R1.3331 CC(C)(O)CCNCc1ccccc1 207a_100000707701_100015611070 [0,1,0,0,0,0|2,0,1]=4 4442 B14R1.3331 CC(C)(O)CCNCc1ccccc1 2230a_100015324214_100000702414 [0,1,0,0,0,0|2,0,1]=4 4443 B14R1.3331 CC(C)(O)CCNCc1ccccc1 270004a_100000707701_100015611070 [0,1,0,0,0,0|2,0,1]=4 4444 B14R1.3331 CC(C)(O)CCNCc1ccccc1 34a_100015324214_100000702414 [0,1,0,0,0,0|2,0,1]=4 4445 B14R1.3331 CC(C)(O)CCOCc1ccccc1 34a_100000210790_100000702414 [0,1,0,0,0,0|2,0,1]=4 4446 B14R1.3331 CC(C)(O)CCOCc1ccccc1 7a_100000210790_100000702414 [0,1,0,0,0,0|2,0,1]=4 4447 B14R1.3331 CC(C)(O)CCSCc1ccccc1 62a_100000211182_100000702414 [0,1,0,0,0,0|2,0,1]=4 4448 B14R1.3331 CC(C)(O)CCSCc1ccccc1 62a_100000702414_100015291786 [0,1,0,0,0,0|2,0,1]=4 4449 B14R1.3331 CC(C)(O)CNCCc1ccccc1 2230a_100000751335_100000765856 [0,1,0,0,0,0|2,0,1]=4 4450 B14R1.3331 CC(C)(O)CNCCc1ccccc1 34a_100000106460_100000764493 [0,1,0,0,0,0|2,0,1]=4 4451 B14R1.3331 CC(C)(O)COCCc1ccccc1 34a_100000210268_100000764493 [0,1,0,0,0,0|2,0,1]=4 4452 B14R1.3331 CC(C)(O)COCCc1ccccc1 7a_100000210268_100000764493 [0,1,0,0,0,0|2,0,1]=4 4453 B14R1.3331 CC(C)(O)CSCCc1ccccc1 62a_100000764493_100011218657 [0,1,0,0,0,0|2,0,1]=4 4454 B14R1.3331 CC(C)(O)CSCCc1ccccc1 62a_100000765856_100000764493 [0,1,0,0,0,0|2,0,1]=4 4455 B14R1.3331 CS(=O)(=O)CCCNc1ccccc1 34a_100000106764_100000754308 [0,1,0,0,0,0|2,0,1]=4 4456 B14R1.3331 CS(=O)(=O)CCCOc1ccccc1 34a_100000210340_100000754308 [0,1,0,0,0,0|2,0,1]=4 4457 B14R1.3331 CS(=O)(=O)CCCOc1ccccc1 7a_100000210340_100000754308 [0,1,0,0,0,0|2,0,1]=4 4458 B14R1.3331 CS(=O)(=O)CCCSc1ccccc1 62a_100000719477_100000754308 [0,1,0,0,0,0|2,0,1]=4 4459 B14R1.3331 CS(=O)(=O)CCCSc1ccccc1 62a_100000754308_100000041952 [0,1,0,0,0,0|2,0,1]=4 4460 B14R1.3331 CS(=O)(=O)CCNCc1ccccc1 207a_100000740961_100015611070 [0,1,0,0,0,0|2,0,1]=4 4461 B14R1.3331 CS(=O)(=O)CCNCc1ccccc1 2230a_100000740961_100015291786 [0,1,0,0,0,0|2,0,1]=4 4462 B14R1.3331 CS(=O)(=O)CCNCc1ccccc1 2230a_100015324214_100000731031 [0,1,0,0,0,0|2,0,1]=4 4463 B14R1.3331 CS(=O)(=O)CCNCc1ccccc1 270004a_100000740961_100015611070 [0,1,0,0,0,0|2,0,1]=4 4464 B14R1.3331 CS(=O)(=O)CCNCc1ccccc1 34a_100000740961_100015291786 [0,1,0,0,0,0|2,0,1]=4 4465 B14R1.3331 CS(=O)(=O)CCNCc1ccccc1 34a_100015324214_100000731031 [0,1,0,0,0,0|2,0,1]=4 4466 B14R1.3331 CS(=O)(=O)CCOCc1ccccc1 34a_100000210790_100000731031 [0,1,0,0,0,0|2,0,1]=4 4467 B14R1.3331 CS(=O)(=O)CCOCc1ccccc1 34a_100000211924_100015291786 [0,1,0,0,0,0|2,0,1]=4 4468 B14R1.3331 CS(=O)(=O)CCOCc1ccccc1 7a_100000210790_100000230027 [0,1,0,0,0,0|2,0,1]=4 4469 B14R1.3331 CS(=O)(=O)CCOCc1ccccc1 7a_100000211924_100000211182 [0,1,0,0,0,0|2,0,1]=4 4470 B14R1.3331 CS(=O)(=O)CCSCc1ccccc1 62a_100000211182_100000230027 [0,1,0,0,0,0|2,0,1]=4 4471 B14R1.3331 CS(=O)(=O)CCSCc1ccccc1 62a_100000731031_100015291786 [0,1,0,0,0,0|2,0,1]=4 4472 B14R1.3331 CS(=O)(=O)NCCCc1ccccc1 40a_100000211184_100000738038 [0,1,0,0,0,0|2,0,1]=4 4473 B14R1.3331 NS(=O)(=O)CCCNc1ccccc1 34a_100000106764_100000750626 [0,1,0,0,0,0|2,0,1]=4 4474 B14R1.3331 NS(=O)(=O)CCCOc1ccccc1 34a_100000210340_100000750626 [0,1,0,0,0,0|2,0,1]=4 4475 B14R1.3331 NS(=O)(=O)CCCOc1ccccc1 7a_100000210340_100000750626 [0,1,0,0,0,0|2,0,1]=4 4476 B14R1.3331 NS(=O)(=O)CCCSc1ccccc1 62a_100000719477_100000750626 [0,1,0,0,0,0|2,0,1]=4 4477 B14R1.3331 NS(=O)(=O)CCCSc1ccccc1 62a_100000750626_100000041952 [0,1,0,0,0,0|2,0,1]=4 4478 B14R1.3331 NS(=O)(=O)CCNCc1ccccc1 207a_100000738205_100015611070 [0,1,0,0,0,0|2,0,1]=4 4479 B14R1.3331 NS(=O)(=O)CCNCc1ccccc1 2230a_100000738205_100015291786 [0,1,0,0,0,0|2,0,1]=4 4480 B14R1.3331 NS(=O)(=O)CCNCc1ccccc1 270004a_100000738205_100015611070 [0,1,0,0,0,0|2,0,1]=4 4481 B14R1.3331 NS(=O)(=O)CCNCc1ccccc1 34a_100000738205_100015291786 [0,1,0,0,0,0|2,0,1]=4 4482 B14R1.3331 NS(=O)(=O)CCOCc1ccccc1 34a_100012334274_100015291786 [0,1,0,0,0,0|2,0,1]=4 4483 B14R1.3331 NS(=O)(=O)CSCCc1ccccc1 62a_100000741382_100011218657 [0,1,0,0,0,0|2,0,1]=4 4484 B14R1.3331 NS(=O)(=O)CSCCc1ccccc1 62a_100000765856_100000741382 [0,1,0,0,0,0|2,0,1]=4 4485 B14R1.3331 O=S(=O)([O-])CCCNc1ccccc1 34a_100000106764_100009813499 [0,1,0,0,0,0|2,0,1]=4 4486 B14R1.3331 O=S(=O)([O-])CCCOc1ccccc1 34a_100000210340_100009813499 [0,1,0,0,0,0|2,0,1]=4 4487 B14R1.3331 O=S(=O)([O-])CCCSc1ccccc1 62a_100000719477_100009813499 [0,1,0,0,0,0|2,0,1]=4 4488 B14R1.3331 O=S(=O)([O-])CCCSc1ccccc1 62a_100009813499_100000041952 [0,1,0,0,0,0|2,0,1]=4 4489 B14R1.3331 O=S(=O)([O-])CCNCc1ccccc1 2230a_100015324214_100000737633 [0,1,0,0,0,0|2,0,1]=4 4490 B14R1.3331 O=S(=O)([O-])CCNCc1ccccc1 34a_100015324214_100000762736 [0,1,0,0,0,0|2,0,1]=4 4491 B14R1.3331 O=S(=O)([O-])CCOCc1ccccc1 34a_100000210790_100000762736 [0,1,0,0,0,0|2,0,1]=4 4492 B14R1.3331 O=S(=O)([O-])CCSCc1ccccc1 62a_100000211182_100000762736 [0,1,0,0,0,0|2,0,1]=4 4493 B14R1.3331 O=S(=O)([O-])CCSCc1ccccc1 62a_100000762736_100015291786 [0,1,0,0,0,0|2,0,1]=4 4494 B14R1.3331 O=S(=O)([O-])CNCCc1ccccc1 34a_100000106460_100009817235 [0,1,0,0,0,0|2,0,1]=4 4495 B14R1.3331 O=S(=O)([O-])COCCc1ccccc1 34a_100000210268_100009817235 [0,1,0,0,0,0|2,0,1]=4 4496 B14R1.3331 O=S(=O)([O-])CSCCc1ccccc1 62a_100000765856_100009817235 [0,1,0,0,0,0|2,0,1]=4 4497 B14R1.3331 O=S(=O)([O-])CSCCc1ccccc1 62a_100009817235_100011218657 [0,1,0,0,0,0|2,0,1]=4 4498 B14R1.6449 C=C(C)C(=O)CCCc1ccccc1 1458a_100000185857_100000211621 [0,1,0,0,0,0|2,0,1]=4 4499 B14R1.6449 C=C(C)C(C)NCCc1ccccc1 269862a_100000106460_100011216138 [0,1,0,0,0,0|3,0,0]=4 4500 B14R1.6449 CC(=O)C(=O)CNCc1ccccc1 34a_100015324214_100011261029 [0,1,0,0,0,0|2,0,1]=4 4501 B14R1.6449 CC(=O)C(=O)COCc1ccccc1 34a_100000210790_100011261029 [0,1,0,0,0,0|2,0,1]=4 4502 B14R1.6449 CC(=O)C(=O)CSCc1ccccc1 62a_100000211182_100011261029 [0,1,0,0,0,0|2,0,1]=4 4503 B14R1.6449 CC(=O)C(=O)CSCc1ccccc1 62a_100011261029_100015291786 [0,1,0,0,0,0|2,0,1]=4 4504 B14R1.6449 CC(=O)C(C)CCCc1ccccc1 1458a_100000070787_200010759516 [0,1,0,0,0,0|1,0,0]=2 4505 B14R1.6449 CC(=O)C(C)COCc1ccccc1 34a_100000032740_100015291786 [0,1,0,0,0,0|2,0,0]=3 4506 B14R1.6449 CC(=O)C(C)COCc1ccccc1 7a_100000032740_100000211182 [0,1,0,0,0,0|2,0,0]=3 4507 B14R1.6449 CC(=O)C(C)COCc1ccccn1 34a_100000032740_100000721315 [0,1,0,0,0,0|3,0,0]=4 4508 B14R1.6449 CC(=O)C(C)COCc1ccccn1 7a_100000032740_100000721315 [0,1,0,0,0,0|3,0,0]=4 4509 B14R1.6449 CC(=O)C(C)COCc1cccnc1 34a_100000032740_100000733263 [0,1,0,0,0,0|3,0,0]=4 4510 B14R1.6449 CC(=O)C(C)COCc1cccnc1 7a_100000032740_100000741622 [0,1,0,0,0,0|3,0,0]=4 4511 B14R1.6449 CC(=O)C(C)COCc1ccncc1 7a_100000032740_100015193705 [0,1,0,0,0,0|3,0,0]=4 4512 B14R1.6449 CC(=O)C(C)NCCc1ccccc1 2230a_100000106460_100009814033 [0,1,0,0,0,0|2,0,0]=3 4513 B14R1.6449 CC(=O)C(C)NCCc1cccnc1 2230a_100000736294_100009814033 [0,1,0,0,0,0|3,0,0]=4 4514 B14R1.6449 CC(=O)C(C)OCCc1ccccc1 34a_100000212229_100000765856 [0,1,0,0,0,0|2,0,0]=3 4515 B14R1.6449 CC(=O)C(C)OCCc1ccccc1 7a_100000210268_100000179758 [0,1,0,0,0,0|2,0,0]=3 4516 B14R1.6449 CC(=O)C(C)SCCc1ccccc1 62a_100000765856_100009814033 [0,1,0,0,0,0|2,0,0]=3 4517 B14R1.6449 CC(=O)C(C)SCCc1ccccc1 62a_100009814033_100011218657 [0,1,0,0,0,0|2,0,0]=3 4518 B14R1.6449 CC(=O)C(C)SCCc1ccccn1 62a_100009814033_100015183660 [0,1,0,0,0,0|3,0,0]=4 4519 B14R1.6449 CC(=O)C(C)SCCc1ccccn1 62a_100015183660_100009814033 [0,1,0,0,0,0|3,0,0]=4 4520 B14R1.6449 CC(=O)C(C)SCCc1cccnc1 62a_100009814033_200011713674 [0,1,0,0,0,0|3,0,0]=4 4521 B14R1.6449 CC(=O)C(C)SCCc1cccnc1 62a_200011713674_100009814033 [0,1,0,0,0,0|3,0,0]=4 4522 B14R1.6449 CC(=O)C(C)SCCc1ccncc1 62a_100000723409_100009814033 [0,1,0,0,0,0|3,0,0]=4 4523 B14R1.6449 CC(=O)C(C)SCCc1ccncc1 62a_100009814033_100000723409 [0,1,0,0,0,0|3,0,0]=4 4524 B14R1.6449 CC(=O)C(C)SCSc1ccccc1 62a_100009814033_100011218342 [0,1,0,0,0,0|3,0,0]=4 4525 B14R1.6449 CC(=O)C(C)SCSc1ccccc1 62a_100011218342_100009814033 [0,1,0,0,0,0|3,0,0]=4 4526 B14R1.6449 CC(=O)N(C)CCCc1ccccc1 11a_100000693637_100015343762 [0,1,0,0,0,0|2,0,0]=3 4527 B14R1.6449 CC(=O)N(C)CCCc1ccccc1 1626a_100000693637_100015343762 [0,1,0,0,0,0|2,0,0]=3 4528 B14R1.6449 CC(=O)N(C)CCCc1ccccc1 240690a_100000693637_100015343762 [0,1,0,0,0,0|2,0,0]=3 4529 B14R1.6449 CC(=O)N(C)CCCc1ccccc1 527a_100000693637_100103153847 [0,1,0,0,0,0|2,0,0]=3 4530 B14R1.6449 CC(=O)N(C)CCOc1ccccc1 11a_100000184383_100015343762 [0,1,0,0,0,0|3,0,0]=4 4531 B14R1.6449 CC(=O)N(C)CCOc1ccccc1 1626a_100000184383_100015343762 [0,1,0,0,0,0|3,0,0]=4 4532 B14R1.6449 CC(=O)N(C)CCOc1ccccc1 240690a_100000184383_100015343762 [0,1,0,0,0,0|3,0,0]=4 4533 B14R1.6449 CC(=O)N(C)CCOc1ccccc1 527a_100000184383_100103153847 [0,1,0,0,0,0|3,0,0]=4 4534 B14R1.6449 CC(CCCc1ccccc1)N(C)C 2230a_100102631434_200010759516 [0,1,0,0,0,0|3,0,0]=4 4535 B14R1.6449 CC(CCCc1ccccc1)N(C)C 269982a_100102631434_200010759516 [0,1,0,0,0,0|3,0,0]=4 4536 B14R1.6449 CC(CNCc1ccccc1)C(=O)O 269956a_100000749485_100015291786 [0,1,0,0,0,0|1,0,0]=2 4537 B14R1.6449 CC(CNCc1ccccn1)C(=O)O 269956a_100000749485_100000721315 [0,1,0,0,0,0|2,0,0]=3 4538 B14R1.6449 CC(CNCc1cccnc1)C(=O)O 269956a_100000749485_100000733263 [0,1,0,0,0,0|2,0,0]=3 4539 B14R1.6449 CC(CNCc1cccnn1)C(=O)O 269956a_100000749485_100016990269 [0,1,0,0,0,0|3,0,0]=4 4540 B14R1.6449 CC(CNCc1ccncc1)C(=O)O 269956a_100000749485_100015193705 [0,1,0,0,0,0|2,0,0]=3 4541 B14R1.6449 CC(CNCc1cnccn1)C(=O)O 269956a_100000749485_100016995436 [0,1,0,0,0,0|3,0,0]=4 4542 B14R1.6449 CC(CNCc1cncnc1)C(=O)O 269956a_100000749485_100016991940 [0,1,0,0,0,0|3,0,0]=4 4543 B14R1.6449 CC(CNCc1ncccn1)C(=O)O 269956a_100000749485_100000703007 [0,1,0,0,0,0|3,0,0]=4 4544 B14R1.6449 CC(COCc1ccccc1)[N+](=O)[O-] 34a_100000039676_100015291786 [0,1,0,0,0,0|2,0,1]=4 4545 B14R1.6449 CC(COCc1ccccc1)[N+](=O)[O-] 7a_100000039676_100000211182 [0,1,0,0,0,0|2,0,1]=4 4546 B14R1.6449 CC(NCCc1ccccc1)C(=O)N 2230a_100000106460_100000702099 [0,1,0,0,0,0|2,0,0]=3 4547 B14R1.6449 CC(NCCc1ccccc1)C(=O)N 34a_100000106460_100000702099 [0,1,0,0,0,0|2,0,0]=3 4548 B14R1.6449 CC(NCCc1cccnc1)C(=O)N 2230a_100000736294_100000702099 [0,1,0,0,0,0|3,0,0]=4 4549 B14R1.6449 CC(OCCc1ccccc1)C(=O)N 34a_100000210268_100000702099 [0,1,0,0,0,0|2,0,0]=3 4550 B14R1.6449 CC(OCCc1ccccc1)C(=O)N 7a_100000210268_100000702099 [0,1,0,0,0,0|2,0,0]=3 4551 B14R1.6449 CC(OCCc1ccccn1)C(=O)N 34a_100000210271_100000702099 [0,1,0,0,0,0|3,0,0]=4 4552 B14R1.6449 CC(OCCc1cccnc1)C(=O)N 34a_100011217484_100000702099 [0,1,0,0,0,0|3,0,0]=4 4553 B14R1.6449 CC(OCCc1ccncc1)C(=O)N 34a_100011216225_100000702099 [0,1,0,0,0,0|3,0,0]=4 4554 B14R1.6449 CC(SCCc1ccccc1)C(=O)N 62a_100000702099_100011218657 [0,1,0,0,0,0|2,0,0]=3 4555 B14R1.6449 CC(SCCc1ccccc1)C(=O)N 62a_100000765856_100000702099 [0,1,0,0,0,0|2,0,0]=3 4556 B14R1.6449 CC(SCCc1ccccn1)C(=O)N 62a_100000702099_100015183660 [0,1,0,0,0,0|3,0,0]=4 4557 B14R1.6449 CC(SCCc1ccccn1)C(=O)N 62a_100015183660_100000702099 [0,1,0,0,0,0|3,0,0]=4 4558 B14R1.6449 CC(SCCc1cccnc1)C(=O)N 62a_100000702099_200011713674 [0,1,0,0,0,0|3,0,0]=4 4559 B14R1.6449 CC(SCCc1cccnc1)C(=O)N 62a_200011713674_100000702099 [0,1,0,0,0,0|3,0,0]=4 4560 B14R1.6449 CC(SCCc1ccncc1)C(=O)N 62a_100000702099_100000723409 [0,1,0,0,0,0|3,0,0]=4 4561 B14R1.6449 CC(SCCc1ccncc1)C(=O)N 62a_100000723409_100000702099 [0,1,0,0,0,0|3,0,0]=4 4562 B14R1.6449 CC(SCSc1ccccc1)C(=O)N 62a_100000702099_100011218342 [0,1,0,0,0,0|3,0,0]=4 4563 B14R1.6449 CC(SCSc1ccccc1)C(=O)N 62a_100011218342_100000702099 [0,1,0,0,0,0|3,0,0]=4 4564 B14R1.6449 C[C@@H](NCCc1ccccc1)C(=O)N 2230a_100000119354_100000765856 [0,1,0,0,0,0|2,0,0]=3 4565 B14R1.6449 C[C@@H](NCCc1ccccc1)C(=O)N 34a_100000119354_100000765856 [0,1,0,0,0,0|2,0,0]=3 4566 B14R1.6449 C[C@@H](NCCc1ccccn1)C(=O)N 2230a_100000119354_100015183660 [0,1,0,0,0,0|3,0,0]=4 4567 B14R1.6449 C[C@@H](NCCc1cccnc1)C(=O)N 2230a_100000119354_200011713674 [0,1,0,0,0,0|3,0,0]=4 4568 B14R1.6449 C[C@@H](NCCc1ccncc1)C(=O)N 2230a_100000119354_100000723409 [0,1,0,0,0,0|3,0,0]=4 4569 B14R1.6449 C[C@@H](NCSc1ccccc1)C(=O)N 2230a_100000119354_100011218342 [0,1,0,0,0,0|3,0,0]=4 4570 B14R1.6449 C[C@@H](O)C(=O)CCCc1ccccc1 1458a_100000717761_100000211621 [0,1,0,0,0,0|1,0,2]=4 4571 B14R1.6449 C[C@@H](OCCc1ccccc1)C(=O)N 34a_100000731257_100000765856 [0,1,0,0,0,0|2,0,0]=3 4572 B14R1.6449 C[C@@H](OCCc1ccccc1)C(=O)N 7a_100000731257_100000765856 [0,1,0,0,0,0|2,0,0]=3 4573 B14R1.6449 C[C@@H](OCCc1ccccn1)C(=O)N 7a_100000731257_100015183660 [0,1,0,0,0,0|3,0,0]=4 4574 B14R1.6449 C[C@@H](OCCc1cccnc1)C(=O)N 7a_100000731257_200011713674 [0,1,0,0,0,0|3,0,0]=4 4575 B14R1.6449 C[C@@H](OCCc1ccncc1)C(=O)N 7a_100000731257_100000723409 [0,1,0,0,0,0|3,0,0]=4 4576 B14R1.6449 C[C@H](NCCc1ccccc1)C(=O)O 269956a_100000743915_100000765856 [0,1,0,0,0,0|1,0,0]=2 4577 B14R1.6449 C[C@H](NCCc1ccccn1)C(=O)O 269956a_100000743915_100015183660 [0,1,0,0,0,0|2,0,0]=3 4578 B14R1.6449 C[C@H](NCCc1cccnc1)C(=O)O 269956a_100000743915_200011713674 [0,1,0,0,0,0|2,0,0]=3 4579 B14R1.6449 C[C@H](NCCc1ccncc1)C(=O)O 269956a_100000743915_100000723409 [0,1,0,0,0,0|2,0,0]=3 4580 B14R1.6449 C[C@H](NCSc1ccccc1)C(=O)O 269956a_100000743915_100011218342 [0,1,0,0,0,0|2,0,0]=3 4581 B14R1.6449 C[C@H](O)C(=O)CCCc1ccccc1 1458a_217856618621_100000211621 [0,1,0,0,0,0|1,0,2]=4 4582 B14R1.6449 C[C@H](OCCc1ccccc1)C(=O)[O-] 7a_217856618621_100000765856 [0,1,0,0,0,0|1,0,1]=3 4583 B14R1.6449 C[C@H](OCCc1ccccn1)C(=O)[O-] 7a_217856618621_100015183660 [0,1,0,0,0,0|2,0,1]=4 4584 B14R1.6449 C[C@H](OCCc1cccnc1)C(=O)[O-] 7a_217856618621_200011713674 [0,1,0,0,0,0|2,0,1]=4 4585 B14R1.6449 C[C@H](OCCc1ccncc1)C(=O)[O-] 7a_217856618621_100000723409 [0,1,0,0,0,0|2,0,1]=4 4586 B14R1.6449 NC(=O)C(=O)NCCc1ccccc1 240690a_100000106460_100011215815 [0,1,0,0,0,0|2,0,1]=4 4587 B14R1.6449 NC(=O)C(F)NCCc1ccccc1 2230a_100000106460_100009813875 [0,1,0,0,0,0|2,0,0]=3 4588 B14R1.6449 NC(=O)C(F)NCCc1ccccc1 34a_100000106460_100009813875 [0,1,0,0,0,0|2,0,0]=3 4589 B14R1.6449 NC(=O)C(F)NCCc1cccnc1 2230a_100000736294_100009813875 [0,1,0,0,0,0|3,0,0]=4 4590 B14R1.6449 NC(=O)C(F)OCCc1ccccc1 34a_100000210268_100009813875 [0,1,0,0,0,0|2,0,0]=3 4591 B14R1.6449 NC(=O)C(F)OCCc1ccccc1 7a_100000210268_100009813875 [0,1,0,0,0,0|2,0,0]=3 4592 B14R1.6449 NC(=O)C(F)OCCc1ccccn1 34a_100000210271_100009813875 [0,1,0,0,0,0|3,0,0]=4 4593 B14R1.6449 NC(=O)C(F)OCCc1cccnc1 34a_100011217484_100009813875 [0,1,0,0,0,0|3,0,0]=4 4594 B14R1.6449 NC(=O)C(F)OCCc1ccncc1 34a_100011216225_100009813875 [0,1,0,0,0,0|3,0,0]=4 4595 B14R1.6449 NC(=O)C(F)SCCc1ccccc1 62a_100000765856_100009813875 [0,1,0,0,0,0|2,0,0]=3 4596 B14R1.6449 NC(=O)C(F)SCCc1ccccc1 62a_100009813875_100011218657 [0,1,0,0,0,0|2,0,0]=3 4597 B14R1.6449 NC(=O)C(F)SCCc1ccccn1 62a_100009813875_100015183660 [0,1,0,0,0,0|3,0,0]=4 4598 B14R1.6449 NC(=O)C(F)SCCc1ccccn1 62a_100015183660_100009813875 [0,1,0,0,0,0|3,0,0]=4 4599 B14R1.6449 NC(=O)C(F)SCCc1cccnc1 62a_100009813875_200011713674 [0,1,0,0,0,0|3,0,0]=4 4600 B14R1.6449 NC(=O)C(F)SCCc1cccnc1 62a_200011713674_100009813875 [0,1,0,0,0,0|3,0,0]=4 4601 B14R1.6449 NC(=O)C(F)SCCc1ccncc1 62a_100000723409_100009813875 [0,1,0,0,0,0|3,0,0]=4 4602 B14R1.6449 NC(=O)C(F)SCCc1ccncc1 62a_100009813875_100000723409 [0,1,0,0,0,0|3,0,0]=4 4603 B14R1.6449 NC(=O)C(F)SCSc1ccccc1 62a_100009813875_100011218342 [0,1,0,0,0,0|3,0,0]=4 4604 B14R1.6449 NC(=O)C(F)SCSc1ccccc1 62a_100011218342_100009813875 [0,1,0,0,0,0|3,0,0]=4 4605 B14R1.6449 NC(=O)[C@@H](N)COCc1ccccc1 34a_100000729942_100015291786 [0,1,0,0,0,0|2,0,0]=3 4606 B14R1.6449 NC(=O)[C@@H](N)COCc1ccccn1 34a_100000729942_100000721315 [0,1,0,0,0,0|3,0,0]=4 4607 B14R1.6449 NC(=O)[C@@H](N)COCc1cccnc1 34a_100000729942_100000733263 [0,1,0,0,0,0|3,0,0]=4 4608 B14R1.6449 O=C(CCCc1ccccc1)C(O)O 1458a_100000233687_100000211621 [0,1,0,0,0,0|0,0,3]=4 4609 B14R1.6449 O=C(O)C(F)CNCc1ccccc1 269956a_100000084737_100015291786 [0,1,0,0,0,0|1,0,0]=2 4610 B14R1.6449 O=C(O)C(F)CNCc1ccccn1 269956a_100000084737_100000721315 [0,1,0,0,0,0|2,0,0]=3 4611 B14R1.6449 O=C(O)C(F)CNCc1cccnc1 269956a_100000084737_100000733263 [0,1,0,0,0,0|2,0,0]=3 4612 B14R1.6449 O=C(O)C(F)CNCc1cccnn1 269956a_100000084737_100016990269 [0,1,0,0,0,0|3,0,0]=4 4613 B14R1.6449 O=C(O)C(F)CNCc1ccncc1 269956a_100000084737_100015193705 [0,1,0,0,0,0|2,0,0]=3 4614 B14R1.6449 O=C(O)C(F)CNCc1cnccn1 269956a_100000084737_100016995436 [0,1,0,0,0,0|3,0,0]=4 4615 B14R1.6449 O=C(O)C(F)CNCc1cncnc1 269956a_100000084737_100016991940 [0,1,0,0,0,0|3,0,0]=4 4616 B14R1.6449 O=C(O)C(F)CNCc1ncccn1 269956a_100000084737_100000703007 [0,1,0,0,0,0|3,0,0]=4 4617 B14R1.6449 O=C([O-])C(F)NCCc1ccccc1 34a_100000106460_100020610796 [0,1,0,0,0,0|1,0,1]=3 4618 B14R1.6449 O=C([O-])C(F)OCCc1ccccc1 34a_100000210268_100020610796 [0,1,0,0,0,0|1,0,1]=3 4619 B14R1.6449 O=C([O-])C(F)OCCc1ccccn1 34a_100000210271_100020610796 [0,1,0,0,0,0|2,0,1]=4 4620 B14R1.6449 O=C([O-])C(F)OCCc1cccnc1 34a_100011217484_100020610796 [0,1,0,0,0,0|2,0,1]=4 4621 B14R1.6449 O=C([O-])C(F)OCCc1ccncc1 34a_100011216225_100020610796 [0,1,0,0,0,0|2,0,1]=4 4622 B14R1.6449 O=C([O-])C(F)SCCc1ccccc1 62a_100000765856_100020610796 [0,1,0,0,0,0|1,0,1]=3 4623 B14R1.6449 O=C([O-])C(F)SCCc1ccccc1 62a_100020610796_100011218657 [0,1,0,0,0,0|1,0,1]=3 4624 B14R1.6449 O=C([O-])C(F)SCCc1ccccn1 62a_100015183660_100020610796 [0,1,0,0,0,0|2,0,1]=4 4625 B14R1.6449 O=C([O-])C(F)SCCc1ccccn1 62a_100020610796_100015183660 [0,1,0,0,0,0|2,0,1]=4 4626 B14R1.6449 O=C([O-])C(F)SCCc1cccnc1 62a_100020610796_200011713674 [0,1,0,0,0,0|2,0,1]=4 4627 B14R1.6449 O=C([O-])C(F)SCCc1cccnc1 62a_200011713674_100020610796 [0,1,0,0,0,0|2,0,1]=4 4628 B14R1.6449 O=C([O-])C(F)SCCc1ccncc1 62a_100000723409_100020610796 [0,1,0,0,0,0|2,0,1]=4 4629 B14R1.6449 O=C([O-])C(F)SCCc1ccncc1 62a_100020610796_100000723409 [0,1,0,0,0,0|2,0,1]=4 4630 B14R1.6449 O=C([O-])C(F)SCSc1ccccc1 62a_100011218342_100020610796 [0,1,0,0,0,0|2,0,1]=4 4631 B14R1.6449 O=C([O-])C(F)SCSc1ccccc1 62a_100020610796_100011218342 [0,1,0,0,0,0|2,0,1]=4 4632 B12R0.95 C=CC=CC(=O)CCCCB(O)O 1458a_100016291481_200009817182 [0,0,1,0,0,0|2,0,1]=4 4633 B12R0.95 C=CC=CC(=O)CCCCC(=O)C 1458a_100016291481_100000735457 [0,0,1,0,0,0|2,0,0]=3 4634 B12R0.95 C=CC=CC(=O)CCCOC(=O)C 1458a_100016291481_100000042594 [0,0,1,0,0,0|3,0,0]=4 4635 B12R0.95 C=CC=CC(=O)CCCSC(=O)C 1458a_100016291481_100000038929 [0,0,1,0,0,0|3,0,0]=4 4636 B12R0.95 C=CC=CC(=O)CCOCC(=O)N 1458a_100016291481_100000076697 [0,0,1,0,0,0|3,0,0]=4 4637 B14R2.2 CC(=O)CC1CCc2c1cccc2 1458a_100000756587_200000210301 [0,0,0,1,0,0|1,0,0]=2 4638 B14R2.2 CC(=O)CN1CCc2c1cccc2 1458a_100000742689_200000210301 [0,0,0,1,0,0|2,0,0]=3 4639 B14R2.2 CC(=O)NC1COc2c1cccc2 11a_100000747519_100015343762 [0,0,0,1,0,0|3,0,0]=4 4640 B14R2.2 CC(=O)NC1COc2c1cccc2 1626a_100000747519_100015343762 [0,0,0,1,0,0|3,0,0]=4 4641 B14R2.2 CC(=O)NC1COc2c1cccc2 240690a_100000747519_100015343762 [0,0,0,1,0,0|3,0,0]=4 4642 B14R2.2 CC(=O)NC1COc2c1cccc2 527a_100000747519_100103153847 [0,0,0,1,0,0|3,0,0]=4 4643 B14R2.2 CC(=O)N[C@H]1CCc2c1cccc2 11a_100016989578_100015343762 [0,0,0,1,0,0|2,0,0]=3 4644 B14R2.2 CC(=O)N[C@H]1CCc2c1cccc2 1626a_100016989578_100015343762 [0,0,0,1,0,0|2,0,0]=3 4645 B14R2.2 CC(=O)N[C@H]1CCc2c1cccc2 240690a_100016989578_100015343762 [0,0,0,1,0,0|2,0,0]=3 4646 B14R2.2 CC(=O)N[C@H]1CCc2c1cccc2 527a_100016989578_100103153847 [0,0,0,1,0,0|2,0,0]=3 4647 B14R2.2 [13CH3]C(=O)CC1CCc2c1cccc2 1458a_100000756587_200025704644 [0,0,0,1,0,0|1,0,0]=2 4648 B14R2.2 [13CH3]C(=O)CN1CCc2c1cccc2 1458a_100000742689_200025704644 [0,0,0,1,0,0|2,0,0]=3 4649 B14R2.19 O=C1CN(CN1)Cc2ccccc2 2230a_200000708111_100015291786 [0,0,0,1,0,0|3,0,0]=4 4650 B14R2.19 O=C1OCC(O1)Nc2ccccc2 34a_100000106764_100000032252 [0,0,0,1,0,0|2,0,0]=3 4651 B14R2.19 O=C1OCC(O1)Oc2ccccc2 34a_100000210340_100000032252 [0,0,0,1,0,0|2,0,0]=3 4652 B14R2.19 O=C1OCC(O1)Oc2cccnc2 34a_100000210849_100000032252 [0,0,0,1,0,0|3,0,0]=4 4653 B14R2.19 O=C1OCC(O1)Oc2ccncc2 34a_100000212176_100000032252 [0,0,0,1,0,0|3,0,0]=4 4654 B14R2.19 O=C1OCC(O1)Sc2ccccc2 62a_100000719477_100000032252 [0,0,0,1,0,0|2,0,0]=3 4655 B14R2.19 O=C1OCC(O1)Sc2ccccn2 62a_100011216584_100000032252 [0,0,0,1,0,0|3,0,0]=4 4656 B14R2.19 O=C1OCC(O1)Sc2cccnc2 62a_100000210063_100000032252 [0,0,0,1,0,0|3,0,0]=4 4657 B14R2.19 O=C1OCC(O1)Sc2ccncc2 62a_100000728582_100000032252 [0,0,0,1,0,0|3,0,0]=4 4658 B14R2.19 OC1CCN(C1)Cc2ccccc2 2230a_100011215560_100015291786 [0,0,0,1,0,0|2,0,1]=4 4659 B14R2.19 OC1CCN(C1)Cc2ccccc2 269982a_100011215560_100000211182 [0,0,0,1,0,0|2,0,1]=4 4660 B14R2.19 OC1CCN(C1)Cc2ccccc2 270004a_100011215560_100015611070 [0,0,0,1,0,0|2,0,1]=4 4661 B14R2.21 CN1CCCC(C1)c2ccccc2 2230a_100011236195_200000210301 [0,0,0,1,0,0|3,0,0]=4 4662 B14R2.21 CN1CCCC(C1)c2ccccc2 269982a_100011236195_200000210301 [0,0,0,1,0,0|3,0,0]=4 4663 B14R2.21 CN1CCCC(C1)c2ccccc2 34a_100011236195_200000210301 [0,0,0,1,0,0|3,0,0]=4 4664 B14R2.21 O=C1C=C(CCC1)c2ccccc2 271570a_100000723966_100000210277 [0,0,0,1,0,0|1,0,1]=3 4665 B14R2.21 O=C1C=C(CCC1)c2ccccn2 271570a_100000723966_100011216584 [0,0,0,1,0,0|2,0,1]=4 4666 B14R2.21 O=C1C=C(CCC1)c2cccnc2 271570a_100000723966_100000752921 [0,0,0,1,0,0|2,0,1]=4 4667 B14R2.21 O=C1C=C(CCC1)c2ccncc2 271570a_100000723966_100000035832 [0,0,0,1,0,0|2,0,1]=4 4668 B14R2.21 [13CH3]N1CCCC(C1)c2ccccc2 2230a_100011236195_200025704644 [0,0,0,1,0,0|3,0,0]=4 4669 B14R2.21 [13CH3]N1CCCC(C1)c2ccccc2 269982a_100011236195_200025704644 [0,0,0,1,0,0|3,0,0]=4 4670 B14R2.21 [13CH3]N1CCCC(C1)c2ccccc2 34a_100011236195_200025704644 [0,0,0,1,0,0|3,0,0]=4 4671 B14R2.436 C=C1CC(C1)NCc2ccccc2 207a_100132301982_100015611070 [0,0,0,1,0,0|3,0,0]=4 4672 B14R2.436 C=C1CC(C1)NCc2ccccc2 2230a_100132301982_100015291786 [0,0,0,1,0,0|3,0,0]=4 4673 B14R2.436 C=C1CC(C1)NCc2ccccc2 270004a_100132301982_100015611070 [0,0,0,1,0,0|3,0,0]=4 4674 B14R2.436 O=C1CC(C1)COc2ccccc2 7a_100000210340_100009874392 [0,0,0,1,0,0|2,0,0]=3 4675 B14R2.436 O=C1CC(C1)COc2cccnc2 7a_100000210849_100009874392 [0,0,0,1,0,0|3,0,0]=4 4676 B14R2.436 O=C1CC(C1)CSc2ccccc2 62a_100000719477_100009874392 [0,0,0,1,0,0|2,0,0]=3 4677 B14R2.436 O=C1CC(C1)CSc2ccccc2 62a_100009874392_100000041952 [0,0,0,1,0,0|2,0,0]=3 4678 B14R2.436 O=C1CC(C1)CSc2ccccn2 62a_100009874392_100011216584 [0,0,0,1,0,0|3,0,0]=4 4679 B14R2.436 O=C1CC(C1)CSc2ccccn2 62a_100011216584_100009874392 [0,0,0,1,0,0|3,0,0]=4 4680 B14R2.436 O=C1CC(C1)CSc2cccnc2 62a_100000210063_100009874392 [0,0,0,1,0,0|3,0,0]=4 4681 B14R2.436 O=C1CC(C1)CSc2cccnc2 62a_100009874392_100000210063 [0,0,0,1,0,0|3,0,0]=4 4682 B14R2.436 O=C1CC(C1)CSc2ccncc2 62a_100000728582_100009874392 [0,0,0,1,0,0|3,0,0]=4 4683 B14R2.436 O=C1CC(C1)CSc2ccncc2 62a_100009874392_100000728582 [0,0,0,1,0,0|3,0,0]=4 4684 B14R2.436 O=C1CC(C1)SCc2ccccc2 62a_100009894365_100015291786 [0,0,0,1,0,0|2,0,0]=3 4685 B14R2.436 O=C1CC(C1)SCc2ccccn2 62a_100009894365_100000721315 [0,0,0,1,0,0|3,0,0]=4 4686 B14R2.436 O=C1CC(C1)SCc2cccnc2 62a_100009894365_100000741622 [0,0,0,1,0,0|3,0,0]=4 4687 B14R2.436 O=C1CC(C1)SCc2ccncc2 62a_100009894365_100015193705 [0,0,0,1,0,0|3,0,0]=4 4688 B14R2.436 OC1CN(C1)CCc2ccccc2 269982a_100000749847_100000765856 [0,0,0,1,0,0|2,0,1]=4 4689 B14R2.436 O[C@H]1C[C@@H](C1)NCc2ccccc2 207a_100020629032_100015611070 [0,0,0,1,0,0|2,0,1]=4 4690 B14R2.436 O[C@H]1C[C@@H](C1)NCc2ccccc2 2230a_100020629032_100015291786 [0,0,0,1,0,0|2,0,1]=4 4691 B14R2.436 O[C@H]1C[C@@H](C1)NCc2ccccc2 270004a_100020629032_100015611070 [0,0,0,1,0,0|2,0,1]=4 4692 B14R2.764 CC(=O)N1C[C@@H]1Cc2ccccc2 11a_100016998360_100015343762 [0,0,0,1,0,0|2,0,0]=3 4693 B14R2.764 CC(=O)N1C[C@@H]1Cc2ccccc2 1626a_100016998360_100015343762 [0,0,0,1,0,0|2,0,0]=3 4694 B14R2.764 CC(=O)N1C[C@@H]1Cc2ccccc2 240690a_100016998360_100015343762 [0,0,0,1,0,0|2,0,0]=3 4695 B14R2.764 CC(=O)N1C[C@@H]1Cc2ccccc2 527a_100016998360_100103153847 [0,0,0,1,0,0|2,0,0]=3 4696 B14R2.780 CC(=O)N1CCC1c2ccccc2 11a_100000739605_100015343762 [0,0,0,1,0,0|2,0,0]=3 4697 B14R2.780 CC(=O)N1CCC1c2ccccc2 1626a_100000739605_100015343762 [0,0,0,1,0,0|2,0,0]=3 4698 B14R2.780 CC(=O)N1CCC1c2ccccc2 240690a_100000739605_100015343762 [0,0,0,1,0,0|2,0,0]=3 4699 B14R2.780 CC(=O)N1CCC1c2ccccc2 527a_100000739605_100103153847 [0,0,0,1,0,0|2,0,0]=3 4700 B14R2.790 CC(=O)N[C@H]1C[C@@H]1c2ccccc2 11a_100020588832_100015343762 [0,0,0,1,0,0|2,0,0]=3 4701 B14R2.790 CC(=O)N[C@H]1C[C@@H]1c2ccccc2 1626a_100020588832_100015343762 [0,0,0,1,0,0|2,0,0]=3 4702 B14R2.790 CC(=O)N[C@H]1C[C@@H]1c2ccccc2 240690a_100020588832_100015343762 [0,0,0,1,0,0|2,0,0]=3 4703 B14R2.790 CC(=O)N[C@H]1C[C@@H]1c2ccccc2 527a_100020588832_100103153847 [0,0,0,1,0,0|2,0,0]=3 4704 B14R2.3018 c1ccc(cc1)CCNCC2CO2 2230a_100000106460_100011216344 [0,0,0,1,0,0|2,0,1]=4 4705 B14R2.3018 c1ccc(cc1)CCNCC2CO2 34a_100000106460_102125554688 [0,0,0,1,0,0|2,0,1]=4 4706 B14R2.3018 c1ccc(cc1)CCOCC2CO2 34a_100000210268_102125554688 [0,0,0,1,0,0|2,0,1]=4 4707 B14R2.3018 c1ccc(cc1)CCOCC2CO2 7a_100000210268_102125554688 [0,0,0,1,0,0|2,0,1]=4 4708 B14R2.3018 c1ccc(cc1)CCOC[C@@H]2CO2 34a_100000757423_100000765856 [0,0,0,1,0,0|2,0,1]=4 4709 B14R2.3018 c1ccc(cc1)CCOC[C@@H]2CO2 7a_100000210268_100000745022 [0,0,0,1,0,0|2,0,1]=4 4710 B14R2.3018 c1ccc(cc1)CCSCC2CO2 62a_100000765856_102125554688 [0,0,0,1,0,0|2,0,1]=4 4711 B14R2.3018 c1ccc(cc1)CCSCC2CO2 62a_102125554688_100011218657 [0,0,0,1,0,0|2,0,1]=4 4712 B14R2.3018 c1ccc(cc1)CCSC[C@@H]2CO2 62a_100000745022_100011218657 [0,0,0,1,0,0|2,0,1]=4 4713 B14R2.3018 c1ccc(cc1)CCSC[C@@H]2CO2 62a_100000765856_100000745022 [0,0,0,1,0,0|2,0,1]=4 4714 B14R2.3018 c1ccc(cc1)CNCCC2CO2 2230a_100015324214_100000732470 [0,0,0,1,0,0|2,0,1]=4 4715 B14R2.3018 c1ccc(cc1)CNCCC2CO2 34a_100015324214_100000732470 [0,0,0,1,0,0|2,0,1]=4 4716 B14R2.3018 c1ccc(cc1)COCCC2CO2 34a_100000210790_100000732470 [0,0,0,1,0,0|2,0,1]=4 4717 B14R2.3018 c1ccc(cc1)COCCC2CO2 7a_100000210790_100000732470 [0,0,0,1,0,0|2,0,1]=4 4718 B14R2.3018 c1ccc(cc1)COCC[C@@H]2CO2 34a_100009820653_100015291786 [0,0,0,1,0,0|2,0,1]=4 4719 B14R2.3018 c1ccc(cc1)CSCCC2CO2 62a_100000211182_100000732470 [0,0,0,1,0,0|2,0,1]=4 4720 B14R2.3018 c1ccc(cc1)CSCCC2CO2 62a_100000732470_100015291786 [0,0,0,1,0,0|2,0,1]=4 4721 B14R2.3018 c1ccc(cc1)NCCCC2CO2 34a_100000106764_100000733510 [0,0,0,1,0,0|2,0,1]=4 4722 B14R2.3018 c1ccc(cc1)OCCCC2CO2 34a_100000210340_100000733510 [0,0,0,1,0,0|2,0,1]=4 4723 B14R2.3018 c1ccc(cc1)OCCCC2CO2 7a_100000210340_100000733510 [0,0,0,1,0,0|2,0,1]=4 4724 B14R2.3018 c1ccc(cc1)SCCCC2CO2 62a_100000719477_100000733510 [0,0,0,1,0,0|2,0,1]=4 4725 B14R2.3018 c1ccc(cc1)SCCCC2CO2 62a_100000733510_100000041952 [0,0,0,1,0,0|2,0,1]=4 4726 B14R2.31137 C=C(C)CSC1Cc2c1cccc2 62a_100000748629_100009813401 [0,0,0,1,0,0|3,0,0]=4 4727 B14R2.31137 C=C(C)CSC1Cc2c1cccc2 62a_100009813401_100000211660 [0,0,0,1,0,0|3,0,0]=4 4728 B14R2.31137 C=C(F)CSC1Cc2c1cccc2 62a_100000042424_100009813401 [0,0,0,1,0,0|3,0,0]=4 4729 B14R2.31137 C=C(F)CSC1Cc2c1cccc2 62a_100009813401_100000042424 [0,0,0,1,0,0|3,0,0]=4 4730 B14R2.31137 CC(O)CSC1Cc2c1cccc2 62a_100009813401_100011218427 [0,0,0,1,0,0|2,0,1]=4 4731 B14R2.31137 CC(O)CSC1Cc2c1cccc2 62a_100011218427_100009813401 [0,0,0,1,0,0|2,0,1]=4 4732 B14R2.31137 C[C@@H](O)CSC1Cc2c1cccc2 62a_100009813401_100009817552 [0,0,0,1,0,0|2,0,1]=4 4733 B14R2.31137 C[C@@H](O)CSC1Cc2c1cccc2 62a_100009817552_100009813401 [0,0,0,1,0,0|2,0,1]=4 4734 B14R2.31137 NC(=O)CSC1Cc2c1cccc2 62a_100000747473_100009813401 [0,0,0,1,0,0|2,0,0]=3 4735 B14R2.31137 NC(=O)CSC1Cc2c1cccc2 62a_100009813401_100000747473 [0,0,0,1,0,0|2,0,0]=3 4736 B14R2.31137 O=C(O)CNC1Cc2c1cccc2 269956a_100016091260_100009813401 [0,0,0,1,0,0|1,0,0]=2 4737 B14R2.31137 O=C([O-])CSC1Cc2c1cccc2 62a_100009813401_100020667443 [0,0,0,1,0,0|1,0,1]=3 4738 B14R2.31137 O=C([O-])CSC1Cc2c1cccc2 62a_100020667443_100009813401 [0,0,0,1,0,0|1,0,1]=3 4739 B14R2.31137 O=[N+]([O-])CSC1Cc2c1cccc2 62a_100009813401_100000761209 [0,0,0,1,0,0|2,0,1]=4 4740 B14R2.31359 CC(=O)C1CCCc2c1cccc2 1458a_100011198263_200000210301 [0,0,0,1,0,0|1,0,0]=2 4741 B14R2.31359 CC(=O)C1OCCc2c1cccc2 1458a_100000026751_200000210301 [0,0,0,1,0,0|2,0,0]=3 4742 B14R2.31359 CN(C)C1CCCc2c1cccc2 2230a_100000185324_200000210301 [0,0,0,1,0,0|3,0,0]=4 4743 B14R2.31359 CN(C)C1CCCc2c1cccc2 269982a_100000185324_200000210301 [0,0,0,1,0,0|3,0,0]=4 4744 B14R2.31359 CN(C)C1CCCc2c1cccc2 34a_100000185324_200000210301 [0,0,0,1,0,0|3,0,0]=4 4745 B14R2.31359 CN([13CH3])C1CCCc2c1cccc2 2230a_100000185324_200025704644 [0,0,0,1,0,0|3,0,0]=4 4746 B14R2.31359 CN([13CH3])C1CCCc2c1cccc2 269982a_100000185324_200025704644 [0,0,0,1,0,0|3,0,0]=4 4747 B14R2.31359 CN([13CH3])C1CCCc2c1cccc2 34a_100000185324_200025704644 [0,0,0,1,0,0|3,0,0]=4 4748 B14R2.31359 [13CH3]C(=O)C1CCCc2c1cccc2 1458a_100011198263_200025704644 [0,0,0,1,0,0|1,0,0]=2 4749 B14R2.31359 [13CH3]C(=O)C1OCCc2c1cccc2 1458a_100000026751_200025704644 [0,0,0,1,0,0|2,0,0]=3 4750 B12R1.252 C=C(C)CCNc1ccccc1 34a_100000106764_100000730704 [0,0,0,0,1,0|3,0,0]=4 4751 B12R1.252 C=C(C)CCOc1ccccc1 34a_100000210340_100000730704 [0,0,0,0,1,0|3,0,0]=4 4752 B12R1.252 C=C(C)CCOc1ccccc1 7a_100000210340_100000730704 [0,0,0,0,1,0|3,0,0]=4 4753 B12R1.252 C=C(C)CCSc1ccccc1 62a_100000719477_100000730704 [0,0,0,0,1,0|3,0,0]=4 4754 B12R1.252 C=C(C)CCSc1ccccc1 62a_100000730704_100000041952 [0,0,0,0,1,0|3,0,0]=4 4755 B12R1.252 C=C(C)CNCc1ccccc1 2230a_100015324214_100000748629 [0,0,0,0,1,0|3,0,0]=4 4756 B12R1.252 C=C(C)CNCc1ccccc1 34a_100015324214_100000748629 [0,0,0,0,1,0|3,0,0]=4 4757 B12R1.252 C=C(C)COCc1ccccc1 34a_100000210245_100015291786 [0,0,0,0,1,0|3,0,0]=4 4758 B12R1.252 C=C(C)COCc1ccccc1 34a_100000210790_100000748629 [0,0,0,0,1,0|3,0,0]=4 4759 B12R1.252 C=C(C)COCc1ccccc1 7a_100000210790_100000748629 [0,0,0,0,1,0|3,0,0]=4 4760 B12R1.252 C=C(C)CSCc1ccccc1 62a_100000211182_100000211660 [0,0,0,0,1,0|3,0,0]=4 4761 B12R1.252 C=C(C)CSCc1ccccc1 62a_100000748629_100015291786 [0,0,0,0,1,0|3,0,0]=4 4762 B12R1.252 C=C(F)CNCc1ccccc1 2230a_100015324214_100009893438 [0,0,0,0,1,0|3,0,0]=4 4763 B12R1.252 C=C(F)CNCc1ccccc1 34a_100015324214_100009893438 [0,0,0,0,1,0|3,0,0]=4 4764 B12R1.252 C=C(F)COCc1ccccc1 34a_100000210790_100009893438 [0,0,0,0,1,0|3,0,0]=4 4765 B12R1.252 C=C(F)COCc1ccccc1 34a_200010262243_100015291786 [0,0,0,0,1,0|3,0,0]=4 4766 B12R1.252 C=C(F)COCc1ccccc1 7a_100000210790_100000042424 [0,0,0,0,1,0|3,0,0]=4 4767 B12R1.252 C=C(F)CSCc1ccccc1 62a_100000042424_100015291786 [0,0,0,0,1,0|3,0,0]=4 4768 B12R1.252 C=C(F)CSCc1ccccc1 62a_100000211182_100000042424 [0,0,0,0,1,0|3,0,0]=4 4769 B12R1.252 CC(=O)C/C=C/c1ccccc1 1458a_100000070787_100016265936 [0,0,0,0,1,0|1,0,2]=4 4770 B12R1.252 CC(=O)C/C=C/c1ccccc1 1458a_100011219626_200000210301 [0,0,0,0,1,0|1,0,2]=4 4771 B12R1.252 CC(=O)CC#Cc1ccccc1 1458a_100000070787_100011352542 [0,0,0,0,1,0|1,0,2]=4 4772 B12R1.252 CC(=O)CCCc1ccccc1 1458a_100000070787_100000211621 [0,0,0,0,1,0|1,0,0]=2 4773 B12R1.252 CC(=O)CCCc1ccccc1 1458a_100011207963_200000210301 [0,0,0,0,1,0|1,0,0]=2 4774 B12R1.252 CC(=O)CCCc1ccccn1 1458a_100000752327_200000210301 [0,0,0,0,1,0|2,0,0]=3 4775 B12R1.252 CC(=O)CCCc1ccncc1 1458a_100020654287_200000210301 [0,0,0,0,1,0|2,0,0]=3 4776 B12R1.252 CC(=O)CCOc1ccccc1 1458a_100000070787_100000184471 [0,0,0,0,1,0|2,0,0]=3 4777 B12R1.252 CC(=O)CCOc1ccccc1 1458a_100000182761_200000210301 [0,0,0,0,1,0|2,0,0]=3 4778 B12R1.252 CC(=O)CCOc1ccccc1 7a_100000210340_100000053229 [0,0,0,0,1,0|2,0,0]=3 4779 B12R1.252 CC(=O)CCOc1cccnc1 7a_100000210849_100000053229 [0,0,0,0,1,0|3,0,0]=4 4780 B12R1.252 CC(=O)CCSc1ccccc1 1458a_100000070787_100000246102 [0,0,0,0,1,0|2,0,0]=3 4781 B12R1.252 CC(=O)CCSc1ccccc1 1458a_100000182436_200000210301 [0,0,0,0,1,0|2,0,0]=3 4782 B12R1.252 CC(=O)CCSc1ccccc1 62a_100000053229_100000041952 [0,0,0,0,1,0|2,0,0]=3 4783 B12R1.252 CC(=O)CCSc1ccccc1 62a_100000719477_100000053229 [0,0,0,0,1,0|2,0,0]=3 4784 B12R1.252 CC(=O)CCSc1ccccn1 62a_100000053229_100011216584 [0,0,0,0,1,0|3,0,0]=4 4785 B12R1.252 CC(=O)CCSc1ccccn1 62a_100011216584_100000053229 [0,0,0,0,1,0|3,0,0]=4 4786 B12R1.252 CC(=O)CCSc1cccnc1 62a_100000053229_100000210063 [0,0,0,0,1,0|3,0,0]=4 4787 B12R1.252 CC(=O)CCSc1cccnc1 62a_100000210063_100000053229 [0,0,0,0,1,0|3,0,0]=4 4788 B12R1.252 CC(=O)CCSc1ccncc1 62a_100000053229_100000728582 [0,0,0,0,1,0|3,0,0]=4 4789 B12R1.252 CC(=O)CCSc1ccncc1 62a_100000728582_100000053229 [0,0,0,0,1,0|3,0,0]=4 4790 B12R1.252 CC(=O)COCc1ccccc1 1458a_100000230186_200000210301 [0,0,0,0,1,0|2,0,0]=3 4791 B12R1.252 CC(=O)COCc1ccccc1 34a_100000211253_100015291786 [0,0,0,0,1,0|2,0,0]=3 4792 B12R1.252 CC(=O)COCc1ccccn1 34a_100000211253_100000721315 [0,0,0,0,1,0|3,0,0]=4 4793 B12R1.252 CC(=O)COCc1cccnc1 34a_100000211253_100000733263 [0,0,0,0,1,0|3,0,0]=4 4794 B12R1.252 CC(=O)CSCc1ccccc1 1458a_100000070787_200011217039 [0,0,0,0,1,0|2,0,0]=3 4795 B12R1.252 CC(=O)CSCc1ccccc1 1458a_100000150264_200000210301 [0,0,0,0,1,0|2,0,0]=3 4796 B12R1.252 CC(=O)CSCc1ccccn1 1458a_100000742634_200000210301 [0,0,0,0,1,0|3,0,0]=4 4797 B12R1.252 CC(=O)NCCc1ccccc1 11a_100000106460_100015343762 [0,0,0,0,1,0|2,0,0]=3 4798 B12R1.252 CC(=O)NCCc1ccccc1 1626a_100000106460_100015343762 [0,0,0,0,1,0|2,0,0]=3 4799 B12R1.252 CC(=O)NCCc1ccccc1 240690a_100000106460_100015343762 [0,0,0,0,1,0|2,0,0]=3 4800 B12R1.252 CC(=O)NCCc1ccccc1 527a_100000106460_100103153847 [0,0,0,0,1,0|2,0,0]=3 4801 B12R1.252 CC(=O)NCCc1ccccn1 11a_100000211156_100015343762 [0,0,0,0,1,0|3,0,0]=4 4802 B12R1.252 CC(=O)NCCc1ccccn1 1626a_100000211156_100015343762 [0,0,0,0,1,0|3,0,0]=4 4803 B12R1.252 CC(=O)NCCc1ccccn1 240690a_100000211156_100015343762 [0,0,0,0,1,0|3,0,0]=4 4804 B12R1.252 CC(=O)NCCc1ccccn1 527a_100000211156_100103153847 [0,0,0,0,1,0|3,0,0]=4 4805 B12R1.252 CC(=O)NCCc1cccnc1 11a_100000736294_100015343762 [0,0,0,0,1,0|3,0,0]=4 4806 B12R1.252 CC(=O)NCCc1cccnc1 1626a_100000736294_100015343762 [0,0,0,0,1,0|3,0,0]=4 4807 B12R1.252 CC(=O)NCCc1cccnc1 240690a_100000736294_100015343762 [0,0,0,0,1,0|3,0,0]=4 4808 B12R1.252 CC(=O)NCCc1cccnc1 527a_100000736294_100103153847 [0,0,0,0,1,0|3,0,0]=4 4809 B12R1.252 CC(=O)NCCc1ccncc1 11a_100000742849_100015343762 [0,0,0,0,1,0|3,0,0]=4 4810 B12R1.252 CC(=O)NCCc1ccncc1 1626a_100000742849_100015343762 [0,0,0,0,1,0|3,0,0]=4 4811 B12R1.252 CC(=O)NCCc1ccncc1 240690a_100000742849_100015343762 [0,0,0,0,1,0|3,0,0]=4 4812 B12R1.252 CC(=O)NCCc1ccncc1 527a_100000742849_100103153847 [0,0,0,0,1,0|3,0,0]=4 4813 B12R1.252 CC(=O)NNCc1ccccc1 22a_100000007032_100000070787 [0,0,0,0,1,0|3,0,0]=4 4814 B12R1.252 CC(=O)OCNc1ccccc1 34a_100000106764_100009813279 [0,0,0,0,1,0|3,0,0]=4 4815 B12R1.252 CC(=O)OCOc1ccccc1 34a_100000210340_100009813279 [0,0,0,0,1,0|3,0,0]=4 4816 B12R1.252 CC(=O)OCSc1ccccc1 62a_100000076356_100000041952 [0,0,0,0,1,0|3,0,0]=4 4817 B12R1.252 CC(=O)OCSc1ccccc1 62a_100000719477_100000076356 [0,0,0,0,1,0|3,0,0]=4 4818 B12R1.252 CC(O)CCNc1ccccc1 34a_100000106764_100012276601 [0,0,0,0,1,0|2,0,1]=4 4819 B12R1.252 CC(O)CCOc1ccccc1 34a_100000210340_100012276601 [0,0,0,0,1,0|2,0,1]=4 4820 B12R1.252 CC(O)CCOc1ccccc1 7a_100000210340_100012276601 [0,0,0,0,1,0|2,0,1]=4 4821 B12R1.252 CC(O)CCSc1ccccc1 62a_100000719477_100012276601 [0,0,0,0,1,0|2,0,1]=4 4822 B12R1.252 CC(O)CCSc1ccccc1 62a_100012276601_100000041952 [0,0,0,0,1,0|2,0,1]=4 4823 B12R1.252 CC(O)CNCc1ccccc1 207a_100000210904_100015611070 [0,0,0,0,1,0|2,0,1]=4 4824 B12R1.252 CC(O)CNCc1ccccc1 2230a_100000210904_100015291786 [0,0,0,0,1,0|2,0,1]=4 4825 B12R1.252 CC(O)CNCc1ccccc1 2230a_100015324214_100011218427 [0,0,0,0,1,0|2,0,1]=4 4826 B12R1.252 CC(O)CNCc1ccccc1 270004a_100000210904_100015611070 [0,0,0,0,1,0|2,0,1]=4 4827 B12R1.252 CC(O)CNCc1ccccc1 34a_100000210904_100015291786 [0,0,0,0,1,0|2,0,1]=4 4828 B12R1.252 CC(O)CNCc1ccccc1 34a_100015324214_100011218427 [0,0,0,0,1,0|2,0,1]=4 4829 B12R1.252 CC(O)COCc1ccccc1 34a_100000210790_100011218427 [0,0,0,0,1,0|2,0,1]=4 4830 B12R1.252 CC(O)COCc1ccccc1 7a_100000210790_100011218427 [0,0,0,0,1,0|2,0,1]=4 4831 B12R1.252 CC(O)CSCc1ccccc1 62a_100000211182_100011218427 [0,0,0,0,1,0|2,0,1]=4 4832 B12R1.252 CC(O)CSCc1ccccc1 62a_100011218427_100015291786 [0,0,0,0,1,0|2,0,1]=4 4833 B12R1.252 CN(C)CCCc1ccccc1 2230a_100000693637_200000210301 [0,0,0,0,1,0|3,0,0]=4 4834 B12R1.252 CN(C)CCCc1ccccc1 2230a_100102631434_100000211621 [0,0,0,0,1,0|3,0,0]=4 4835 B12R1.252 CN(C)CCCc1ccccc1 269982a_100000693637_200000210301 [0,0,0,0,1,0|3,0,0]=4 4836 B12R1.252 CN(C)CCCc1ccccc1 269982a_100102631434_100000211621 [0,0,0,0,1,0|3,0,0]=4 4837 B12R1.252 CN([13CH3])CCCc1ccccc1 2230a_100000693637_200025704644 [0,0,0,0,1,0|3,0,0]=4 4838 B12R1.252 CN([13CH3])CCCc1ccccc1 269982a_100000693637_200025704644 [0,0,0,0,1,0|3,0,0]=4 4839 B12R1.252 C[C@@H](O)CNCc1ccccc1 2230a_100015324214_100009817552 [0,0,0,0,1,0|2,0,1]=4 4840 B12R1.252 C[C@@H](O)CNCc1ccccc1 34a_100015324214_100009817552 [0,0,0,0,1,0|2,0,1]=4 4841 B12R1.252 C[C@@H](O)COCc1ccccc1 34a_100000210790_100009817552 [0,0,0,0,1,0|2,0,1]=4 4842 B12R1.252 C[C@@H](O)COCc1ccccc1 7a_100000210790_100009817552 [0,0,0,0,1,0|2,0,1]=4 4843 B12R1.252 C[C@@H](O)CSCc1ccccc1 62a_100000211182_100009817552 [0,0,0,0,1,0|2,0,1]=4 4844 B12R1.252 C[C@@H](O)CSCc1ccccc1 62a_100009817552_100015291786 [0,0,0,0,1,0|2,0,1]=4 4845 B12R1.252 NC(=O)CCNc1ccccc1 34a_100000106764_100000731001 [0,0,0,0,1,0|2,0,0]=3 4846 B12R1.252 NC(=O)CCOc1ccccc1 34a_100000210340_100000731001 [0,0,0,0,1,0|2,0,0]=3 4847 B12R1.252 NC(=O)CCOc1ccccc1 7a_100000210340_100000744528 [0,0,0,0,1,0|2,0,0]=3 4848 B12R1.252 NC(=O)CCOc1cccnc1 34a_100000210849_100000731001 [0,0,0,0,1,0|3,0,0]=4 4849 B12R1.252 NC(=O)CCOc1cccnc1 7a_100000210849_100000744528 [0,0,0,0,1,0|3,0,0]=4 4850 B12R1.252 NC(=O)CCOc1ccncc1 34a_100000212176_100000731001 [0,0,0,0,1,0|3,0,0]=4 4851 B12R1.252 NC(=O)CCSc1ccccc1 62a_100000719477_100000744528 [0,0,0,0,1,0|2,0,0]=3 4852 B12R1.252 NC(=O)CCSc1ccccc1 62a_100000744528_100000041952 [0,0,0,0,1,0|2,0,0]=3 4853 B12R1.252 NC(=O)CCSc1ccccn1 62a_100000744528_100011216584 [0,0,0,0,1,0|3,0,0]=4 4854 B12R1.252 NC(=O)CCSc1ccccn1 62a_100011216584_100000744528 [0,0,0,0,1,0|3,0,0]=4 4855 B12R1.252 NC(=O)CCSc1cccnc1 62a_100000210063_100000744528 [0,0,0,0,1,0|3,0,0]=4 4856 B12R1.252 NC(=O)CCSc1cccnc1 62a_100000744528_100000210063 [0,0,0,0,1,0|3,0,0]=4 4857 B12R1.252 NC(=O)CCSc1ccncc1 62a_100000728582_100000744528 [0,0,0,0,1,0|3,0,0]=4 4858 B12R1.252 NC(=O)CCSc1ccncc1 62a_100000744528_100000728582 [0,0,0,0,1,0|3,0,0]=4 4859 B12R1.252 NC(=O)CNCc1ccccc1 2230a_100000711301_100015291786 [0,0,0,0,1,0|2,0,0]=3 4860 B12R1.252 NC(=O)CNCc1ccccc1 2230a_100015324214_100000747473 [0,0,0,0,1,0|2,0,0]=3 4861 B12R1.252 NC(=O)CNCc1ccccc1 34a_100015324214_100000187820 [0,0,0,0,1,0|2,0,0]=3 4862 B12R1.252 NC(=O)CNCc1ccccn1 2230a_100000711301_100000721315 [0,0,0,0,1,0|3,0,0]=4 4863 B12R1.252 NC(=O)CNCc1cccnc1 2230a_100000711301_100000741622 [0,0,0,0,1,0|3,0,0]=4 4864 B12R1.252 NC(=O)CNCc1ccncc1 2230a_100000711301_100015193705 [0,0,0,0,1,0|3,0,0]=4 4865 B12R1.252 NC(=O)COCc1ccccc1 34a_100000210790_100000187820 [0,0,0,0,1,0|2,0,0]=3 4866 B12R1.252 NC(=O)COCc1ccccc1 7a_100000210790_100000187820 [0,0,0,0,1,0|2,0,0]=3 4867 B12R1.252 NC(=O)CSCc1ccccc1 62a_100000211182_100000747473 [0,0,0,0,1,0|2,0,0]=3 4868 B12R1.252 NC(=O)CSCc1ccccc1 62a_100000747473_100015291786 [0,0,0,0,1,0|2,0,0]=3 4869 B12R1.252 NC(=O)CSCc1ccccn1 62a_100000721315_100000747473 [0,0,0,0,1,0|3,0,0]=4 4870 B12R1.252 NC(=O)CSCc1ccccn1 62a_100000747473_100000721315 [0,0,0,0,1,0|3,0,0]=4 4871 B12R1.252 NC(=O)CSCc1cccnc1 62a_100000741622_100000747473 [0,0,0,0,1,0|3,0,0]=4 4872 B12R1.252 NC(=O)CSCc1cccnc1 62a_100000747473_100000741622 [0,0,0,0,1,0|3,0,0]=4 4873 B12R1.252 NC(=O)CSCc1ccncc1 62a_100000747473_100015193705 [0,0,0,0,1,0|3,0,0]=4 4874 B12R1.252 NC(=O)CSCc1ccncc1 62a_100015193705_100000747473 [0,0,0,0,1,0|3,0,0]=4 4875 B12R1.252 O=C(O)CNCc1ccccc1 269956a_100016091260_100015291786 [0,0,0,0,1,0|1,0,0]=2 4876 B12R1.252 O=C(O)CNCc1ccccn1 269956a_100016091260_100000721315 [0,0,0,0,1,0|2,0,0]=3 4877 B12R1.252 O=C(O)CNCc1cccnc1 269956a_100016091260_100000733263 [0,0,0,0,1,0|2,0,0]=3 4878 B12R1.252 O=C(O)CNCc1cccnn1 269956a_100016091260_100016990269 [0,0,0,0,1,0|3,0,0]=4 4879 B12R1.252 O=C(O)CNCc1ccncc1 269956a_100016091260_100015193705 [0,0,0,0,1,0|2,0,0]=3 4880 B12R1.252 O=C(O)CNCc1cnccn1 269956a_100016091260_100016995436 [0,0,0,0,1,0|3,0,0]=4 4881 B12R1.252 O=C(O)CNCc1cncnc1 269956a_100016091260_100016991940 [0,0,0,0,1,0|3,0,0]=4 4882 B12R1.252 O=C(O)CNCc1ncccn1 269956a_100016091260_100000703007 [0,0,0,0,1,0|3,0,0]=4 4883 B12R1.252 O=C([O-])CNCc1ccccc1 34a_100015324214_100020667443 [0,0,0,0,1,0|1,0,1]=3 4884 B12R1.252 O=C([O-])COCc1ccccc1 34a_100000210790_100020667443 [0,0,0,0,1,0|1,0,1]=3 4885 B12R1.252 O=C([O-])CSCc1ccccc1 62a_100000211182_100020667443 [0,0,0,0,1,0|1,0,1]=3 4886 B12R1.252 O=C([O-])CSCc1ccccc1 62a_100020667443_100015291786 [0,0,0,0,1,0|1,0,1]=3 4887 B12R1.252 O=C([O-])CSCc1ccccn1 62a_100000721315_100020667443 [0,0,0,0,1,0|2,0,1]=4 4888 B12R1.252 O=C([O-])CSCc1ccccn1 62a_100020667443_100000721315 [0,0,0,0,1,0|2,0,1]=4 4889 B12R1.252 O=C([O-])CSCc1cccnc1 62a_100000741622_100020667443 [0,0,0,0,1,0|2,0,1]=4 4890 B12R1.252 O=C([O-])CSCc1cccnc1 62a_100020667443_100000741622 [0,0,0,0,1,0|2,0,1]=4 4891 B12R1.252 O=C([O-])CSCc1ccncc1 62a_100015193705_100020667443 [0,0,0,0,1,0|2,0,1]=4 4892 B12R1.252 O=C([O-])CSCc1ccncc1 62a_100020667443_100015193705 [0,0,0,0,1,0|2,0,1]=4 4893 B12R1.252 O=[N+]([O-])CNCc1ccccc1 34a_100015324214_100000761209 [0,0,0,0,1,0|2,0,1]=4 4894 B12R1.252 O=[N+]([O-])COCc1ccccc1 34a_100000210790_100000761209 [0,0,0,0,1,0|2,0,1]=4 4895 B12R1.252 O=[N+]([O-])CSCc1ccccc1 62a_100000211182_100000761209 [0,0,0,0,1,0|2,0,1]=4 4896 B12R1.252 [13CH3]C(=O)C/C=C/c1ccccc1 1458a_100011219626_200025704644 [0,0,0,0,1,0|1,0,2]=4 4897 B12R1.252 [13CH3]C(=O)CCCc1ccccc1 1458a_100011207963_200025704644 [0,0,0,0,1,0|1,0,0]=2 4898 B12R1.252 [13CH3]C(=O)CCCc1ccccn1 1458a_100000752327_200025704644 [0,0,0,0,1,0|2,0,0]=3 4899 B12R1.252 [13CH3]C(=O)CCCc1ccncc1 1458a_100020654287_200025704644 [0,0,0,0,1,0|2,0,0]=3 4900 B12R1.252 [13CH3]C(=O)CCOc1ccccc1 1458a_100000182761_200025704644 [0,0,0,0,1,0|2,0,0]=3 4901 B12R1.252 [13CH3]C(=O)CCSc1ccccc1 1458a_100000182436_200025704644 [0,0,0,0,1,0|2,0,0]=3 4902 B12R1.252 [13CH3]C(=O)COCc1ccccc1 1458a_100000230186_200025704644 [0,0,0,0,1,0|2,0,0]=3 4903 B12R1.252 [13CH3]C(=O)CSCc1ccccc1 1458a_100000150264_200025704644 [0,0,0,0,1,0|2,0,0]=3 4904 B12R1.252 [13CH3]C(=O)CSCc1ccccn1 1458a_100000742634_200025704644 [0,0,0,0,1,0|3,0,0]=4 4905 B12R1.255 CC(=O)CCCCc1cccs1 1458a_100011216592_200000210301 [0,0,0,0,1,0|2,0,0]=3 4906 B12R1.255 CC(=O)CCCOc1ccsc1 34a_100000106738_100000685027 [0,0,0,0,1,0|3,0,0]=4 4907 B12R1.255 CC(=O)CCCOc1ccsc1 7a_100000106738_100011215641 [0,0,0,0,1,0|3,0,0]=4 4908 B12R1.255 CC(=O)CCCSc1ccco1 62a_100009814098_100011215641 [0,0,0,0,1,0|3,0,0]=4 4909 B12R1.255 CC(=O)CCCSc1ccco1 62a_100011215641_100009814098 [0,0,0,0,1,0|3,0,0]=4 4910 B12R1.255 CC(=O)CCCSc1cccs1 62a_100011215356_100011215641 [0,0,0,0,1,0|3,0,0]=4 4911 B12R1.255 CC(=O)CCCSc1cccs1 62a_100011215641_100011215356 [0,0,0,0,1,0|3,0,0]=4 4912 B12R1.255 CC(=O)CCCSc1ccoc1 62a_100011215275_100011215641 [0,0,0,0,1,0|3,0,0]=4 4913 B12R1.255 CC(=O)CCCSc1ccoc1 62a_100011215641_100011215275 [0,0,0,0,1,0|3,0,0]=4 4914 B12R1.255 CC(=O)CCCSc1ccsc1 62a_100000738268_100011215641 [0,0,0,0,1,0|3,0,0]=4 4915 B12R1.255 CC(=O)CCCSc1ccsc1 62a_100011215641_100000738268 [0,0,0,0,1,0|3,0,0]=4 4916 B12R1.255 CC(=O)CCOCc1ccsc1 34a_100000759926_100011261437 [0,0,0,0,1,0|3,0,0]=4 4917 B12R1.255 CC(=O)CCOCc1ccsc1 7a_100000759926_100011261437 [0,0,0,0,1,0|3,0,0]=4 4918 B12R1.255 CC(=O)CCSCc1ccsc1 62a_100000053229_100011233845 [0,0,0,0,1,0|3,0,0]=4 4919 B12R1.255 CC(=O)CCSCc1ccsc1 62a_100011261437_100000053229 [0,0,0,0,1,0|3,0,0]=4 4920 B12R1.255 CC(=O)COCCc1cccs1 34a_100000211253_100000748579 [0,0,0,0,1,0|3,0,0]=4 4921 B12R1.255 NC(=O)CCCOc1ccsc1 34a_100000106738_100102525003 [0,0,0,0,1,0|3,0,0]=4 4922 B12R1.255 NC(=O)CCCOc1ccsc1 7a_100000106738_100102525003 [0,0,0,0,1,0|3,0,0]=4 4923 B12R1.255 NC(=O)CCCSc1ccco1 62a_100009814098_100102525003 [0,0,0,0,1,0|3,0,0]=4 4924 B12R1.255 NC(=O)CCCSc1ccco1 62a_100102525003_100009814098 [0,0,0,0,1,0|3,0,0]=4 4925 B12R1.255 NC(=O)CCCSc1cccs1 62a_100011215356_100102525003 [0,0,0,0,1,0|3,0,0]=4 4926 B12R1.255 NC(=O)CCCSc1cccs1 62a_100102525003_100011215356 [0,0,0,0,1,0|3,0,0]=4 4927 B12R1.255 NC(=O)CCCSc1ccoc1 62a_100011215275_100102525003 [0,0,0,0,1,0|3,0,0]=4 4928 B12R1.255 NC(=O)CCCSc1ccoc1 62a_100102525003_100011215275 [0,0,0,0,1,0|3,0,0]=4 4929 B12R1.255 NC(=O)CCCSc1ccsc1 62a_100000738268_100102525003 [0,0,0,0,1,0|3,0,0]=4 4930 B12R1.255 NC(=O)CCCSc1ccsc1 62a_100102525003_100000738268 [0,0,0,0,1,0|3,0,0]=4 4931 B12R1.255 NC(=O)CCNCc1ccco1 207a_100000740010_100000186105 [0,0,0,0,1,0|3,0,0]=4 4932 B12R1.255 NC(=O)CCNCc1ccco1 2230a_100000185738_100000744528 [0,0,0,0,1,0|3,0,0]=4 4933 B12R1.255 NC(=O)CCNCc1ccco1 34a_100000185738_100000731001 [0,0,0,0,1,0|3,0,0]=4 4934 B12R1.255 NC(=O)CCNCc1cccs1 207a_100000740010_100000209959 [0,0,0,0,1,0|3,0,0]=4 4935 B12R1.255 NC(=O)CCNCc1cccs1 2230a_100000211653_100000744528 [0,0,0,0,1,0|3,0,0]=4 4936 B12R1.255 NC(=O)CCNCc1ccoc1 207a_100000740010_100011215517 [0,0,0,0,1,0|3,0,0]=4 4937 B12R1.255 NC(=O)CCNCc1ccoc1 2230a_100015206860_100000744528 [0,0,0,0,1,0|3,0,0]=4 4938 B12R1.255 NC(=O)CCNCc1ccoc1 34a_100015206860_100000731001 [0,0,0,0,1,0|3,0,0]=4 4939 B12R1.255 NC(=O)CCNCc1ccsc1 207a_100000740010_100000188534 [0,0,0,0,1,0|3,0,0]=4 4940 B12R1.255 NC(=O)CCNCc1ccsc1 2230a_100000186416_100000744528 [0,0,0,0,1,0|3,0,0]=4 4941 B12R1.255 NC(=O)CCNCc1ccsc1 34a_100000186416_100000731001 [0,0,0,0,1,0|3,0,0]=4 4942 B12R1.255 NC(=O)CCOCc1ccco1 34a_100000210059_100000731001 [0,0,0,0,1,0|3,0,0]=4 4943 B12R1.255 NC(=O)CCOCc1cccs1 34a_100000211240_100000731001 [0,0,0,0,1,0|3,0,0]=4 4944 B12R1.255 NC(=O)CCOCc1ccoc1 34a_100011215357_100000731001 [0,0,0,0,1,0|3,0,0]=4 4945 B12R1.255 NC(=O)CCOCc1ccsc1 34a_100000757172_100011261437 [0,0,0,0,1,0|3,0,0]=4 4946 B12R1.255 NC(=O)CCOCc1ccsc1 34a_100011215551_100000731001 [0,0,0,0,1,0|3,0,0]=4 4947 B12R1.255 NC(=O)CCOCc1ccsc1 7a_100000757172_100011261437 [0,0,0,0,1,0|3,0,0]=4 4948 B12R1.255 NC(=O)CCSCc1ccsc1 62a_100000744528_100011233845 [0,0,0,0,1,0|3,0,0]=4 4949 B12R1.255 NC(=O)CCSCc1ccsc1 62a_100011261437_100000744528 [0,0,0,0,1,0|3,0,0]=4 4950 B12R1.255 NC(=O)CNCCc1ccco1 2230a_100000694680_100000747473 [0,0,0,0,1,0|3,0,0]=4 4951 B12R1.255 NC(=O)CNCCc1ccco1 34a_100000694680_100000187820 [0,0,0,0,1,0|3,0,0]=4 4952 B12R1.255 NC(=O)CNCCc1cccs1 2230a_100000203755_100000747473 [0,0,0,0,1,0|3,0,0]=4 4953 B12R1.255 NC(=O)CNCCc1cccs1 2230a_100000711301_100000748579 [0,0,0,0,1,0|3,0,0]=4 4954 B12R1.255 NC(=O)CNCCc1cccs1 34a_100000203755_100000187820 [0,0,0,0,1,0|3,0,0]=4 4955 B12R1.255 NC(=O)CNCCc1ccsc1 2230a_100000692642_100000747473 [0,0,0,0,1,0|3,0,0]=4 4956 B12R1.255 NC(=O)CNCCc1ccsc1 34a_100000692642_100000187820 [0,0,0,0,1,0|3,0,0]=4 4957 B12R1.255 NC(=O)CNCCn1cccc1 2230a_100000711301_200009811947 [0,0,0,0,1,0|3,0,0]=4 4958 B12R1.255 NC(=O)CNCCn1cccc1 34a_100011368172_100000187820 [0,0,0,0,1,0|3,0,0]=4 4959 B12R1.255 NC(=O)COCCc1cccs1 34a_100011216825_100000187820 [0,0,0,0,1,0|3,0,0]=4 4960 B12R1.255 NC(=O)COCCc1cccs1 7a_100011216825_100000187820 [0,0,0,0,1,0|3,0,0]=4 4961 B12R1.255 NC(=O)COCCc1ccsc1 34a_100000748821_100000187820 [0,0,0,0,1,0|3,0,0]=4 4962 B12R1.255 NC(=O)COCCn1cccc1 34a_100000179382_100000187820 [0,0,0,0,1,0|3,0,0]=4 4963 B12R1.255 NC(=O)CSCCc1cccs1 62a_100000747473_100000748579 [0,0,0,0,1,0|3,0,0]=4 4964 B12R1.255 NC(=O)CSCCc1cccs1 62a_100000748579_100000747473 [0,0,0,0,1,0|3,0,0]=4 4965 B12R1.255 NC(=O)CSCCn1cccc1 62a_100000747473_200000035178 [0,0,0,0,1,0|3,0,0]=4 4966 B12R1.255 NC(=O)CSCCn1cccc1 62a_200009811947_100000747473 [0,0,0,0,1,0|3,0,0]=4 4967 B12R1.255 O=C(O)CNCCc1c[nH]cn1 269956a_100016091260_100020628418 [0,0,0,0,1,0|3,0,0]=4 4968 B12R1.255 O=C(O)CNCCc1cccs1 269956a_100016091260_100000748579 [0,0,0,0,1,0|2,0,0]=3 4969 B12R1.255 O=C(O)CNCCc1cn[nH]c1 269956a_100016091260_100000743252 [0,0,0,0,1,0|3,0,0]=4 4970 B12R1.255 O=C(O)CNCCn1cccc1 269956a_100016091260_200000035178 [0,0,0,0,1,0|2,0,0]=3 4971 B12R1.255 O=C(O)CNCCn1cccn1 269956a_100016091260_100000685285 [0,0,0,0,1,0|3,0,0]=4 4972 B12R1.255 O=C(O)CNCCn1ccnc1 269956a_100016091260_100000702546 [0,0,0,0,1,0|3,0,0]=4 4973 B12R1.255 O=C(O)CONCc1ccsc1 269956a_100000106656_100011261437 [0,0,0,0,1,0|3,0,0]=4 4974 B12R1.255 O=C([O-])CNCCc1ccco1 34a_100000694680_100020667443 [0,0,0,0,1,0|2,0,1]=4 4975 B12R1.255 O=C([O-])CNCCc1cccs1 34a_100000203755_100020667443 [0,0,0,0,1,0|2,0,1]=4 4976 B12R1.255 O=C([O-])CNCCc1ccsc1 34a_100000692642_100020667443 [0,0,0,0,1,0|2,0,1]=4 4977 B12R1.255 O=C([O-])CNCCn1cccc1 34a_100011368172_100020667443 [0,0,0,0,1,0|2,0,1]=4 4978 B12R1.255 O=C([O-])COCCc1cccs1 34a_100011216825_100020667443 [0,0,0,0,1,0|2,0,1]=4 4979 B12R1.255 O=C([O-])COCCc1ccsc1 34a_100000748821_100020667443 [0,0,0,0,1,0|2,0,1]=4 4980 B12R1.255 O=C([O-])COCCn1cccc1 34a_100000179382_100020667443 [0,0,0,0,1,0|2,0,1]=4 4981 B12R1.255 O=C([O-])CSCCc1cccs1 62a_100000748579_100020667443 [0,0,0,0,1,0|2,0,1]=4 4982 B12R1.255 O=C([O-])CSCCc1cccs1 62a_100020667443_100000748579 [0,0,0,0,1,0|2,0,1]=4 4983 B12R1.255 O=C([O-])CSCCn1cccc1 62a_100020667443_200000035178 [0,0,0,0,1,0|2,0,1]=4 4984 B12R1.255 O=C([O-])CSCCn1cccc1 62a_200009811947_100020667443 [0,0,0,0,1,0|2,0,1]=4 4985 B12R1.255 [13CH3]C(=O)CCCCc1cccs1 1458a_100011216592_200025704644 [0,0,0,0,1,0|2,0,0]=3 4986 B14R1.422 C=C(Br)CCOCCc1ccccc1 34a_100009813270_100000765856 [0,0,0,0,0,1|2,0,0]=3 4987 B14R1.422 C=C(C)CCNCCc1ccccc1 2230a_100000106460_100000730704 [0,0,0,0,0,1|2,0,0]=3 4988 B14R1.422 C=C(C)CCNCCc1ccccc1 34a_100000106460_100000730704 [0,0,0,0,0,1|2,0,0]=3 4989 B14R1.422 C=C(C)CCNCCc1cccnc1 2230a_100000736294_100000730704 [0,0,0,0,0,1|3,0,0]=4 4990 B14R1.422 C=C(C)CCOCCc1ccccc1 34a_100000210268_100000730704 [0,0,0,0,0,1|2,0,0]=3 4991 B14R1.422 C=C(C)CCOCCc1ccccc1 34a_100000764851_100000765856 [0,0,0,0,0,1|2,0,0]=3 4992 B14R1.422 C=C(C)CCOCCc1ccccc1 7a_100000210268_100000730704 [0,0,0,0,0,1|2,0,0]=3 4993 B14R1.422 C=C(C)CCOCCc1ccccn1 34a_100000210271_100000730704 [0,0,0,0,0,1|3,0,0]=4 4994 B14R1.422 C=C(C)CCOCCc1cccnc1 34a_100011217484_100000730704 [0,0,0,0,0,1|3,0,0]=4 4995 B14R1.422 C=C(C)CCOCCc1ccncc1 34a_100011216225_100000730704 [0,0,0,0,0,1|3,0,0]=4 4996 B14R1.422 C=C(C)CCSCCc1ccccc1 62a_100000730704_100011218657 [0,0,0,0,0,1|2,0,0]=3 4997 B14R1.422 C=C(C)CCSCCc1ccccc1 62a_100000765856_100000730704 [0,0,0,0,0,1|2,0,0]=3 4998 B14R1.422 C=C(C)CCSCCc1ccccn1 62a_100000730704_100015183660 [0,0,0,0,0,1|3,0,0]=4 4999 B14R1.422 C=C(C)CCSCCc1ccccn1 62a_100015183660_100000730704 [0,0,0,0,0,1|3,0,0]=4 5000 B14R1.422 C=C(C)CCSCCc1cccnc1 62a_100000730704_200011713674 [0,0,0,0,0,1|3,0,0]=4 5001 B14R1.422 C=C(C)CCSCCc1cccnc1 62a_200011713674_100000730704 [0,0,0,0,0,1|3,0,0]=4 5002 B14R1.422 C=C(C)CCSCCc1ccncc1 62a_100000723409_100000730704 [0,0,0,0,0,1|3,0,0]=4 5003 B14R1.422 C=C(C)CCSCCc1ccncc1 62a_100000730704_100000723409 [0,0,0,0,0,1|3,0,0]=4 5004 B14R1.422 C=C(C)CCSCSc1ccccc1 62a_100000730704_100011218342 [0,0,0,0,0,1|3,0,0]=4 5005 B14R1.422 C=C(C)CCSCSc1ccccc1 62a_100011218342_100000730704 [0,0,0,0,0,1|3,0,0]=4 5006 B14R1.422 C=C(C)CNCCCc1ccccc1 2230a_100000211184_100000748629 [0,0,0,0,0,1|2,0,0]=3 5007 B14R1.422 C=C(C)CNCCCc1ccccc1 34a_100000211184_100000748629 [0,0,0,0,0,1|2,0,0]=3 5008 B14R1.422 C=C(C)CNCCCc1cccnc1 2230a_100011532358_100000748629 [0,0,0,0,0,1|3,0,0]=4 5009 B14R1.422 C=C(C)CNCCCc1cccnc1 34a_100011532358_100000748629 [0,0,0,0,0,1|3,0,0]=4 5010 B14R1.422 C=C(C)CNCCCc1ccncc1 2230a_100011275580_100000748629 [0,0,0,0,0,1|3,0,0]=4 5011 B14R1.422 C=C(C)CNCCOc1ccccc1 2230a_100000174943_100000748629 [0,0,0,0,0,1|3,0,0]=4 5012 B14R1.422 C=C(C)CNCCOc1ccccc1 34a_100000174943_100000748629 [0,0,0,0,0,1|3,0,0]=4 5013 B14R1.422 C=C(C)CNCCSc1ccccc1 2230a_100000189519_100000748629 [0,0,0,0,0,1|3,0,0]=4 5014 B14R1.422 C=C(C)COCCCc1ccccc1 34a_100000210245_100000211621 [0,0,0,0,0,1|2,0,0]=3 5015 B14R1.422 C=C(C)COCCCc1ccccc1 34a_100000210828_100000748629 [0,0,0,0,0,1|2,0,0]=3 5016 B14R1.422 C=C(C)COCCCc1ccccc1 7a_100000210828_100000748629 [0,0,0,0,0,1|2,0,0]=3 5017 B14R1.422 C=C(C)COCCCc1ccccn1 34a_100011215068_100000748629 [0,0,0,0,0,1|3,0,0]=4 5018 B14R1.422 C=C(C)COCCCc1cccnc1 34a_100000211284_100000748629 [0,0,0,0,0,1|3,0,0]=4 5019 B14R1.422 C=C(C)COCCCc1ccncc1 34a_100000210659_100000748629 [0,0,0,0,0,1|3,0,0]=4 5020 B14R1.422 C=C(C)COCCNc1ccccc1 34a_100000211345_100000748629 [0,0,0,0,0,1|3,0,0]=4 5021 B14R1.422 C=C(C)COCCOc1ccccc1 34a_100000210245_100000184471 [0,0,0,0,0,1|3,0,0]=4 5022 B14R1.422 C=C(C)COCCOc1ccccc1 34a_100000210260_100000748629 [0,0,0,0,0,1|3,0,0]=4 5023 B14R1.422 C=C(C)COCCOc1ccccc1 7a_100000210260_100000748629 [0,0,0,0,0,1|3,0,0]=4 5024 B14R1.422 C=C(C)COCCSc1ccccc1 34a_100000210245_100000246102 [0,0,0,0,0,1|3,0,0]=4 5025 B14R1.422 C=C(C)COCCSc1ccccc1 7a_100000230494_100000748629 [0,0,0,0,0,1|3,0,0]=4 5026 B14R1.422 C=C(C)COCOCc1ccccc1 34a_100000210245_100000763385 [0,0,0,0,0,1|3,0,0]=4 5027 B14R1.422 C=C(C)COCSCc1ccccc1 34a_100000210245_200011217039 [0,0,0,0,0,1|3,0,0]=4 5028 B14R1.422 C=C(C)CSCCCc1ccccc1 62a_100000211621_100000211660 [0,0,0,0,0,1|2,0,0]=3 5029 B14R1.422 C=C(C)CSCCCc1ccccc1 62a_100000748629_100000211621 [0,0,0,0,0,1|2,0,0]=3 5030 B14R1.422 C=C(C)CSCCOc1ccccc1 62a_100000184471_100000211660 [0,0,0,0,0,1|3,0,0]=4 5031 B14R1.422 C=C(C)CSCCOc1ccccc1 62a_100000748629_100000184471 [0,0,0,0,0,1|3,0,0]=4 5032 B14R1.422 C=C(C)CSCCSc1ccccc1 62a_100000246102_100000211660 [0,0,0,0,0,1|3,0,0]=4 5033 B14R1.422 C=C(C)CSCCSc1ccccc1 62a_100000748629_100000246102 [0,0,0,0,0,1|3,0,0]=4 5034 B14R1.422 C=C(C)CSCOCc1ccccc1 62a_100000748629_100000763385 [0,0,0,0,0,1|3,0,0]=4 5035 B14R1.422 C=C(C)CSCOCc1ccccc1 62a_100000763385_100000211660 [0,0,0,0,0,1|3,0,0]=4 5036 B14R1.422 C=C(C)CSCSCc1ccccc1 62a_100000748629_200011217039 [0,0,0,0,0,1|3,0,0]=4 5037 B14R1.422 C=C(C)CSCSCc1ccccc1 62a_200011217039_100000211660 [0,0,0,0,0,1|3,0,0]=4 5038 B14R1.422 C=C(F)CNCCCc1ccccc1 2230a_100000211184_100009893438 [0,0,0,0,0,1|2,0,0]=3 5039 B14R1.422 C=C(F)CNCCCc1ccccc1 34a_100000211184_100009893438 [0,0,0,0,0,1|2,0,0]=3 5040 B14R1.422 C=C(F)CNCCCc1cccnc1 2230a_100011532358_100009893438 [0,0,0,0,0,1|3,0,0]=4 5041 B14R1.422 C=C(F)CNCCCc1cccnc1 34a_100011532358_100009893438 [0,0,0,0,0,1|3,0,0]=4 5042 B14R1.422 C=C(F)CNCCCc1ccncc1 2230a_100011275580_100009893438 [0,0,0,0,0,1|3,0,0]=4 5043 B14R1.422 C=C(F)CNCCOc1ccccc1 2230a_100000174943_100009893438 [0,0,0,0,0,1|3,0,0]=4 5044 B14R1.422 C=C(F)CNCCOc1ccccc1 34a_100000174943_100009893438 [0,0,0,0,0,1|3,0,0]=4 5045 B14R1.422 C=C(F)CNCCSc1ccccc1 2230a_100000189519_100009893438 [0,0,0,0,0,1|3,0,0]=4 5046 B14R1.422 C=C(F)COCCCc1ccccc1 34a_100000210828_100009893438 [0,0,0,0,0,1|2,0,0]=3 5047 B14R1.422 C=C(F)COCCCc1ccccc1 34a_200010262243_100000211621 [0,0,0,0,0,1|2,0,0]=3 5048 B14R1.422 C=C(F)COCCCc1ccccc1 7a_100000210828_100000042424 [0,0,0,0,0,1|2,0,0]=3 5049 B14R1.422 C=C(F)COCCCc1ccccn1 34a_100011215068_100009893438 [0,0,0,0,0,1|3,0,0]=4 5050 B14R1.422 C=C(F)COCCCc1cccnc1 34a_100000211284_100009893438 [0,0,0,0,0,1|3,0,0]=4 5051 B14R1.422 C=C(F)COCCCc1ccncc1 34a_100000210659_100009893438 [0,0,0,0,0,1|3,0,0]=4 5052 B14R1.422 C=C(F)COCCNc1ccccc1 34a_100000211345_100009893438 [0,0,0,0,0,1|3,0,0]=4 5053 B14R1.422 C=C(F)COCCOc1ccccc1 34a_100000210260_100009893438 [0,0,0,0,0,1|3,0,0]=4 5054 B14R1.422 C=C(F)COCCOc1ccccc1 34a_200010262243_100000184471 [0,0,0,0,0,1|3,0,0]=4 5055 B14R1.422 C=C(F)COCCOc1ccccc1 7a_100000210260_100000042424 [0,0,0,0,0,1|3,0,0]=4 5056 B14R1.422 C=C(F)COCCSc1ccccc1 34a_200010262243_100000246102 [0,0,0,0,0,1|3,0,0]=4 5057 B14R1.422 C=C(F)COCCSc1ccccc1 7a_100000230494_100000042424 [0,0,0,0,0,1|3,0,0]=4 5058 B14R1.422 C=C(F)COCOCc1ccccc1 34a_200010262243_100000763385 [0,0,0,0,0,1|3,0,0]=4 5059 B14R1.422 C=C(F)COCSCc1ccccc1 34a_200010262243_200011217039 [0,0,0,0,0,1|3,0,0]=4 5060 B14R1.422 C=C(F)CSCCCc1ccccc1 62a_100000042424_100000211621 [0,0,0,0,0,1|2,0,0]=3 5061 B14R1.422 C=C(F)CSCCCc1ccccc1 62a_100000211621_100000042424 [0,0,0,0,0,1|2,0,0]=3 5062 B14R1.422 C=C(F)CSCCOc1ccccc1 62a_100000042424_100000184471 [0,0,0,0,0,1|3,0,0]=4 5063 B14R1.422 C=C(F)CSCCOc1ccccc1 62a_100000184471_100000042424 [0,0,0,0,0,1|3,0,0]=4 5064 B14R1.422 C=C(F)CSCCSc1ccccc1 62a_100000042424_100000246102 [0,0,0,0,0,1|3,0,0]=4 5065 B14R1.422 C=C(F)CSCCSc1ccccc1 62a_100000246102_100000042424 [0,0,0,0,0,1|3,0,0]=4 5066 B14R1.422 C=C(F)CSCOCc1ccccc1 62a_100000042424_100000763385 [0,0,0,0,0,1|3,0,0]=4 5067 B14R1.422 C=C(F)CSCOCc1ccccc1 62a_100000763385_100000042424 [0,0,0,0,0,1|3,0,0]=4 5068 B14R1.422 C=C(F)CSCSCc1ccccc1 62a_100000042424_200011217039 [0,0,0,0,0,1|3,0,0]=4 5069 B14R1.422 C=C(F)CSCSCc1ccccc1 62a_200011217039_100000042424 [0,0,0,0,0,1|3,0,0]=4 5070 B14R1.422 CC(=CCCNCc1ccccc1)C 2230a_100015324214_100011217483 [0,0,0,0,0,1|2,0,1]=4 5071 B14R1.422 CC(=CCCNCc1ccccc1)C 34a_100015324214_100011217483 [0,0,0,0,0,1|2,0,1]=4 5072 B14R1.422 CC(=CCCOCc1ccccc1)C 34a_100000210790_100011217483 [0,0,0,0,0,1|2,0,1]=4 5073 B14R1.422 CC(=CCCOCc1ccccc1)C 7a_100000210790_100011217483 [0,0,0,0,0,1|2,0,1]=4 5074 B14R1.422 CC(=CCCSCc1ccccc1)C 62a_100000211182_100011217483 [0,0,0,0,0,1|2,0,1]=4 5075 B14R1.422 CC(=CCCSCc1ccccc1)C 62a_100011217483_100015291786 [0,0,0,0,0,1|2,0,1]=4 5076 B14R1.422 CC(=CCNCCc1ccccc1)C 2230a_100000106460_100000761012 [0,0,0,0,0,1|2,0,1]=4 5077 B14R1.422 CC(=CCNCCc1ccccc1)C 34a_100000106460_100000761012 [0,0,0,0,0,1|2,0,1]=4 5078 B14R1.422 CC(=CCNCCc1ccccc1)C 34a_100000718196_100000765856 [0,0,0,0,0,1|2,0,1]=4 5079 B14R1.422 CC(=CCOCCc1ccccc1)C 34a_100000210268_100000761012 [0,0,0,0,0,1|2,0,1]=4 5080 B14R1.422 CC(=CCOCCc1ccccc1)C 34a_100000753907_100000765856 [0,0,0,0,0,1|2,0,1]=4 5081 B14R1.422 CC(=CCOCCc1ccccc1)C 7a_100000210268_100000761012 [0,0,0,0,0,1|2,0,1]=4 5082 B14R1.422 CC(=CCSCCc1ccccc1)C 62a_100000761012_100011218657 [0,0,0,0,0,1|2,0,1]=4 5083 B14R1.422 CC(=CCSCCc1ccccc1)C 62a_100000765856_100000761012 [0,0,0,0,0,1|2,0,1]=4 5084 B14R1.422 CC(=O)CCCCCc1ccccc1 1458a_100000070787_200011217138 [0,0,0,0,0,1|1,0,0]=2 5085 B14R1.422 CC(=O)CCCCCc1ccccc1 1458a_100011216832_200000210301 [0,0,0,0,0,1|1,0,0]=2 5086 B14R1.422 CC(=O)CCCCNc1ccccc1 34a_100000106764_100009817362 [0,0,0,0,0,1|1,0,0]=2 5087 B14R1.422 CC(=O)CCCCOc1ccccc1 1458a_100000070787_100011215240 [0,0,0,0,0,1|1,0,0]=2 5088 B14R1.422 CC(=O)CCCCOc1ccccc1 1458a_200011216290_200000210301 [0,0,0,0,0,1|1,0,0]=2 5089 B14R1.422 CC(=O)CCCCOc1ccccc1 34a_100000210340_100009817362 [0,0,0,0,0,1|1,0,0]=2 5090 B14R1.422 CC(=O)CCCCOc1ccccc1 7a_100000210340_100000735457 [0,0,0,0,0,1|1,0,0]=2 5091 B14R1.422 CC(=O)CCCCOc1cccnc1 34a_100000210849_100009817362 [0,0,0,0,0,1|2,0,0]=3 5092 B14R1.422 CC(=O)CCCCOc1cccnc1 7a_100000210849_100000735457 [0,0,0,0,0,1|2,0,0]=3 5093 B14R1.422 CC(=O)CCCCOc1ccncc1 34a_100000212176_100009817362 [0,0,0,0,0,1|2,0,0]=3 5094 B14R1.422 CC(=O)CCCCOc1ccnnc1 34a_100015204005_100009817362 [0,0,0,0,0,1|3,0,0]=4 5095 B14R1.422 CC(=O)CCCCOc1cncnc1 7a_100000754086_100000735457 [0,0,0,0,0,1|3,0,0]=4 5096 B14R1.422 CC(=O)CCCCSc1ccccc1 62a_100000719477_100000735457 [0,0,0,0,0,1|1,0,0]=2 5097 B14R1.422 CC(=O)CCCCSc1ccccc1 62a_100000735457_100000041952 [0,0,0,0,0,1|1,0,0]=2 5098 B14R1.422 CC(=O)CCCCSc1ccccn1 62a_100000735457_100011216584 [0,0,0,0,0,1|2,0,0]=3 5099 B14R1.422 CC(=O)CCCCSc1ccccn1 62a_100011216584_100000735457 [0,0,0,0,0,1|2,0,0]=3 5100 B14R1.422 CC(=O)CCCCSc1cccnc1 62a_100000210063_100000735457 [0,0,0,0,0,1|2,0,0]=3 5101 B14R1.422 CC(=O)CCCCSc1cccnc1 62a_100000735457_100000210063 [0,0,0,0,0,1|2,0,0]=3 5102 B14R1.422 CC(=O)CCCCSc1cccnn1 62a_100000735457_100016991348 [0,0,0,0,0,1|3,0,0]=4 5103 B14R1.422 CC(=O)CCCCSc1cccnn1 62a_100016991348_100000735457 [0,0,0,0,0,1|3,0,0]=4 5104 B14R1.422 CC(=O)CCCCSc1ccncc1 62a_100000728582_100000735457 [0,0,0,0,0,1|2,0,0]=3 5105 B14R1.422 CC(=O)CCCCSc1ccncc1 62a_100000735457_100000728582 [0,0,0,0,0,1|2,0,0]=3 5106 B14R1.422 CC(=O)CCCCSc1ccncn1 62a_100000703185_100000735457 [0,0,0,0,0,1|3,0,0]=4 5107 B14R1.422 CC(=O)CCCCSc1ccncn1 62a_100000735457_100000703185 [0,0,0,0,0,1|3,0,0]=4 5108 B14R1.422 CC(=O)CCCCSc1ccnnc1 62a_100000732662_100000735457 [0,0,0,0,0,1|3,0,0]=4 5109 B14R1.422 CC(=O)CCCCSc1ccnnc1 62a_100000735457_100000732662 [0,0,0,0,0,1|3,0,0]=4 5110 B14R1.422 CC(=O)CCCCSc1cnccn1 62a_100000211759_100000735457 [0,0,0,0,0,1|3,0,0]=4 5111 B14R1.422 CC(=O)CCCCSc1cnccn1 62a_100000735457_100000211759 [0,0,0,0,0,1|3,0,0]=4 5112 B14R1.422 CC(=O)CCCCSc1cncnc1 62a_100000735457_100011206942 [0,0,0,0,0,1|3,0,0]=4 5113 B14R1.422 CC(=O)CCCCSc1cncnc1 62a_100011206942_100000735457 [0,0,0,0,0,1|3,0,0]=4 5114 B14R1.422 CC(=O)CCCCSc1ncccn1 62a_100000211032_100000735457 [0,0,0,0,0,1|3,0,0]=4 5115 B14R1.422 CC(=O)CCCCSc1ncccn1 62a_100000735457_100000211032 [0,0,0,0,0,1|3,0,0]=4 5116 B14R1.422 CC(=O)CCCNCc1ccccc1 34a_100015324214_100000685027 [0,0,0,0,0,1|1,0,0]=2 5117 B14R1.422 CC(=O)CCCOCc1ccccc1 1458a_100000070787_100011215529 [0,0,0,0,0,1|1,0,0]=2 5118 B14R1.422 CC(=O)CCCOCc1ccccc1 1458a_100000748059_200000210301 [0,0,0,0,0,1|1,0,0]=2 5119 B14R1.422 CC(=O)CCCOCc1ccccc1 34a_100000210790_100000685027 [0,0,0,0,0,1|1,0,0]=2 5120 B14R1.422 CC(=O)CCCOCc1ccccc1 34a_100000759063_100015291786 [0,0,0,0,0,1|1,0,0]=2 5121 B14R1.422 CC(=O)CCCOCc1ccccc1 7a_100000210790_100011215641 [0,0,0,0,0,1|1,0,0]=2 5122 B14R1.422 CC(=O)CCCOCc1ccccc1 7a_100000759063_100000211182 [0,0,0,0,0,1|1,0,0]=2 5123 B14R1.422 CC(=O)CCCOCc1ccccn1 34a_100000759063_100000721315 [0,0,0,0,0,1|2,0,0]=3 5124 B14R1.422 CC(=O)CCCOCc1ccccn1 7a_100000759063_100000721315 [0,0,0,0,0,1|2,0,0]=3 5125 B14R1.422 CC(=O)CCCOCc1cccnc1 34a_100000759063_100000733263 [0,0,0,0,0,1|2,0,0]=3 5126 B14R1.422 CC(=O)CCCOCc1cccnc1 7a_100000759063_100000741622 [0,0,0,0,0,1|2,0,0]=3 5127 B14R1.422 CC(=O)CCCOCc1cccnn1 34a_100000759063_100016990269 [0,0,0,0,0,1|3,0,0]=4 5128 B14R1.422 CC(=O)CCCOCc1cccnn1 7a_100000759063_100016990269 [0,0,0,0,0,1|3,0,0]=4 5129 B14R1.422 CC(=O)CCCOCc1ccncc1 7a_100000759063_100015193705 [0,0,0,0,0,1|2,0,0]=3 5130 B14R1.422 CC(=O)CCCOCc1cnccn1 34a_100000759063_100016995436 [0,0,0,0,0,1|3,0,0]=4 5131 B14R1.422 CC(=O)CCCOCc1cnccn1 7a_100000759063_100016995436 [0,0,0,0,0,1|3,0,0]=4 5132 B14R1.422 CC(=O)CCCOCc1cncnc1 34a_100000759063_100015196519 [0,0,0,0,0,1|3,0,0]=4 5133 B14R1.422 CC(=O)CCCOCc1cncnc1 7a_100000759063_100015196519 [0,0,0,0,0,1|3,0,0]=4 5134 B14R1.422 CC(=O)CCCOCc1ncccn1 34a_100000759063_100000703007 [0,0,0,0,0,1|3,0,0]=4 5135 B14R1.422 CC(=O)CCCOCc1ncccn1 7a_100000759063_100000703007 [0,0,0,0,0,1|3,0,0]=4 5136 B14R1.422 CC(=O)CCCSCc1ccccc1 62a_100000211182_100011215641 [0,0,0,0,0,1|1,0,0]=2 5137 B14R1.422 CC(=O)CCCSCc1ccccc1 62a_100011215641_100015291786 [0,0,0,0,0,1|1,0,0]=2 5138 B14R1.422 CC(=O)CCCSCc1ccccn1 62a_100000721315_100011215641 [0,0,0,0,0,1|2,0,0]=3 5139 B14R1.422 CC(=O)CCCSCc1ccccn1 62a_100011215641_100000721315 [0,0,0,0,0,1|2,0,0]=3 5140 B14R1.422 CC(=O)CCCSCc1cccnc1 62a_100000741622_100011215641 [0,0,0,0,0,1|2,0,0]=3 5141 B14R1.422 CC(=O)CCCSCc1cccnc1 62a_100011215641_100000741622 [0,0,0,0,0,1|2,0,0]=3 5142 B14R1.422 CC(=O)CCCSCc1cccnn1 62a_100011215641_100016990269 [0,0,0,0,0,1|3,0,0]=4 5143 B14R1.422 CC(=O)CCCSCc1cccnn1 62a_100016990269_100011215641 [0,0,0,0,0,1|3,0,0]=4 5144 B14R1.422 CC(=O)CCCSCc1ccncc1 62a_100011215641_100015193705 [0,0,0,0,0,1|2,0,0]=3 5145 B14R1.422 CC(=O)CCCSCc1ccncc1 62a_100015193705_100011215641 [0,0,0,0,0,1|2,0,0]=3 5146 B14R1.422 CC(=O)CCCSCc1cnccn1 62a_100011215641_100016995436 [0,0,0,0,0,1|3,0,0]=4 5147 B14R1.422 CC(=O)CCCSCc1cnccn1 62a_100016995436_100011215641 [0,0,0,0,0,1|3,0,0]=4 5148 B14R1.422 CC(=O)CCCSCc1cncnc1 62a_100011215641_100015196519 [0,0,0,0,0,1|3,0,0]=4 5149 B14R1.422 CC(=O)CCCSCc1cncnc1 62a_100015196519_100011215641 [0,0,0,0,0,1|3,0,0]=4 5150 B14R1.422 CC(=O)CCCSCc1ncccn1 62a_100000703007_100011215641 [0,0,0,0,0,1|3,0,0]=4 5151 B14R1.422 CC(=O)CCCSCc1ncccn1 62a_100011215641_100000703007 [0,0,0,0,0,1|3,0,0]=4 5152 B14R1.422 CC(=O)CCOCCc1ccccc1 34a_100000759926_100000765856 [0,0,0,0,0,1|1,0,0]=2 5153 B14R1.422 CC(=O)CCOCCc1ccccc1 7a_100000210268_100000053229 [0,0,0,0,0,1|1,0,0]=2 5154 B14R1.422 CC(=O)CCOCCc1ccccc1 7a_100000759926_100000765856 [0,0,0,0,0,1|1,0,0]=2 5155 B14R1.422 CC(=O)CCOCCc1ccccn1 7a_100000759926_100015183660 [0,0,0,0,0,1|2,0,0]=3 5156 B14R1.422 CC(=O)CCOCCc1cccnc1 7a_100000759926_200011713674 [0,0,0,0,0,1|2,0,0]=3 5157 B14R1.422 CC(=O)CCOCCc1ccncc1 7a_100000759926_100000723409 [0,0,0,0,0,1|2,0,0]=3 5158 B14R1.422 CC(=O)CCSCCc1ccccc1 62a_100000053229_100011218657 [0,0,0,0,0,1|1,0,0]=2 5159 B14R1.422 CC(=O)CCSCCc1ccccc1 62a_100000765856_100000053229 [0,0,0,0,0,1|1,0,0]=2 5160 B14R1.422 CC(=O)CCSCCc1ccccn1 62a_100000053229_100015183660 [0,0,0,0,0,1|2,0,0]=3 5161 B14R1.422 CC(=O)CCSCCc1ccccn1 62a_100015183660_100000053229 [0,0,0,0,0,1|2,0,0]=3 5162 B14R1.422 CC(=O)CCSCCc1cccnc1 62a_100000053229_200011713674 [0,0,0,0,0,1|2,0,0]=3 5163 B14R1.422 CC(=O)CCSCCc1cccnc1 62a_200011713674_100000053229 [0,0,0,0,0,1|2,0,0]=3 5164 B14R1.422 CC(=O)CCSCCc1ccncc1 62a_100000053229_100000723409 [0,0,0,0,0,1|2,0,0]=3 5165 B14R1.422 CC(=O)CCSCCc1ccncc1 62a_100000723409_100000053229 [0,0,0,0,0,1|2,0,0]=3 5166 B14R1.422 CC(=O)CCSCSc1ccccc1 62a_100000053229_100011218342 [0,0,0,0,0,1|2,0,0]=3 5167 B14R1.422 CC(=O)CCSCSc1ccccc1 62a_100011218342_100000053229 [0,0,0,0,0,1|2,0,0]=3 5168 B14R1.422 CC(=O)COC/C=C/c1ccccc1 34a_100000211253_100016265936 [0,0,0,0,0,1|1,0,2]=4 5169 B14R1.422 CC(=O)COCC#Cc1ccccc1 34a_100000211253_100011352542 [0,0,0,0,0,1|1,0,2]=4 5170 B14R1.422 CC(=O)COCCCc1ccccc1 34a_100000211253_100000211621 [0,0,0,0,0,1|1,0,0]=2 5171 B14R1.422 CC(=O)COCCOc1ccccc1 34a_100000211253_100000184471 [0,0,0,0,0,1|2,0,0]=3 5172 B14R1.422 CC(=O)COCCSc1ccccc1 34a_100000211253_100000246102 [0,0,0,0,0,1|2,0,0]=3 5173 B14R1.422 CC(=O)COCOCc1ccccc1 34a_100000211253_100000763385 [0,0,0,0,0,1|2,0,0]=3 5174 B14R1.422 CC(=O)COCSCc1ccccc1 34a_100000211253_200011217039 [0,0,0,0,0,1|2,0,0]=3 5175 B14R1.422 CC(=O)CSCCOc1ccccc1 1458a_200000150159_200000210301 [0,0,0,0,0,1|2,0,0]=3 5176 B14R1.422 CC(=O)NCCCCc1ccccc1 11a_100015280158_100015343762 [0,0,0,0,0,1|1,0,0]=2 5177 B14R1.422 CC(=O)NCCCCc1ccccc1 1626a_100015280158_100015343762 [0,0,0,0,0,1|1,0,0]=2 5178 B14R1.422 CC(=O)NCCCCc1ccccc1 240690a_100015280158_100015343762 [0,0,0,0,0,1|1,0,0]=2 5179 B14R1.422 CC(=O)NCCCCc1ccccc1 527a_100015280158_100103153847 [0,0,0,0,0,1|1,0,0]=2 5180 B14R1.422 CC(=O)NCCCOc1ccccc1 11a_100000216521_100015343762 [0,0,0,0,0,1|2,0,0]=3 5181 B14R1.422 CC(=O)NCCCOc1ccccc1 1626a_100000216521_100015343762 [0,0,0,0,0,1|2,0,0]=3 5182 B14R1.422 CC(=O)NCCCOc1ccccc1 240690a_100000216521_100015343762 [0,0,0,0,0,1|2,0,0]=3 5183 B14R1.422 CC(=O)NCCCOc1ccccc1 527a_100000216521_100103153847 [0,0,0,0,0,1|2,0,0]=3 5184 B14R1.422 CC(=O)NCCCSc1ccccc1 11a_100000184639_100015343762 [0,0,0,0,0,1|2,0,0]=3 5185 B14R1.422 CC(=O)NCCCSc1ccccc1 240690a_100000184639_100015343762 [0,0,0,0,0,1|2,0,0]=3 5186 B14R1.422 CC(=O)NCCCSc1ccccc1 527a_100000184639_100103153847 [0,0,0,0,0,1|2,0,0]=3 5187 B14R1.422 CC(=O)NCCNCc1ccccc1 207a_100000209853_100015611070 [0,0,0,0,0,1|2,0,0]=3 5188 B14R1.422 CC(=O)NCCNCc1ccccc1 2230a_100000209853_100015291786 [0,0,0,0,0,1|2,0,0]=3 5189 B14R1.422 CC(=O)NCCNCc1ccccc1 2230a_100015324214_100000189650 [0,0,0,0,0,1|2,0,0]=3 5190 B14R1.422 CC(=O)NCCNCc1ccccn1 207a_100000209853_100000209966 [0,0,0,0,0,1|3,0,0]=4 5191 B14R1.422 CC(=O)NCCNCc1ccccn1 2230a_100000209853_100000721315 [0,0,0,0,0,1|3,0,0]=4 5192 B14R1.422 CC(=O)NCCNCc1cccnc1 207a_100000209853_100000209961 [0,0,0,0,0,1|3,0,0]=4 5193 B14R1.422 CC(=O)NCCNCc1cccnc1 2230a_100000209853_100000741622 [0,0,0,0,0,1|3,0,0]=4 5194 B14R1.422 CC(=O)NCCNCc1ccncc1 207a_100000209853_100000186114 [0,0,0,0,0,1|3,0,0]=4 5195 B14R1.422 CC(=O)NCCNCc1ccncc1 2230a_100000209853_100015193705 [0,0,0,0,0,1|3,0,0]=4 5196 B14R1.422 CC(=O)NCCOCc1ccccc1 11a_100000753106_100015343762 [0,0,0,0,0,1|2,0,0]=3 5197 B14R1.422 CC(=O)NCCOCc1ccccc1 1626a_100000753106_100015343762 [0,0,0,0,0,1|2,0,0]=3 5198 B14R1.422 CC(=O)NCCOCc1ccccc1 240690a_100000753106_100015343762 [0,0,0,0,0,1|2,0,0]=3 5199 B14R1.422 CC(=O)NCCOCc1ccccc1 34a_100000158858_100015291786 [0,0,0,0,0,1|2,0,0]=3 5200 B14R1.422 CC(=O)NCCOCc1ccccc1 527a_100000753106_100103153847 [0,0,0,0,0,1|2,0,0]=3 5201 B14R1.422 CC(=O)NCCOCc1ccccc1 7a_100000210790_100000189650 [0,0,0,0,0,1|2,0,0]=3 5202 B14R1.422 CC(=O)NCCOCc1ccccn1 34a_100000158858_100000721315 [0,0,0,0,0,1|3,0,0]=4 5203 B14R1.422 CC(=O)NCCOCc1cccnc1 34a_100000158858_100000733263 [0,0,0,0,0,1|3,0,0]=4 5204 B14R1.422 CC(=O)NCCSCc1ccccc1 11a_100000189534_100015343762 [0,0,0,0,0,1|2,0,0]=3 5205 B14R1.422 CC(=O)NCCSCc1ccccc1 240690a_100000189534_100015343762 [0,0,0,0,0,1|2,0,0]=3 5206 B14R1.422 CC(=O)NCCSCc1ccccc1 527a_100000189534_100103153847 [0,0,0,0,0,1|2,0,0]=3 5207 B14R1.422 CC(=O)NCCSCc1ccccc1 62a_100000189650_100015291786 [0,0,0,0,0,1|2,0,0]=3 5208 B14R1.422 CC(=O)NCCSCc1ccccc1 62a_100000211182_100000189650 [0,0,0,0,0,1|2,0,0]=3 5209 B14R1.422 CC(=O)NCCSCc1ccccn1 62a_100000189650_100000721315 [0,0,0,0,0,1|3,0,0]=4 5210 B14R1.422 CC(=O)NCCSCc1ccccn1 62a_100000721315_100000189650 [0,0,0,0,0,1|3,0,0]=4 5211 B14R1.422 CC(=O)NCCSCc1cccnc1 62a_100000189650_100000741622 [0,0,0,0,0,1|3,0,0]=4 5212 B14R1.422 CC(=O)NCCSCc1cccnc1 62a_100000741622_100000189650 [0,0,0,0,0,1|3,0,0]=4 5213 B14R1.422 CC(=O)NCCSCc1ccncc1 62a_100000189650_100015193705 [0,0,0,0,0,1|3,0,0]=4 5214 B14R1.422 CC(=O)NCCSCc1ccncc1 62a_100015193705_100000189650 [0,0,0,0,0,1|3,0,0]=4 5215 B14R1.422 CC(=O)NN=CCCc1ccccc1 4a_100000189765_100000198083 [0,0,0,0,0,1|2,0,1]=4 5216 B14R1.422 CC(=O)OCCCNc1ccccc1 34a_100000106764_100000042594 [0,0,0,0,0,1|2,0,0]=3 5217 B14R1.422 CC(=O)OCCCOc1ccccc1 34a_100000210340_100000042594 [0,0,0,0,0,1|2,0,0]=3 5218 B14R1.422 CC(=O)OCCCOc1ccccc1 7a_100000210340_100000042594 [0,0,0,0,0,1|2,0,0]=3 5219 B14R1.422 CC(=O)OCCCOc1cccnc1 34a_100000210849_100000042594 [0,0,0,0,0,1|3,0,0]=4 5220 B14R1.422 CC(=O)OCCCOc1cccnc1 7a_100000210849_100000042594 [0,0,0,0,0,1|3,0,0]=4 5221 B14R1.422 CC(=O)OCCCOc1ccncc1 34a_100000212176_100000042594 [0,0,0,0,0,1|3,0,0]=4 5222 B14R1.422 CC(=O)OCCCSc1ccccc1 62a_100000042594_100000041952 [0,0,0,0,0,1|2,0,0]=3 5223 B14R1.422 CC(=O)OCCCSc1ccccc1 62a_100000719477_100000042594 [0,0,0,0,0,1|2,0,0]=3 5224 B14R1.422 CC(=O)OCCCSc1ccccn1 62a_100000042594_100011216584 [0,0,0,0,0,1|3,0,0]=4 5225 B14R1.422 CC(=O)OCCCSc1ccccn1 62a_100011216584_100000042594 [0,0,0,0,0,1|3,0,0]=4 5226 B14R1.422 CC(=O)OCCCSc1cccnc1 62a_100000042594_100000210063 [0,0,0,0,0,1|3,0,0]=4 5227 B14R1.422 CC(=O)OCCCSc1cccnc1 62a_100000210063_100000042594 [0,0,0,0,0,1|3,0,0]=4 5228 B14R1.422 CC(=O)OCCCSc1ccncc1 62a_100000042594_100000728582 [0,0,0,0,0,1|3,0,0]=4 5229 B14R1.422 CC(=O)OCCCSc1ccncc1 62a_100000728582_100000042594 [0,0,0,0,0,1|3,0,0]=4 5230 B14R1.422 CC(=O)OCCNCc1ccccc1 34a_100015324214_100009814007 [0,0,0,0,0,1|2,0,0]=3 5231 B14R1.422 CC(=O)OCCOCc1ccccc1 34a_100000210790_100009814007 [0,0,0,0,0,1|2,0,0]=3 5232 B14R1.422 CC(=O)OCCOCc1ccccc1 7a_100000210790_100009814007 [0,0,0,0,0,1|2,0,0]=3 5233 B14R1.422 CC(=O)OCCSCc1ccccc1 62a_100000211182_100009814007 [0,0,0,0,0,1|2,0,0]=3 5234 B14R1.422 CC(=O)OCCSCc1ccccc1 62a_100009814007_100015291786 [0,0,0,0,0,1|2,0,0]=3 5235 B14R1.422 CC(=O)OCCSCc1ccccn1 62a_100000721315_100009814007 [0,0,0,0,0,1|3,0,0]=4 5236 B14R1.422 CC(=O)OCCSCc1ccccn1 62a_100009814007_100000721315 [0,0,0,0,0,1|3,0,0]=4 5237 B14R1.422 CC(=O)OCCSCc1cccnc1 62a_100000741622_100009814007 [0,0,0,0,0,1|3,0,0]=4 5238 B14R1.422 CC(=O)OCCSCc1cccnc1 62a_100009814007_100000741622 [0,0,0,0,0,1|3,0,0]=4 5239 B14R1.422 CC(=O)OCCSCc1ccncc1 62a_100009814007_100015193705 [0,0,0,0,0,1|3,0,0]=4 5240 B14R1.422 CC(=O)OCCSCc1ccncc1 62a_100015193705_100009814007 [0,0,0,0,0,1|3,0,0]=4 5241 B14R1.422 CC(=O)OCNCCc1ccccc1 34a_100000106460_100009813279 [0,0,0,0,0,1|2,0,0]=3 5242 B14R1.422 CC(=O)OCOCCc1ccccc1 34a_100000210268_100009813279 [0,0,0,0,0,1|2,0,0]=3 5243 B14R1.422 CC(=O)OCOCCc1ccccn1 34a_100000210271_100009813279 [0,0,0,0,0,1|3,0,0]=4 5244 B14R1.422 CC(=O)OCOCCc1cccnc1 34a_100011217484_100009813279 [0,0,0,0,0,1|3,0,0]=4 5245 B14R1.422 CC(=O)OCOCCc1ccncc1 34a_100011216225_100009813279 [0,0,0,0,0,1|3,0,0]=4 5246 B14R1.422 CC(=O)OCSCCc1ccccc1 62a_100000076356_100011218657 [0,0,0,0,0,1|2,0,0]=3 5247 B14R1.422 CC(=O)OCSCCc1ccccc1 62a_100000765856_100000076356 [0,0,0,0,0,1|2,0,0]=3 5248 B14R1.422 CC(=O)OCSCCc1ccccn1 62a_100000076356_100015183660 [0,0,0,0,0,1|3,0,0]=4 5249 B14R1.422 CC(=O)OCSCCc1ccccn1 62a_100015183660_100000076356 [0,0,0,0,0,1|3,0,0]=4 5250 B14R1.422 CC(=O)OCSCCc1cccnc1 62a_100000076356_200011713674 [0,0,0,0,0,1|3,0,0]=4 5251 B14R1.422 CC(=O)OCSCCc1cccnc1 62a_200011713674_100000076356 [0,0,0,0,0,1|3,0,0]=4 5252 B14R1.422 CC(=O)OCSCCc1ccncc1 62a_100000076356_100000723409 [0,0,0,0,0,1|3,0,0]=4 5253 B14R1.422 CC(=O)OCSCCc1ccncc1 62a_100000723409_100000076356 [0,0,0,0,0,1|3,0,0]=4 5254 B14R1.422 CC(=O)OCSCSc1ccccc1 62a_100000076356_100011218342 [0,0,0,0,0,1|3,0,0]=4 5255 B14R1.422 CC(=O)OCSCSc1ccccc1 62a_100011218342_100000076356 [0,0,0,0,0,1|3,0,0]=4 5256 B14R1.422 CC(=O)SCCCNc1ccccc1 34a_100000106764_100000038929 [0,0,0,0,0,1|2,0,0]=3 5257 B14R1.422 CC(=O)SCCCOc1ccccc1 34a_100000210340_100000038929 [0,0,0,0,0,1|2,0,0]=3 5258 B14R1.422 CC(=O)SCCCOc1ccccc1 7a_100000210340_100000038929 [0,0,0,0,0,1|2,0,0]=3 5259 B14R1.422 CC(=O)SCCCOc1cccnc1 34a_100000210849_100000038929 [0,0,0,0,0,1|3,0,0]=4 5260 B14R1.422 CC(=O)SCCCOc1cccnc1 7a_100000210849_100000038929 [0,0,0,0,0,1|3,0,0]=4 5261 B14R1.422 CC(=O)SCCCOc1ccncc1 34a_100000212176_100000038929 [0,0,0,0,0,1|3,0,0]=4 5262 B14R1.422 CC(=O)SCCCSc1ccccc1 62a_100000038929_100000041952 [0,0,0,0,0,1|2,0,0]=3 5263 B14R1.422 CC(=O)SCCCSc1ccccc1 62a_100000719477_100000038929 [0,0,0,0,0,1|2,0,0]=3 5264 B14R1.422 CC(=O)SCCCSc1ccccn1 62a_100000038929_100011216584 [0,0,0,0,0,1|3,0,0]=4 5265 B14R1.422 CC(=O)SCCCSc1ccccn1 62a_100011216584_100000038929 [0,0,0,0,0,1|3,0,0]=4 5266 B14R1.422 CC(=O)SCCCSc1cccnc1 62a_100000038929_100000210063 [0,0,0,0,0,1|3,0,0]=4 5267 B14R1.422 CC(=O)SCCCSc1cccnc1 62a_100000210063_100000038929 [0,0,0,0,0,1|3,0,0]=4 5268 B14R1.422 CC(=O)SCCCSc1ccncc1 62a_100000038929_100000728582 [0,0,0,0,0,1|3,0,0]=4 5269 B14R1.422 CC(=O)SCCCSc1ccncc1 62a_100000728582_100000038929 [0,0,0,0,0,1|3,0,0]=4 5270 B14R1.422 CC(=S)OCCCNc1ccccc1 34a_100000106764_200135323944 [0,0,0,0,0,1|2,1,0]=4 5271 B14R1.422 CC(=S)OCCCOc1ccccc1 34a_100000210340_200135323944 [0,0,0,0,0,1|2,1,0]=4 5272 B14R1.422 CC(=S)OCCCOc1ccccc1 7a_100000210340_200135323944 [0,0,0,0,0,1|2,1,0]=4 5273 B14R1.422 CC(=S)OCCCSc1ccccc1 62a_100000719477_200135323944 [0,0,0,0,0,1|2,1,0]=4 5274 B14R1.422 CC(=S)OCCCSc1ccccc1 62a_200135323944_100000041952 [0,0,0,0,0,1|2,1,0]=4 5275 B14R1.422 CC(Br)CCOCCc1ccccc1 34a_100009893172_100000765856 [0,0,0,0,0,1|2,0,1]=4 5276 B14R1.422 CC(Br)COCCCc1ccccc1 34a_100012180447_100000211621 [0,0,0,0,0,1|2,0,1]=4 5277 B14R1.422 CC(C)CCCCNc1ccccc1 34a_100000106764_100011216152 [0,0,0,0,0,1|2,0,1]=4 5278 B14R1.422 CC(C)CCCCOc1ccccc1 34a_100000210340_100011216152 [0,0,0,0,0,1|2,0,1]=4 5279 B14R1.422 CC(C)CCCCOc1ccccc1 7a_100000210340_100011216152 [0,0,0,0,0,1|2,0,1]=4 5280 B14R1.422 CC(C)CCCCSc1ccccc1 62a_100000719477_100011216152 [0,0,0,0,0,1|2,0,1]=4 5281 B14R1.422 CC(C)CCCCSc1ccccc1 62a_100011216152_100000041952 [0,0,0,0,0,1|2,0,1]=4 5282 B14R1.422 CC(C)CCCNCc1ccccc1 207a_200000737386_100015611070 [0,0,0,0,0,1|2,0,1]=4 5283 B14R1.422 CC(C)CCCNCc1ccccc1 2230a_100015324214_100011214892 [0,0,0,0,0,1|2,0,1]=4 5284 B14R1.422 CC(C)CCCNCc1ccccc1 2230a_200000737386_100015291786 [0,0,0,0,0,1|2,0,1]=4 5285 B14R1.422 CC(C)CCCNCc1ccccc1 270004a_200000737386_100015611070 [0,0,0,0,0,1|2,0,1]=4 5286 B14R1.422 CC(C)CCCNCc1ccccc1 34a_100015324214_100011214892 [0,0,0,0,0,1|2,0,1]=4 5287 B14R1.422 CC(C)CCCNCc1ccccc1 34a_200000737386_100015291786 [0,0,0,0,0,1|2,0,1]=4 5288 B14R1.422 CC(C)CCCOCc1ccccc1 34a_100000210774_100015291786 [0,0,0,0,0,1|2,0,1]=4 5289 B14R1.422 CC(C)CCCOCc1ccccc1 34a_100000210790_100011214892 [0,0,0,0,0,1|2,0,1]=4 5290 B14R1.422 CC(C)CCCOCc1ccccc1 7a_100000210774_100000211182 [0,0,0,0,0,1|2,0,1]=4 5291 B14R1.422 CC(C)CCCOCc1ccccc1 7a_100000210790_100011214892 [0,0,0,0,0,1|2,0,1]=4 5292 B14R1.422 CC(C)CCCSCc1ccccc1 62a_100000211182_100011214892 [0,0,0,0,0,1|2,0,1]=4 5293 B14R1.422 CC(C)CCCSCc1ccccc1 62a_100011214892_100015291786 [0,0,0,0,0,1|2,0,1]=4 5294 B14R1.422 CC(C)CCNCCc1ccccc1 2230a_100000106460_100000210312 [0,0,0,0,0,1|2,0,1]=4 5295 B14R1.422 CC(C)CCNCCc1ccccc1 269862a_100000106460_100000185833 [0,0,0,0,0,1|2,0,1]=4 5296 B14R1.422 CC(C)CCNCCc1ccccc1 34a_100000106460_100000210312 [0,0,0,0,0,1|2,0,1]=4 5297 B14R1.422 CC(C)CCOCCc1ccccc1 34a_100000210254_100000765856 [0,0,0,0,0,1|2,0,1]=4 5298 B14R1.422 CC(C)CCOCCc1ccccc1 34a_100000210268_100000210312 [0,0,0,0,0,1|2,0,1]=4 5299 B14R1.422 CC(C)CCOCCc1ccccc1 7a_100000210254_100000765856 [0,0,0,0,0,1|2,0,1]=4 5300 B14R1.422 CC(C)CCOCCc1ccccc1 7a_100000210268_100000210626 [0,0,0,0,0,1|2,0,1]=4 5301 B14R1.422 CC(C)CCSCCc1ccccc1 62a_100000210312_100011218657 [0,0,0,0,0,1|2,0,1]=4 5302 B14R1.422 CC(C)CCSCCc1ccccc1 62a_100000765856_100000210312 [0,0,0,0,0,1|2,0,1]=4 5303 B14R1.422 CC(C)CNCCCc1ccccc1 2230a_100000210953_100000211621 [0,0,0,0,0,1|2,0,1]=4 5304 B14R1.422 CC(C)CNCCCc1ccccc1 2230a_100000211184_100000210760 [0,0,0,0,0,1|2,0,1]=4 5305 B14R1.422 CC(C)CNCCCc1ccccc1 270004a_100000211184_100000210432 [0,0,0,0,0,1|2,0,1]=4 5306 B14R1.422 CC(C)CNCCCc1ccccc1 34a_100000210953_100000211621 [0,0,0,0,0,1|2,0,1]=4 5307 B14R1.422 CC(C)CNCCCc1ccccc1 34a_100000211184_100000210624 [0,0,0,0,0,1|2,0,1]=4 5308 B14R1.422 CC(C)COCCCc1ccccc1 34a_100000210257_100000211621 [0,0,0,0,0,1|2,0,1]=4 5309 B14R1.422 CC(C)COCCCc1ccccc1 34a_100000210828_100000210624 [0,0,0,0,0,1|2,0,1]=4 5310 B14R1.422 CC(C)COCCCc1ccccc1 7a_100000210828_100000210760 [0,0,0,0,0,1|2,0,1]=4 5311 B14R1.422 CC(C)CSCCCc1ccccc1 62a_100000210624_100000211621 [0,0,0,0,0,1|2,0,1]=4 5312 B14R1.422 CC(C)CSCCCc1ccccc1 62a_100000211621_100000210760 [0,0,0,0,0,1|2,0,1]=4 5313 B14R1.422 CC(C)NCCCCc1ccccc1 2230a_100015280158_100000210206 [0,0,0,0,0,1|2,0,1]=4 5314 B14R1.422 CC(C)NCCCCc1ccccc1 2230a_100138425928_100000701786 [0,0,0,0,0,1|2,0,1]=4 5315 B14R1.422 CC(C)NCCCCc1ccccc1 34a_100015280158_100000210206 [0,0,0,0,0,1|2,0,1]=4 5316 B14R1.422 CC(C)NCCCCc1ccccc1 34a_100138425928_100000701786 [0,0,0,0,0,1|2,0,1]=4 5317 B14R1.422 CC(C)OCCCCc1ccccc1 34a_100000212225_100000701786 [0,0,0,0,0,1|2,0,1]=4 5318 B14R1.422 CC(C)OCCCCc1ccccc1 34a_100000703073_100000210206 [0,0,0,0,0,1|2,0,1]=4 5319 B14R1.422 CC(C)OCCCCc1ccccc1 7a_100000703073_100000210206 [0,0,0,0,0,1|2,0,1]=4 5320 B14R1.422 CC(C)SCCCCc1ccccc1 62a_100000210206_100000701786 [0,0,0,0,0,1|2,0,1]=4 5321 B14R1.422 CC(C)SCCCCc1ccccc1 62a_100000701786_100000210206 [0,0,0,0,0,1|2,0,1]=4 5322 B14R1.422 CC(F)COCCCc1ccccc1 34a_100015925927_100000211621 [0,0,0,0,0,1|2,0,1]=4 5323 B14R1.422 CC(O)CCCNCc1ccccc1 2230a_100015324214_200000718107 [0,0,0,0,0,1|1,0,1]=3 5324 B14R1.422 CC(O)CCCNCc1ccccc1 34a_100015324214_200000718107 [0,0,0,0,0,1|1,0,1]=3 5325 B14R1.422 CC(O)CCCOCc1ccccc1 34a_100000210790_200000718107 [0,0,0,0,0,1|1,0,1]=3 5326 B14R1.422 CC(O)CCCOCc1ccccc1 7a_100000210790_200000718107 [0,0,0,0,0,1|1,0,1]=3 5327 B14R1.422 CC(O)CCCSCc1ccccc1 62a_100000211182_200000718107 [0,0,0,0,0,1|1,0,1]=3 5328 B14R1.422 CC(O)CCCSCc1ccccc1 62a_200000718107_100015291786 [0,0,0,0,0,1|1,0,1]=3 5329 B14R1.422 CC(O)CCCSCc1ccccn1 62a_100000721315_200000718107 [0,0,0,0,0,1|2,0,1]=4 5330 B14R1.422 CC(O)CCCSCc1ccccn1 62a_200000718107_100000721315 [0,0,0,0,0,1|2,0,1]=4 5331 B14R1.422 CC(O)CCCSCc1cccnc1 62a_100000741622_200000718107 [0,0,0,0,0,1|2,0,1]=4 5332 B14R1.422 CC(O)CCCSCc1cccnc1 62a_200000718107_100000741622 [0,0,0,0,0,1|2,0,1]=4 5333 B14R1.422 CC(O)CCCSCc1ccncc1 62a_100015193705_200000718107 [0,0,0,0,0,1|2,0,1]=4 5334 B14R1.422 CC(O)CCCSCc1ccncc1 62a_200000718107_100015193705 [0,0,0,0,0,1|2,0,1]=4 5335 B14R1.422 CC(O)CCNCCc1ccccc1 2230a_100000106460_100012276601 [0,0,0,0,0,1|1,0,1]=3 5336 B14R1.422 CC(O)CCNCCc1ccccc1 2230a_200000755665_100000765856 [0,0,0,0,0,1|1,0,1]=3 5337 B14R1.422 CC(O)CCNCCc1ccccc1 34a_100000106460_100012276601 [0,0,0,0,0,1|1,0,1]=3 5338 B14R1.422 CC(O)CCNCCc1ccccn1 2230a_200000755665_100015183660 [0,0,0,0,0,1|2,0,1]=4 5339 B14R1.422 CC(O)CCNCCc1cccnc1 2230a_100000736294_100012276601 [0,0,0,0,0,1|2,0,1]=4 5340 B14R1.422 CC(O)CCNCCc1cccnc1 2230a_200000755665_200011713674 [0,0,0,0,0,1|2,0,1]=4 5341 B14R1.422 CC(O)CCNCCc1ccncc1 2230a_200000755665_100000723409 [0,0,0,0,0,1|2,0,1]=4 5342 B14R1.422 CC(O)CCNCSc1ccccc1 2230a_200000755665_100011218342 [0,0,0,0,0,1|2,0,1]=4 5343 B14R1.422 CC(O)CCOCCc1ccccc1 34a_100000210268_100012276601 [0,0,0,0,0,1|1,0,1]=3 5344 B14R1.422 CC(O)CCOCCc1ccccc1 7a_100000210268_100012276601 [0,0,0,0,0,1|1,0,1]=3 5345 B14R1.422 CC(O)CCOCCc1ccccn1 34a_100000210271_100012276601 [0,0,0,0,0,1|2,0,1]=4 5346 B14R1.422 CC(O)CCOCCc1cccnc1 34a_100011217484_100012276601 [0,0,0,0,0,1|2,0,1]=4 5347 B14R1.422 CC(O)CCOCCc1ccncc1 34a_100011216225_100012276601 [0,0,0,0,0,1|2,0,1]=4 5348 B14R1.422 CC(O)CCSCCc1ccccc1 62a_100000765856_100012276601 [0,0,0,0,0,1|1,0,1]=3 5349 B14R1.422 CC(O)CCSCCc1ccccc1 62a_100012276601_100011218657 [0,0,0,0,0,1|1,0,1]=3 5350 B14R1.422 CC(O)CCSCCc1ccccn1 62a_100012276601_100015183660 [0,0,0,0,0,1|2,0,1]=4 5351 B14R1.422 CC(O)CCSCCc1ccccn1 62a_100015183660_100012276601 [0,0,0,0,0,1|2,0,1]=4 5352 B14R1.422 CC(O)CCSCCc1cccnc1 62a_100012276601_200011713674 [0,0,0,0,0,1|2,0,1]=4 5353 B14R1.422 CC(O)CCSCCc1cccnc1 62a_200011713674_100012276601 [0,0,0,0,0,1|2,0,1]=4 5354 B14R1.422 CC(O)CCSCCc1ccncc1 62a_100000723409_100012276601 [0,0,0,0,0,1|2,0,1]=4 5355 B14R1.422 CC(O)CCSCCc1ccncc1 62a_100012276601_100000723409 [0,0,0,0,0,1|2,0,1]=4 5356 B14R1.422 CC(O)CCSCSc1ccccc1 62a_100011218342_100012276601 [0,0,0,0,0,1|2,0,1]=4 5357 B14R1.422 CC(O)CCSCSc1ccccc1 62a_100012276601_100011218342 [0,0,0,0,0,1|2,0,1]=4 5358 B14R1.422 CC(O)CNCCCc1ccccc1 2230a_100000210904_100000211621 [0,0,0,0,0,1|1,0,1]=3 5359 B14R1.422 CC(O)CNCCCc1ccccc1 2230a_100000211184_100011218427 [0,0,0,0,0,1|1,0,1]=3 5360 B14R1.422 CC(O)CNCCCc1ccccc1 34a_100000210904_100000211621 [0,0,0,0,0,1|1,0,1]=3 5361 B14R1.422 CC(O)CNCCCc1ccccc1 34a_100000211184_100011218427 [0,0,0,0,0,1|1,0,1]=3 5362 B14R1.422 CC(O)CNCCCc1cccnc1 2230a_100011532358_100011218427 [0,0,0,0,0,1|2,0,1]=4 5363 B14R1.422 CC(O)CNCCCc1cccnc1 34a_100011532358_100011218427 [0,0,0,0,0,1|2,0,1]=4 5364 B14R1.422 CC(O)CNCCCc1ccncc1 2230a_100011275580_100011218427 [0,0,0,0,0,1|2,0,1]=4 5365 B14R1.422 CC(O)CNCCOc1ccccc1 2230a_100000174943_100011218427 [0,0,0,0,0,1|2,0,1]=4 5366 B14R1.422 CC(O)CNCCOc1ccccc1 2230a_100000210904_100000184471 [0,0,0,0,0,1|2,0,1]=4 5367 B14R1.422 CC(O)CNCCOc1ccccc1 270004a_100000210904_100000758736 [0,0,0,0,0,1|2,0,1]=4 5368 B14R1.422 CC(O)CNCCOc1ccccc1 34a_100000174943_100011218427 [0,0,0,0,0,1|2,0,1]=4 5369 B14R1.422 CC(O)CNCCOc1ccccc1 34a_100000210904_100000184471 [0,0,0,0,0,1|2,0,1]=4 5370 B14R1.422 CC(O)CNCCSc1ccccc1 2230a_100000189519_100011218427 [0,0,0,0,0,1|2,0,1]=4 5371 B14R1.422 CC(O)CNCCSc1ccccc1 2230a_100000210904_100000246102 [0,0,0,0,0,1|2,0,1]=4 5372 B14R1.422 CC(O)CNCCSc1ccccc1 34a_100000210904_100000246102 [0,0,0,0,0,1|2,0,1]=4 5373 B14R1.422 CC(O)CNCOCc1ccccc1 2230a_100000210904_100000763385 [0,0,0,0,0,1|2,0,1]=4 5374 B14R1.422 CC(O)CNCOCc1ccccc1 34a_100000210904_100000763385 [0,0,0,0,0,1|2,0,1]=4 5375 B14R1.422 CC(O)CNCSCc1ccccc1 2230a_100000210904_200011217039 [0,0,0,0,0,1|2,0,1]=4 5376 B14R1.422 CC(O)CNCSCc1ccccc1 34a_100000210904_200011217039 [0,0,0,0,0,1|2,0,1]=4 5377 B14R1.422 CC(O)COCCCc1ccccc1 34a_100000210828_100011218427 [0,0,0,0,0,1|1,0,1]=3 5378 B14R1.422 CC(O)COCCCc1ccccc1 7a_100000210828_100011218427 [0,0,0,0,0,1|1,0,1]=3 5379 B14R1.422 CC(O)COCCCc1ccccn1 34a_100011215068_100011218427 [0,0,0,0,0,1|2,0,1]=4 5380 B14R1.422 CC(O)COCCCc1cccnc1 34a_100000211284_100011218427 [0,0,0,0,0,1|2,0,1]=4 5381 B14R1.422 CC(O)COCCCc1ccncc1 34a_100000210659_100011218427 [0,0,0,0,0,1|2,0,1]=4 5382 B14R1.422 CC(O)COCCNc1ccccc1 34a_100000211345_100011218427 [0,0,0,0,0,1|2,0,1]=4 5383 B14R1.422 CC(O)COCCOc1ccccc1 34a_100000210260_100011218427 [0,0,0,0,0,1|2,0,1]=4 5384 B14R1.422 CC(O)COCCOc1ccccc1 7a_100000210260_100011218427 [0,0,0,0,0,1|2,0,1]=4 5385 B14R1.422 CC(O)COCCSc1ccccc1 7a_100000230494_100011218427 [0,0,0,0,0,1|2,0,1]=4 5386 B14R1.422 CC(O)CSCCCc1ccccc1 62a_100000211621_100011218427 [0,0,0,0,0,1|1,0,1]=3 5387 B14R1.422 CC(O)CSCCCc1ccccc1 62a_100011218427_100000211621 [0,0,0,0,0,1|1,0,1]=3 5388 B14R1.422 CC(O)CSCCOc1ccccc1 62a_100000184471_100011218427 [0,0,0,0,0,1|2,0,1]=4 5389 B14R1.422 CC(O)CSCCOc1ccccc1 62a_100011218427_100000184471 [0,0,0,0,0,1|2,0,1]=4 5390 B14R1.422 CC(O)CSCCSc1ccccc1 62a_100000246102_100011218427 [0,0,0,0,0,1|2,0,1]=4 5391 B14R1.422 CC(O)CSCCSc1ccccc1 62a_100011218427_100000246102 [0,0,0,0,0,1|2,0,1]=4 5392 B14R1.422 CC(O)CSCOCc1ccccc1 62a_100000763385_100011218427 [0,0,0,0,0,1|2,0,1]=4 5393 B14R1.422 CC(O)CSCOCc1ccccc1 62a_100011218427_100000763385 [0,0,0,0,0,1|2,0,1]=4 5394 B14R1.422 CC(O)CSCSCc1ccccc1 62a_100011218427_200011217039 [0,0,0,0,0,1|2,0,1]=4 5395 B14R1.422 CC(O)CSCSCc1ccccc1 62a_200011217039_100011218427 [0,0,0,0,0,1|2,0,1]=4 5396 B14R1.422 CN(C)CCCCCc1ccccc1 2230a_100102631434_200011217138 [0,0,0,0,0,1|3,0,0]=4 5397 B14R1.422 CN(C)CCCCCc1ccccc1 269982a_100102631434_200011217138 [0,0,0,0,0,1|3,0,0]=4 5398 B14R1.422 CN(C)CCCCOc1ccccc1 2230a_100102631434_100011215240 [0,0,0,0,0,1|3,0,0]=4 5399 B14R1.422 CN(C)CCCCOc1ccccc1 269982a_100102631434_100011215240 [0,0,0,0,0,1|3,0,0]=4 5400 B14R1.422 CN(C)CCCCSc1ccccc1 62a_100000719477_100000690147 [0,0,0,0,0,1|3,0,0]=4 5401 B14R1.422 CN(C)CCCNCc1ccccc1 207a_102531767803_100015611070 [0,0,0,0,0,1|3,0,0]=4 5402 B14R1.422 CN(C)CCCNCc1ccccc1 270004a_102531767803_100015611070 [0,0,0,0,0,1|3,0,0]=4 5403 B14R1.422 CN(C)CCCOCc1ccccc1 2230a_100000233174_200000210301 [0,0,0,0,0,1|3,0,0]=4 5404 B14R1.422 CN(C)CCCOCc1ccccc1 2230a_100102631434_100011215529 [0,0,0,0,0,1|3,0,0]=4 5405 B14R1.422 CN(C)CCCOCc1ccccc1 269982a_100000233174_200000210301 [0,0,0,0,0,1|3,0,0]=4 5406 B14R1.422 CN(C)CCCOCc1ccccc1 269982a_100102631434_100011215529 [0,0,0,0,0,1|3,0,0]=4 5407 B14R1.422 CN(C)CCCOCc1ccccc1 7a_100000210790_100000757444 [0,0,0,0,0,1|3,0,0]=4 5408 B14R1.422 CN(C)CCCSCc1ccccc1 62a_100000211182_100000757444 [0,0,0,0,0,1|3,0,0]=4 5409 B14R1.422 CN(C)CCOCCc1ccccc1 7a_100000210268_100000755713 [0,0,0,0,0,1|3,0,0]=4 5410 B14R1.422 CN(C)CCSCCc1ccccc1 62a_100000765856_100000755713 [0,0,0,0,0,1|3,0,0]=4 5411 B14R1.422 CN([13CH3])CCCOCc1ccccc1 2230a_100000233174_200025704644 [0,0,0,0,0,1|3,0,0]=4 5412 B14R1.422 CN([13CH3])CCCOCc1ccccc1 269982a_100000233174_200025704644 [0,0,0,0,0,1|3,0,0]=4 5413 B14R1.422 CS(=O)CCCNCc1ccccc1 207a_200000753449_100015611070 [0,0,0,0,0,1|2,0,0]=3 5414 B14R1.422 CS(=O)CCCNCc1ccccc1 2230a_200000753449_100015291786 [0,0,0,0,0,1|2,0,0]=3 5415 B14R1.422 CS(=O)CCCNCc1ccccc1 270004a_200000753449_100015611070 [0,0,0,0,0,1|2,0,0]=3 5416 B14R1.422 CS(=O)CCCNCc1ccccn1 207a_200000753449_100000209966 [0,0,0,0,0,1|3,0,0]=4 5417 B14R1.422 CS(=O)CCCNCc1ccccn1 2230a_200000753449_100000721315 [0,0,0,0,0,1|3,0,0]=4 5418 B14R1.422 CS(=O)CCCNCc1ccccn1 270004a_200000753449_100000209966 [0,0,0,0,0,1|3,0,0]=4 5419 B14R1.422 CS(=O)CCCNCc1cccnc1 207a_200000753449_100000209961 [0,0,0,0,0,1|3,0,0]=4 5420 B14R1.422 CS(=O)CCCNCc1cccnc1 2230a_200000753449_100000741622 [0,0,0,0,0,1|3,0,0]=4 5421 B14R1.422 CS(=O)CCCNCc1cccnc1 270004a_200000753449_100000209961 [0,0,0,0,0,1|3,0,0]=4 5422 B14R1.422 CS(=O)CCCNCc1ccncc1 207a_200000753449_100000186114 [0,0,0,0,0,1|3,0,0]=4 5423 B14R1.422 CS(=O)CCCNCc1ccncc1 2230a_200000753449_100015193705 [0,0,0,0,0,1|3,0,0]=4 5424 B14R1.422 C[C@@H](Cl)COCCCc1ccccc1 34a_100016084084_100000211621 [0,0,0,0,0,1|2,0,1]=4 5425 B14R1.422 C[C@@H](N)CCOCCc1ccccc1 34a_100000706166_100000765856 [0,0,0,0,0,1|2,0,1]=4 5426 B14R1.422 C[C@@H](N)COCCCc1ccccc1 34a_100000737577_100000211621 [0,0,0,0,0,1|2,0,1]=4 5427 B14R1.422 C[C@@H](O)CNCCCc1ccccc1 2230a_100000211184_100009817552 [0,0,0,0,0,1|1,0,1]=3 5428 B14R1.422 C[C@@H](O)CNCCCc1ccccc1 34a_100000211184_100009817552 [0,0,0,0,0,1|1,0,1]=3 5429 B14R1.422 C[C@@H](O)CNCCCc1cccnc1 2230a_100011532358_100009817552 [0,0,0,0,0,1|2,0,1]=4 5430 B14R1.422 C[C@@H](O)CNCCCc1cccnc1 34a_100011532358_100009817552 [0,0,0,0,0,1|2,0,1]=4 5431 B14R1.422 C[C@@H](O)CNCCCc1ccncc1 2230a_100011275580_100009817552 [0,0,0,0,0,1|2,0,1]=4 5432 B14R1.422 C[C@@H](O)CNCCOc1ccccc1 2230a_100000174943_100009817552 [0,0,0,0,0,1|2,0,1]=4 5433 B14R1.422 C[C@@H](O)CNCCOc1ccccc1 34a_100000174943_100009817552 [0,0,0,0,0,1|2,0,1]=4 5434 B14R1.422 C[C@@H](O)CNCCSc1ccccc1 2230a_100000189519_100009817552 [0,0,0,0,0,1|2,0,1]=4 5435 B14R1.422 C[C@@H](O)COCCCc1ccccc1 34a_100000210828_100009817552 [0,0,0,0,0,1|1,0,1]=3 5436 B14R1.422 C[C@@H](O)COCCCc1ccccc1 7a_100000210828_100009817552 [0,0,0,0,0,1|1,0,1]=3 5437 B14R1.422 C[C@@H](O)COCCCc1ccccn1 34a_100011215068_100009817552 [0,0,0,0,0,1|2,0,1]=4 5438 B14R1.422 C[C@@H](O)COCCCc1cccnc1 34a_100000211284_100009817552 [0,0,0,0,0,1|2,0,1]=4 5439 B14R1.422 C[C@@H](O)COCCCc1ccncc1 34a_100000210659_100009817552 [0,0,0,0,0,1|2,0,1]=4 5440 B14R1.422 C[C@@H](O)COCCNc1ccccc1 34a_100000211345_100009817552 [0,0,0,0,0,1|2,0,1]=4 5441 B14R1.422 C[C@@H](O)COCCOc1ccccc1 34a_100000210260_100009817552 [0,0,0,0,0,1|2,0,1]=4 5442 B14R1.422 C[C@@H](O)COCCOc1ccccc1 7a_100000210260_100009817552 [0,0,0,0,0,1|2,0,1]=4 5443 B14R1.422 C[C@@H](O)COCCSc1ccccc1 7a_100000230494_100009817552 [0,0,0,0,0,1|2,0,1]=4 5444 B14R1.422 C[C@@H](O)CSCCCc1ccccc1 62a_100000211621_100009817552 [0,0,0,0,0,1|1,0,1]=3 5445 B14R1.422 C[C@@H](O)CSCCCc1ccccc1 62a_100009817552_100000211621 [0,0,0,0,0,1|1,0,1]=3 5446 B14R1.422 C[C@@H](O)CSCCOc1ccccc1 62a_100000184471_100009817552 [0,0,0,0,0,1|2,0,1]=4 5447 B14R1.422 C[C@@H](O)CSCCOc1ccccc1 62a_100009817552_100000184471 [0,0,0,0,0,1|2,0,1]=4 5448 B14R1.422 C[C@@H](O)CSCCSc1ccccc1 62a_100000246102_100009817552 [0,0,0,0,0,1|2,0,1]=4 5449 B14R1.422 C[C@@H](O)CSCCSc1ccccc1 62a_100009817552_100000246102 [0,0,0,0,0,1|2,0,1]=4 5450 B14R1.422 C[C@@H](O)CSCOCc1ccccc1 62a_100000763385_100009817552 [0,0,0,0,0,1|2,0,1]=4 5451 B14R1.422 C[C@@H](O)CSCOCc1ccccc1 62a_100009817552_100000763385 [0,0,0,0,0,1|2,0,1]=4 5452 B14R1.422 C[C@@H](O)CSCSCc1ccccc1 62a_100009817552_200011217039 [0,0,0,0,0,1|2,0,1]=4 5453 B14R1.422 C[C@@H](O)CSCSCc1ccccc1 62a_200011217039_100009817552 [0,0,0,0,0,1|2,0,1]=4 5454 B14R1.422 FC(=CCCNCc1ccccc1)F 2230a_100015324214_200009816681 [0,0,0,0,0,1|2,0,1]=4 5455 B14R1.422 FC(=CCCNCc1ccccc1)F 34a_100015324214_200009816681 [0,0,0,0,0,1|2,0,1]=4 5456 B14R1.422 FC(=CCCOCc1ccccc1)F 34a_100000210790_200009816681 [0,0,0,0,0,1|2,0,1]=4 5457 B14R1.422 FC(=CCCOCc1ccccc1)F 7a_100000210790_200009816681 [0,0,0,0,0,1|2,0,1]=4 5458 B14R1.422 FC(=CCCSCc1ccccc1)F 62a_100000211182_200009816681 [0,0,0,0,0,1|2,0,1]=4 5459 B14R1.422 FC(=CCCSCc1ccccc1)F 62a_200009816681_100015291786 [0,0,0,0,0,1|2,0,1]=4 5460 B14R1.422 FC(F)CCOCCc1ccccc1 34a_100103093639_100000765856 [0,0,0,0,0,1|2,0,1]=4 5461 B14R1.422 FC(F)CNCCCc1ccccc1 2230a_100000211184_100011934356 [0,0,0,0,0,1|2,0,1]=4 5462 B14R1.422 FC(F)CNCCCc1ccccc1 34a_100000211184_100011934356 [0,0,0,0,0,1|2,0,1]=4 5463 B14R1.422 FC(F)CNCCCc1ccccc1 34a_100000765723_100000211621 [0,0,0,0,0,1|2,0,1]=4 5464 B14R1.422 FC(F)COCCCc1ccccc1 34a_100000210828_100011934356 [0,0,0,0,0,1|2,0,1]=4 5465 B14R1.422 FC(F)COCCCc1ccccc1 34a_100000743014_100000211621 [0,0,0,0,0,1|2,0,1]=4 5466 B14R1.422 FC(F)COCCCc1ccccc1 7a_100000210828_100011934356 [0,0,0,0,0,1|2,0,1]=4 5467 B14R1.422 FC(F)CSCCCc1ccccc1 62a_100000211621_100011934356 [0,0,0,0,0,1|2,0,1]=4 5468 B14R1.422 FC(F)CSCCCc1ccccc1 62a_100011934356_100000211621 [0,0,0,0,0,1|2,0,1]=4 5469 B14R1.422 NC(=O)CCCNCc1ccccc1 34a_100000739312_100015291786 [0,0,0,0,0,1|1,0,0]=2 5470 B14R1.422 NC(=O)CCCNCc1ccccc1 34a_100015324214_100102525003 [0,0,0,0,0,1|1,0,0]=2 5471 B14R1.422 NC(=O)CCCNCc1ccccn1 34a_100000739312_100000721315 [0,0,0,0,0,1|2,0,0]=3 5472 B14R1.422 NC(=O)CCCNCc1cccnc1 34a_100000739312_100000733263 [0,0,0,0,0,1|2,0,0]=3 5473 B14R1.422 NC(=O)CCCNCc1cccnn1 34a_100000739312_100016990269 [0,0,0,0,0,1|3,0,0]=4 5474 B14R1.422 NC(=O)CCCNCc1cnccn1 34a_100000739312_100016995436 [0,0,0,0,0,1|3,0,0]=4 5475 B14R1.422 NC(=O)CCCNCc1cncnc1 34a_100000739312_100015196519 [0,0,0,0,0,1|3,0,0]=4 5476 B14R1.422 NC(=O)CCCNCc1ncccn1 34a_100000739312_100000703007 [0,0,0,0,0,1|3,0,0]=4 5477 B14R1.422 NC(=O)CCCOCc1ccccc1 34a_100000210790_100102525003 [0,0,0,0,0,1|1,0,0]=2 5478 B14R1.422 NC(=O)CCCOCc1ccccc1 7a_100000210790_100102525003 [0,0,0,0,0,1|1,0,0]=2 5479 B14R1.422 NC(=O)CCCSCc1ccccc1 62a_100000211182_100102525003 [0,0,0,0,0,1|1,0,0]=2 5480 B14R1.422 NC(=O)CCCSCc1ccccc1 62a_100102525003_100015291786 [0,0,0,0,0,1|1,0,0]=2 5481 B14R1.422 NC(=O)CCCSCc1ccccn1 62a_100000721315_100102525003 [0,0,0,0,0,1|2,0,0]=3 5482 B14R1.422 NC(=O)CCCSCc1ccccn1 62a_100102525003_100000721315 [0,0,0,0,0,1|2,0,0]=3 5483 B14R1.422 NC(=O)CCCSCc1cccnc1 62a_100000741622_100102525003 [0,0,0,0,0,1|2,0,0]=3 5484 B14R1.422 NC(=O)CCCSCc1cccnc1 62a_100102525003_100000741622 [0,0,0,0,0,1|2,0,0]=3 5485 B14R1.422 NC(=O)CCCSCc1cccnn1 62a_100016990269_100102525003 [0,0,0,0,0,1|3,0,0]=4 5486 B14R1.422 NC(=O)CCCSCc1cccnn1 62a_100102525003_100016990269 [0,0,0,0,0,1|3,0,0]=4 5487 B14R1.422 NC(=O)CCCSCc1ccncc1 62a_100015193705_100102525003 [0,0,0,0,0,1|2,0,0]=3 5488 B14R1.422 NC(=O)CCCSCc1ccncc1 62a_100102525003_100015193705 [0,0,0,0,0,1|2,0,0]=3 5489 B14R1.422 NC(=O)CCCSCc1cnccn1 62a_100016995436_100102525003 [0,0,0,0,0,1|3,0,0]=4 5490 B14R1.422 NC(=O)CCCSCc1cnccn1 62a_100102525003_100016995436 [0,0,0,0,0,1|3,0,0]=4 5491 B14R1.422 NC(=O)CCCSCc1cncnc1 62a_100015196519_100102525003 [0,0,0,0,0,1|3,0,0]=4 5492 B14R1.422 NC(=O)CCCSCc1cncnc1 62a_100102525003_100015196519 [0,0,0,0,0,1|3,0,0]=4 5493 B14R1.422 NC(=O)CCCSCc1ncccn1 62a_100000703007_100102525003 [0,0,0,0,0,1|3,0,0]=4 5494 B14R1.422 NC(=O)CCCSCc1ncccn1 62a_100102525003_100000703007 [0,0,0,0,0,1|3,0,0]=4 5495 B14R1.422 NC(=O)CCNCCc1ccccc1 2230a_100000106460_100000744528 [0,0,0,0,0,1|1,0,0]=2 5496 B14R1.422 NC(=O)CCNCCc1ccccc1 34a_100000106460_100000731001 [0,0,0,0,0,1|1,0,0]=2 5497 B14R1.422 NC(=O)CCNCCc1cccnc1 2230a_100000736294_100000744528 [0,0,0,0,0,1|2,0,0]=3 5498 B14R1.422 NC(=O)CCOCCc1ccccc1 34a_100000210268_100000731001 [0,0,0,0,0,1|1,0,0]=2 5499 B14R1.422 NC(=O)CCOCCc1ccccc1 34a_100000757172_100000765856 [0,0,0,0,0,1|1,0,0]=2 5500 B14R1.422 NC(=O)CCOCCc1ccccc1 7a_100000210268_100000744528 [0,0,0,0,0,1|1,0,0]=2 5501 B14R1.422 NC(=O)CCOCCc1ccccc1 7a_100000757172_100000765856 [0,0,0,0,0,1|1,0,0]=2 5502 B14R1.422 NC(=O)CCOCCc1ccccn1 34a_100000210271_100000731001 [0,0,0,0,0,1|2,0,0]=3 5503 B14R1.422 NC(=O)CCOCCc1ccccn1 7a_100000757172_100015183660 [0,0,0,0,0,1|2,0,0]=3 5504 B14R1.422 NC(=O)CCOCCc1cccnc1 34a_100011217484_100000731001 [0,0,0,0,0,1|2,0,0]=3 5505 B14R1.422 NC(=O)CCOCCc1cccnc1 7a_100000757172_200011713674 [0,0,0,0,0,1|2,0,0]=3 5506 B14R1.422 NC(=O)CCOCCc1ccncc1 34a_100011216225_100000731001 [0,0,0,0,0,1|2,0,0]=3 5507 B14R1.422 NC(=O)CCOCCc1ccncc1 7a_100000757172_100000723409 [0,0,0,0,0,1|2,0,0]=3 5508 B14R1.422 NC(=O)CCOCCc1cnccn1 34a_100011349526_100000731001 [0,0,0,0,0,1|3,0,0]=4 5509 B14R1.422 NC(=O)CCOCCc1cncnc1 34a_100011709255_100000731001 [0,0,0,0,0,1|3,0,0]=4 5510 B14R1.422 NC(=O)CCSCCc1ccccc1 62a_100000744528_100011218657 [0,0,0,0,0,1|1,0,0]=2 5511 B14R1.422 NC(=O)CCSCCc1ccccc1 62a_100000765856_100000744528 [0,0,0,0,0,1|1,0,0]=2 5512 B14R1.422 NC(=O)CCSCCc1ccccn1 62a_100000744528_100015183660 [0,0,0,0,0,1|2,0,0]=3 5513 B14R1.422 NC(=O)CCSCCc1ccccn1 62a_100015183660_100000744528 [0,0,0,0,0,1|2,0,0]=3 5514 B14R1.422 NC(=O)CCSCCc1cccnc1 62a_100000744528_200011713674 [0,0,0,0,0,1|2,0,0]=3 5515 B14R1.422 NC(=O)CCSCCc1cccnc1 62a_200011713674_100000744528 [0,0,0,0,0,1|2,0,0]=3 5516 B14R1.422 NC(=O)CCSCCc1ccncc1 62a_100000723409_100000744528 [0,0,0,0,0,1|2,0,0]=3 5517 B14R1.422 NC(=O)CCSCCc1ccncc1 62a_100000744528_100000723409 [0,0,0,0,0,1|2,0,0]=3 5518 B14R1.422 NC(=O)CCSCSc1ccccc1 62a_100000744528_100011218342 [0,0,0,0,0,1|2,0,0]=3 5519 B14R1.422 NC(=O)CCSCSc1ccccc1 62a_100011218342_100000744528 [0,0,0,0,0,1|2,0,0]=3 5520 B14R1.422 NC(=O)CNC/C=C/c1ccccc1 2230a_100000711301_100016265936 [0,0,0,0,0,1|1,0,2]=4 5521 B14R1.422 NC(=O)CNC/C=C/c1ccccc1 2230a_100020603302_100000747473 [0,0,0,0,0,1|1,0,2]=4 5522 B14R1.422 NC(=O)CNC/C=C/c1ccccc1 34a_100020603302_100000187820 [0,0,0,0,0,1|1,0,2]=4 5523 B14R1.422 NC(=O)CNCC#Cc1ccccc1 2230a_100000711301_100011352542 [0,0,0,0,0,1|1,0,2]=4 5524 B14R1.422 NC(=O)CNCC#Cc1ccccc1 34a_100000735379_100000187820 [0,0,0,0,0,1|1,0,2]=4 5525 B14R1.422 NC(=O)CNCCCc1ccccc1 2230a_100000211184_100000747473 [0,0,0,0,0,1|1,0,0]=2 5526 B14R1.422 NC(=O)CNCCCc1ccccc1 2230a_100000711301_100000211621 [0,0,0,0,0,1|1,0,0]=2 5527 B14R1.422 NC(=O)CNCCCc1ccccc1 34a_100000211184_100000187820 [0,0,0,0,0,1|1,0,0]=2 5528 B14R1.422 NC(=O)CNCCCc1cccnc1 2230a_100011532358_100000747473 [0,0,0,0,0,1|2,0,0]=3 5529 B14R1.422 NC(=O)CNCCCc1cccnc1 34a_100011532358_100000187820 [0,0,0,0,0,1|2,0,0]=3 5530 B14R1.422 NC(=O)CNCCCc1ccncc1 2230a_100011275580_100000747473 [0,0,0,0,0,1|2,0,0]=3 5531 B14R1.422 NC(=O)CNCCOc1ccccc1 2230a_100000174943_100000747473 [0,0,0,0,0,1|2,0,0]=3 5532 B14R1.422 NC(=O)CNCCOc1ccccc1 2230a_100000711301_100000184471 [0,0,0,0,0,1|2,0,0]=3 5533 B14R1.422 NC(=O)CNCCOc1ccccc1 34a_100000174943_100000187820 [0,0,0,0,0,1|2,0,0]=3 5534 B14R1.422 NC(=O)CNCCOc1ccccn1 2230a_106741647558_100000747473 [0,0,0,0,0,1|3,0,0]=4 5535 B14R1.422 NC(=O)CNCCOc1cccnc1 2230a_100000754688_100000747473 [0,0,0,0,0,1|3,0,0]=4 5536 B14R1.422 NC(=O)CNCCSc1ccccc1 2230a_100000189519_100000747473 [0,0,0,0,0,1|2,0,0]=3 5537 B14R1.422 NC(=O)CNCCSc1ccccc1 2230a_100000711301_100000246102 [0,0,0,0,0,1|2,0,0]=3 5538 B14R1.422 NC(=O)CNCOCc1ccccc1 2230a_100000711301_100000763385 [0,0,0,0,0,1|2,0,0]=3 5539 B14R1.422 NC(=O)CNCSCc1ccccc1 2230a_100000711301_200011217039 [0,0,0,0,0,1|2,0,0]=3 5540 B14R1.422 NC(=O)COC/C=C/c1ccccc1 34a_100000210256_100000187820 [0,0,0,0,0,1|1,0,2]=4 5541 B14R1.422 NC(=O)COCC#Cc1ccccc1 34a_100011217464_100000187820 [0,0,0,0,0,1|1,0,2]=4 5542 B14R1.422 NC(=O)COCC#Cc1ccccc1 7a_100011217464_100000187820 [0,0,0,0,0,1|1,0,2]=4 5543 B14R1.422 NC(=O)COCCCC1=CCC=CC1 34a_100020667889_100000187820 [0,0,0,0,0,1|1,0,2]=4 5544 B14R1.422 NC(=O)COCCCc1ccccc1 34a_100000210828_100000187820 [0,0,0,0,0,1|1,0,0]=2 5545 B14R1.422 NC(=O)COCCCc1ccccc1 7a_100000210828_100000187820 [0,0,0,0,0,1|1,0,0]=2 5546 B14R1.422 NC(=O)COCCCc1ccccn1 34a_100011215068_100000187820 [0,0,0,0,0,1|2,0,0]=3 5547 B14R1.422 NC(=O)COCCCc1cccnc1 34a_100000211284_100000187820 [0,0,0,0,0,1|2,0,0]=3 5548 B14R1.422 NC(=O)COCCCc1ccncc1 34a_100000210659_100000187820 [0,0,0,0,0,1|2,0,0]=3 5549 B14R1.422 NC(=O)COCCNc1ccccc1 34a_100000106764_100000076697 [0,0,0,0,0,1|2,0,0]=3 5550 B14R1.422 NC(=O)COCCNc1ccccc1 34a_100000211345_100000187820 [0,0,0,0,0,1|2,0,0]=3 5551 B14R1.422 NC(=O)COCCNc1ccncc1 34a_200011243140_100000187820 [0,0,0,0,0,1|3,0,0]=4 5552 B14R1.422 NC(=O)COCCOc1ccccc1 34a_100000210260_100000187820 [0,0,0,0,0,1|2,0,0]=3 5553 B14R1.422 NC(=O)COCCOc1ccccc1 34a_100000210340_100000076697 [0,0,0,0,0,1|2,0,0]=3 5554 B14R1.422 NC(=O)COCCOc1ccccc1 7a_100000210260_100000187820 [0,0,0,0,0,1|2,0,0]=3 5555 B14R1.422 NC(=O)COCCOc1ccccc1 7a_100000210340_100000076697 [0,0,0,0,0,1|2,0,0]=3 5556 B14R1.422 NC(=O)COCCOc1cccnc1 34a_100000210849_100000076697 [0,0,0,0,0,1|3,0,0]=4 5557 B14R1.422 NC(=O)COCCOc1cccnc1 7a_100000210849_100000076697 [0,0,0,0,0,1|3,0,0]=4 5558 B14R1.422 NC(=O)COCCOc1ccncc1 34a_100000212176_100000076697 [0,0,0,0,0,1|3,0,0]=4 5559 B14R1.422 NC(=O)COCCSc1ccccc1 62a_100000076697_100000041952 [0,0,0,0,0,1|2,0,0]=3 5560 B14R1.422 NC(=O)COCCSc1ccccc1 62a_100000719477_100000076697 [0,0,0,0,0,1|2,0,0]=3 5561 B14R1.422 NC(=O)COCCSc1ccccc1 7a_100000230494_100000187820 [0,0,0,0,0,1|2,0,0]=3 5562 B14R1.422 NC(=O)COCCSc1ccccn1 62a_100000076697_100011216584 [0,0,0,0,0,1|3,0,0]=4 5563 B14R1.422 NC(=O)COCCSc1ccccn1 62a_100011216584_100000076697 [0,0,0,0,0,1|3,0,0]=4 5564 B14R1.422 NC(=O)COCCSc1ccccn1 7a_100000156319_100000187820 [0,0,0,0,0,1|3,0,0]=4 5565 B14R1.422 NC(=O)COCCSc1cccnc1 62a_100000076697_100000210063 [0,0,0,0,0,1|3,0,0]=4 5566 B14R1.422 NC(=O)COCCSc1cccnc1 62a_100000210063_100000076697 [0,0,0,0,0,1|3,0,0]=4 5567 B14R1.422 NC(=O)COCCSc1ccncc1 62a_100000076697_100000728582 [0,0,0,0,0,1|3,0,0]=4 5568 B14R1.422 NC(=O)COCCSc1ccncc1 62a_100000728582_100000076697 [0,0,0,0,0,1|3,0,0]=4 5569 B14R1.422 NC(=O)CSC/C=C/c1ccccc1 62a_100000747473_100016265936 [0,0,0,0,0,1|1,0,2]=4 5570 B14R1.422 NC(=O)CSC/C=C/c1ccccc1 62a_100016265936_100000747473 [0,0,0,0,0,1|1,0,2]=4 5571 B14R1.422 NC(=O)CSCC#Cc1ccccc1 62a_100000747473_100011352542 [0,0,0,0,0,1|1,0,2]=4 5572 B14R1.422 NC(=O)CSCCCc1ccccc1 62a_100000211621_100000747473 [0,0,0,0,0,1|1,0,0]=2 5573 B14R1.422 NC(=O)CSCCCc1ccccc1 62a_100000747473_100000211621 [0,0,0,0,0,1|1,0,0]=2 5574 B14R1.422 NC(=O)CSCCOc1ccccc1 62a_100000184471_100000747473 [0,0,0,0,0,1|2,0,0]=3 5575 B14R1.422 NC(=O)CSCCOc1ccccc1 62a_100000747473_100000184471 [0,0,0,0,0,1|2,0,0]=3 5576 B14R1.422 NC(=O)CSCCSc1ccccc1 62a_100000246102_100000747473 [0,0,0,0,0,1|2,0,0]=3 5577 B14R1.422 NC(=O)CSCCSc1ccccc1 62a_100000747473_100000246102 [0,0,0,0,0,1|2,0,0]=3 5578 B14R1.422 NC(=O)CSCOCc1ccccc1 62a_100000747473_100000763385 [0,0,0,0,0,1|2,0,0]=3 5579 B14R1.422 NC(=O)CSCOCc1ccccc1 62a_100000763385_100000747473 [0,0,0,0,0,1|2,0,0]=3 5580 B14R1.422 NC(=O)CSCSCc1ccccc1 62a_100000747473_200011217039 [0,0,0,0,0,1|2,0,0]=3 5581 B14R1.422 NC(=O)CSCSCc1ccccc1 62a_200011217039_100000747473 [0,0,0,0,0,1|2,0,0]=3 5582 B14R1.422 NC(=O)NCCNCc1ccccc1 207a_100020590234_100015611070 [0,0,0,0,0,1|2,0,0]=3 5583 B14R1.422 NC(=O)NCCNCc1ccccc1 2230a_100015324214_200000034859 [0,0,0,0,0,1|2,0,0]=3 5584 B14R1.422 NC(=O)NCCNCc1ccccc1 34a_100020590234_100015291786 [0,0,0,0,0,1|2,0,0]=3 5585 B14R1.422 NC(=O)NCCNCc1ccccn1 207a_100020590234_100000209966 [0,0,0,0,0,1|3,0,0]=4 5586 B14R1.422 NC(=O)NCCNCc1ccccn1 34a_100020590234_100000721315 [0,0,0,0,0,1|3,0,0]=4 5587 B14R1.422 NC(=O)NCCNCc1cccnc1 207a_100020590234_100000209961 [0,0,0,0,0,1|3,0,0]=4 5588 B14R1.422 NC(=O)NCCNCc1cccnc1 34a_100020590234_100000733263 [0,0,0,0,0,1|3,0,0]=4 5589 B14R1.422 NC(=O)NCCNCc1ccncc1 207a_100020590234_100000186114 [0,0,0,0,0,1|3,0,0]=4 5590 B14R1.422 NC(=O)NCCOCc1ccccc1 34a_100000181757_100015291786 [0,0,0,0,0,1|2,0,0]=3 5591 B14R1.422 NC(=O)NCCOCc1ccccc1 7a_100000210790_200000034859 [0,0,0,0,0,1|2,0,0]=3 5592 B14R1.422 NC(=O)NCCOCc1ccccn1 34a_100000181757_100000721315 [0,0,0,0,0,1|3,0,0]=4 5593 B14R1.422 NC(=O)NCCOCc1cccnc1 34a_100000181757_100000733263 [0,0,0,0,0,1|3,0,0]=4 5594 B14R1.422 NC(=O)NCCSCc1ccccc1 62a_100000211182_200000034859 [0,0,0,0,0,1|2,0,0]=3 5595 B14R1.422 NC(=O)NCCSCc1ccccc1 62a_200000034859_100015291786 [0,0,0,0,0,1|2,0,0]=3 5596 B14R1.422 NC(=O)NCCSCc1ccccn1 62a_100000721315_200000034859 [0,0,0,0,0,1|3,0,0]=4 5597 B14R1.422 NC(=O)NCCSCc1ccccn1 62a_200000034859_100000721315 [0,0,0,0,0,1|3,0,0]=4 5598 B14R1.422 NC(=O)NCCSCc1cccnc1 62a_100000741622_200000034859 [0,0,0,0,0,1|3,0,0]=4 5599 B14R1.422 NC(=O)NCCSCc1cccnc1 62a_200000034859_100000741622 [0,0,0,0,0,1|3,0,0]=4 5600 B14R1.422 NC(=O)NCCSCc1ccncc1 62a_100015193705_200000034859 [0,0,0,0,0,1|3,0,0]=4 5601 B14R1.422 NC(=O)NCCSCc1ccncc1 62a_200000034859_100015193705 [0,0,0,0,0,1|3,0,0]=4 5602 B14R1.422 NC(=O)OCCNCc1ccccc1 34a_100015324214_200011214921 [0,0,0,0,0,1|2,0,0]=3 5603 B14R1.422 NC(=O)OCCOCc1ccccc1 34a_100000210790_200011214921 [0,0,0,0,0,1|2,0,0]=3 5604 B14R1.422 NC(=O)OCCOCc1ccccc1 7a_100000210790_200011214921 [0,0,0,0,0,1|2,0,0]=3 5605 B14R1.422 NC(=O)OCCOCc1ccccc1 7a_100000766696_100000211182 [0,0,0,0,0,1|2,0,0]=3 5606 B14R1.422 NC(=O)OCCOCc1ccccn1 7a_100000766696_100000721315 [0,0,0,0,0,1|3,0,0]=4 5607 B14R1.422 NC(=O)OCCOCc1cccnc1 7a_100000766696_100000741622 [0,0,0,0,0,1|3,0,0]=4 5608 B14R1.422 NC(=O)OCCOCc1ccncc1 7a_100000766696_100015193705 [0,0,0,0,0,1|3,0,0]=4 5609 B14R1.422 NC(=O)OCCSCc1ccccc1 62a_100000211182_200011214921 [0,0,0,0,0,1|2,0,0]=3 5610 B14R1.422 NC(=O)OCCSCc1ccccc1 62a_200011214921_100015291786 [0,0,0,0,0,1|2,0,0]=3 5611 B14R1.422 NC(=O)OCCSCc1ccccn1 62a_100000721315_200011214921 [0,0,0,0,0,1|3,0,0]=4 5612 B14R1.422 NC(=O)OCCSCc1ccccn1 62a_200011214921_100000721315 [0,0,0,0,0,1|3,0,0]=4 5613 B14R1.422 NC(=O)OCCSCc1cccnc1 62a_100000741622_200011214921 [0,0,0,0,0,1|3,0,0]=4 5614 B14R1.422 NC(=O)OCCSCc1cccnc1 62a_200011214921_100000741622 [0,0,0,0,0,1|3,0,0]=4 5615 B14R1.422 NC(=O)OCCSCc1ccncc1 62a_100015193705_200011214921 [0,0,0,0,0,1|3,0,0]=4 5616 B14R1.422 NC(=O)OCCSCc1ccncc1 62a_200011214921_100015193705 [0,0,0,0,0,1|3,0,0]=4 5617 B14R1.422 O=C(O)CNC/C=C/c1ccccc1 269956a_100016091260_100016265936 [0,0,0,0,0,1|0,0,2]=3 5618 B14R1.422 O=C(O)CNCC#Cc1ccccc1 269956a_100016091260_100011352542 [0,0,0,0,0,1|0,0,2]=3 5619 B14R1.422 O=C(O)CNCCCc1ccccc1 269956a_100016091260_100000211621 [0,0,0,0,0,1|0,0,0]=1 5620 B14R1.422 O=C(O)CNCCOc1ccccc1 269956a_100016091260_100000184471 [0,0,0,0,0,1|1,0,0]=2 5621 B14R1.422 O=C(O)CNCCSc1ccccc1 269956a_100016091260_100000246102 [0,0,0,0,0,1|1,0,0]=2 5622 B14R1.422 O=C(O)CNCOCc1ccccc1 269956a_100016091260_100000763385 [0,0,0,0,0,1|1,0,0]=2 5623 B14R1.422 O=C(O)CNCSCc1ccccc1 269956a_100016091260_200011217039 [0,0,0,0,0,1|1,0,0]=2 5624 B14R1.422 O=C(O)CONCCc1ccccc1 269956a_100000106656_100000765856 [0,0,0,0,0,1|1,0,0]=2 5625 B14R1.422 O=C(O)CONCCc1ccccn1 269956a_100000106656_100015183660 [0,0,0,0,0,1|2,0,0]=3 5626 B14R1.422 O=C(O)CONCCc1cccnc1 269956a_100000106656_200011713674 [0,0,0,0,0,1|2,0,0]=3 5627 B14R1.422 O=C(O)CONCCc1ccncc1 269956a_100000106656_100000723409 [0,0,0,0,0,1|2,0,0]=3 5628 B14R1.422 O=C(O)CONCSc1ccccc1 269956a_100000106656_100011218342 [0,0,0,0,0,1|2,0,0]=3 5629 B14R1.422 O=C([O-])CNC/C=C/c1ccccc1 34a_100020603302_100020667443 [0,0,0,0,0,1|0,0,3]=4 5630 B14R1.422 O=C([O-])CNCC#Cc1ccccc1 34a_100000735379_100020667443 [0,0,0,0,0,1|0,0,3]=4 5631 B14R1.422 O=C([O-])CNCCCc1ccccc1 34a_100000211184_100020667443 [0,0,0,0,0,1|0,0,1]=2 5632 B14R1.422 O=C([O-])CNCCCc1cccnc1 34a_100011532358_100020667443 [0,0,0,0,0,1|1,0,1]=3 5633 B14R1.422 O=C([O-])CNCCOc1ccccc1 34a_100000174943_100020667443 [0,0,0,0,0,1|1,0,1]=3 5634 B14R1.422 O=C([O-])COC/C=C/c1ccccc1 34a_100000210256_100020667443 [0,0,0,0,0,1|0,0,3]=4 5635 B14R1.422 O=C([O-])COCC#Cc1ccccc1 34a_100011217464_100020667443 [0,0,0,0,0,1|0,0,3]=4 5636 B14R1.422 O=C([O-])COCCCC1=CCC=CC1 34a_100020667889_100020667443 [0,0,0,0,0,1|0,0,3]=4 5637 B14R1.422 O=C([O-])COCCCc1ccccc1 34a_100000210828_100020667443 [0,0,0,0,0,1|0,0,1]=2 5638 B14R1.422 O=C([O-])COCCCc1ccccn1 34a_100011215068_100020667443 [0,0,0,0,0,1|1,0,1]=3 5639 B14R1.422 O=C([O-])COCCCc1cccnc1 34a_100000211284_100020667443 [0,0,0,0,0,1|1,0,1]=3 5640 B14R1.422 O=C([O-])COCCCc1ccncc1 34a_100000210659_100020667443 [0,0,0,0,0,1|1,0,1]=3 5641 B14R1.422 O=C([O-])COCCNc1ccccc1 34a_100000211345_100020667443 [0,0,0,0,0,1|1,0,1]=3 5642 B14R1.422 O=C([O-])COCCNc1ccncc1 34a_200011243140_100020667443 [0,0,0,0,0,1|2,0,1]=4 5643 B14R1.422 O=C([O-])COCCOc1ccccc1 34a_100000210260_100020667443 [0,0,0,0,0,1|1,0,1]=3 5644 B14R1.422 O=C([O-])CSC/C=C/c1ccccc1 62a_100016265936_100020667443 [0,0,0,0,0,1|0,0,3]=4 5645 B14R1.422 O=C([O-])CSC/C=C/c1ccccc1 62a_100020667443_100016265936 [0,0,0,0,0,1|0,0,3]=4 5646 B14R1.422 O=C([O-])CSCC#Cc1ccccc1 62a_100020667443_100011352542 [0,0,0,0,0,1|0,0,3]=4 5647 B14R1.422 O=C([O-])CSCCCc1ccccc1 62a_100000211621_100020667443 [0,0,0,0,0,1|0,0,1]=2 5648 B14R1.422 O=C([O-])CSCCCc1ccccc1 62a_100020667443_100000211621 [0,0,0,0,0,1|0,0,1]=2 5649 B14R1.422 O=C([O-])CSCCOc1ccccc1 62a_100000184471_100020667443 [0,0,0,0,0,1|1,0,1]=3 5650 B14R1.422 O=C([O-])CSCCOc1ccccc1 62a_100020667443_100000184471 [0,0,0,0,0,1|1,0,1]=3 5651 B14R1.422 O=C([O-])CSCCSc1ccccc1 62a_100000246102_100020667443 [0,0,0,0,0,1|1,0,1]=3 5652 B14R1.422 O=C([O-])CSCCSc1ccccc1 62a_100020667443_100000246102 [0,0,0,0,0,1|1,0,1]=3 5653 B14R1.422 O=C([O-])CSCOCc1ccccc1 62a_100000763385_100020667443 [0,0,0,0,0,1|1,0,1]=3 5654 B14R1.422 O=C([O-])CSCOCc1ccccc1 62a_100020667443_100000763385 [0,0,0,0,0,1|1,0,1]=3 5655 B14R1.422 O=C([O-])CSCSCc1ccccc1 62a_100020667443_200011217039 [0,0,0,0,0,1|1,0,1]=3 5656 B14R1.422 O=C([O-])CSCSCc1ccccc1 62a_200011217039_100020667443 [0,0,0,0,0,1|1,0,1]=3 5657 B14R1.422 O=[N+]([O-])CCCOCc1ccccc1 34a_200000037920_100015291786 [0,0,0,0,0,1|1,0,1]=3 5658 B14R1.422 O=[N+]([O-])CCCOCc1ccccn1 34a_200000037920_100000721315 [0,0,0,0,0,1|2,0,1]=4 5659 B14R1.422 O=[N+]([O-])CCCOCc1cccnc1 34a_200000037920_100000733263 [0,0,0,0,0,1|2,0,1]=4 5660 B14R1.422 O=[N+]([O-])CNCCCc1ccccc1 34a_100000211184_100000761209 [0,0,0,0,0,1|1,0,1]=3 5661 B14R1.422 O=[N+]([O-])CNCCCc1cccnc1 34a_100011532358_100000761209 [0,0,0,0,0,1|2,0,1]=4 5662 B14R1.422 O=[N+]([O-])CNCCOc1ccccc1 34a_100000174943_100000761209 [0,0,0,0,0,1|2,0,1]=4 5663 B14R1.422 O=[N+]([O-])COCCCc1ccccc1 34a_100000210828_100000761209 [0,0,0,0,0,1|1,0,1]=3 5664 B14R1.422 O=[N+]([O-])COCCCc1ccccn1 34a_100011215068_100000761209 [0,0,0,0,0,1|2,0,1]=4 5665 B14R1.422 O=[N+]([O-])COCCCc1cccnc1 34a_100000211284_100000761209 [0,0,0,0,0,1|2,0,1]=4 5666 B14R1.422 O=[N+]([O-])COCCCc1ccncc1 34a_100000210659_100000761209 [0,0,0,0,0,1|2,0,1]=4 5667 B14R1.422 O=[N+]([O-])COCCNc1ccccc1 34a_100000211345_100000761209 [0,0,0,0,0,1|2,0,1]=4 5668 B14R1.422 O=[N+]([O-])COCCOc1ccccc1 34a_100000210260_100000761209 [0,0,0,0,0,1|2,0,1]=4 5669 B14R1.422 O=[N+]([O-])CSCCCc1ccccc1 62a_100000211621_100000761209 [0,0,0,0,0,1|1,0,1]=3 5670 B14R1.422 O=[N+]([O-])CSCCOc1ccccc1 62a_100000184471_100000761209 [0,0,0,0,0,1|2,0,1]=4 5671 B14R1.422 O=[N+]([O-])CSCCSc1ccccc1 62a_100000246102_100000761209 [0,0,0,0,0,1|2,0,1]=4 5672 B14R1.422 O=[N+]([O-])CSCOCc1ccccc1 62a_100000763385_100000761209 [0,0,0,0,0,1|2,0,1]=4 5673 B14R1.422 O=[N+]([O-])CSCSCc1ccccc1 62a_200011217039_100000761209 [0,0,0,0,0,1|2,0,1]=4 5674 B14R1.422 OB(O)CCCCNc1ccccc1 34a_100000106764_200009817182 [0,0,0,0,0,1|1,0,1]=3 5675 B14R1.422 OB(O)CCCCOc1ccccc1 34a_100000210340_200009817182 [0,0,0,0,0,1|1,0,1]=3 5676 B14R1.422 OB(O)CCCCOc1ccccc1 7a_100000210340_200009817182 [0,0,0,0,0,1|1,0,1]=3 5677 B14R1.422 OB(O)CCCCOc1cccnc1 34a_100000210849_200009817182 [0,0,0,0,0,1|2,0,1]=4 5678 B14R1.422 OB(O)CCCCOc1cccnc1 7a_100000210849_200009817182 [0,0,0,0,0,1|2,0,1]=4 5679 B14R1.422 OB(O)CCCCOc1ccncc1 34a_100000212176_200009817182 [0,0,0,0,0,1|2,0,1]=4 5680 B14R1.422 OB(O)CCCCSc1ccccc1 62a_100000719477_200009817182 [0,0,0,0,0,1|1,0,1]=3 5681 B14R1.422 OB(O)CCCCSc1ccccc1 62a_200009817182_100000041952 [0,0,0,0,0,1|1,0,1]=3 5682 B14R1.422 OB(O)CCCCSc1ccccn1 62a_100011216584_200009817182 [0,0,0,0,0,1|2,0,1]=4 5683 B14R1.422 OB(O)CCCCSc1ccccn1 62a_200009817182_100011216584 [0,0,0,0,0,1|2,0,1]=4 5684 B14R1.422 OB(O)CCCCSc1cccnc1 62a_100000210063_200009817182 [0,0,0,0,0,1|2,0,1]=4 5685 B14R1.422 OB(O)CCCCSc1cccnc1 62a_200009817182_100000210063 [0,0,0,0,0,1|2,0,1]=4 5686 B14R1.422 OB(O)CCCCSc1ccncc1 62a_100000728582_200009817182 [0,0,0,0,0,1|2,0,1]=4 5687 B14R1.422 OB(O)CCCCSc1ccncc1 62a_200009817182_100000728582 [0,0,0,0,0,1|2,0,1]=4 5688 B14R1.422 [13CH3]C(=O)CCCCCc1ccccc1 1458a_100011216832_200025704644 [0,0,0,0,0,1|1,0,0]=2 5689 B14R1.422 [13CH3]C(=O)CCCCOc1ccccc1 1458a_200011216290_200025704644 [0,0,0,0,0,1|1,0,0]=2 5690 B14R1.422 [13CH3]C(=O)CCCOCc1ccccc1 1458a_100000748059_200025704644 [0,0,0,0,0,1|1,0,0]=2 5691 B14R1.422 [13CH3]C(=O)CSCCOc1ccccc1 1458a_200000150159_200025704644 [0,0,0,0,0,1|2,0,0]=3 5692 B11R0.81 C=CC=CC(=O)CCCCC=C 1458a_100016291481_100011215482 [1,0,1,0,0,0|2,0,0]=4 5693 B11R0.81 C=CC=CC(=O)CCCCCO 1458a_100016291481_100000746330 [1,0,1,0,0,0|1,0,1]=4 5694 B11R1.28 BrCCOCc1ccccc1 34a_100000211926_100015291786 [2,0,0,0,0,0|2,0,0]=4 5695 B11R1.28 C=CCCNc1ccccc1 34a_100000106764_100000754431 [2,0,0,0,0,0|1,0,1]=4 5696 B11R1.28 C=CCCOc1ccccc1 34a_100000210340_100000754431 [2,0,0,0,0,0|1,0,1]=4 5697 B11R1.28 C=CCCOc1ccccc1 7a_100000210340_100000754431 [2,0,0,0,0,0|1,0,1]=4 5698 B11R1.28 C=CCCSc1ccccc1 62a_100000719477_100000754431 [2,0,0,0,0,0|1,0,1]=4 5699 B11R1.28 C=CCCSc1ccccc1 62a_100000754431_100000041952 [2,0,0,0,0,0|1,0,1]=4 5700 B11R1.28 C=CCNCc1ccccc1 2230a_100015324214_100000210623 [2,0,0,0,0,0|1,0,1]=4 5701 B11R1.28 C=CCNCc1ccccc1 2230a_100020586998_100015291786 [2,0,0,0,0,0|1,0,1]=4 5702 B11R1.28 C=CCNCc1ccccc1 270004a_100020586998_100015611070 [2,0,0,0,0,0|1,0,1]=4 5703 B11R1.28 C=CCNCc1ccccc1 34a_100015324214_100015514636 [2,0,0,0,0,0|1,0,1]=4 5704 B11R1.28 C=CCOCc1ccccc1 34a_100000210790_100015514636 [2,0,0,0,0,0|1,0,1]=4 5705 B11R1.28 C=CCOCc1ccccc1 34a_200000210373_100015291786 [2,0,0,0,0,0|1,0,1]=4 5706 B11R1.28 C=CCOCc1ccccc1 7a_100000210790_100015514636 [2,0,0,0,0,0|1,0,1]=4 5707 B11R1.28 C=CCSCc1ccccc1 62a_100000210623_100015291786 [2,0,0,0,0,0|1,0,1]=4 5708 B11R1.28 C=CCSCc1ccccc1 62a_100000211182_100000210623 [2,0,0,0,0,0|1,0,1]=4 5709 B11R1.28 CCCCNc1ccccc1 34a_100000106764_100000210210 [2,0,0,0,0,0|1,0,1]=4 5710 B11R1.28 CCCCOc1ccccc1 34a_100000210340_100000210210 [2,0,0,0,0,0|1,0,1]=4 5711 B11R1.28 CCCCOc1ccccc1 7a_100000210340_100000210211 [2,0,0,0,0,0|1,0,1]=4 5712 B11R1.28 CCCCSc1ccccc1 62a_100000210211_100000041952 [2,0,0,0,0,0|1,0,1]=4 5713 B11R1.28 CCCCSc1ccccc1 62a_100000719477_100000210210 [2,0,0,0,0,0|1,0,1]=4 5714 B11R1.28 CCCNCc1ccccc1 207a_100020643023_100015611070 [2,0,0,0,0,0|1,0,1]=4 5715 B11R1.28 CCCNCc1ccccc1 2230a_100015324214_100000210303 [2,0,0,0,0,0|1,0,1]=4 5716 B11R1.28 CCCNCc1ccccc1 270004a_100020643023_100015611070 [2,0,0,0,0,0|1,0,1]=4 5717 B11R1.28 CCCNCc1ccccc1 34a_100015324214_100000210303 [2,0,0,0,0,0|1,0,1]=4 5718 B11R1.28 CCCOCc1ccccc1 34a_100000210258_100015291786 [2,0,0,0,0,0|1,0,1]=4 5719 B11R1.28 CCCOCc1ccccc1 34a_100000210790_100000210303 [2,0,0,0,0,0|1,0,1]=4 5720 B11R1.28 CCCOCc1ccccc1 7a_100000210790_100000210303 [2,0,0,0,0,0|1,0,1]=4 5721 B11R1.28 CCCSCc1ccccc1 62a_100000210303_100015291786 [2,0,0,0,0,0|1,0,1]=4 5722 B11R1.28 CCCSCc1ccccc1 62a_100000211182_100000210303 [2,0,0,0,0,0|1,0,1]=4 5723 B11R1.28 CCNCCc1ccccc1 2230a_100000106460_100000210202 [2,0,0,0,0,0|1,0,1]=4 5724 B11R1.28 CCNCCc1ccccc1 2230a_100015525214_100000765856 [2,0,0,0,0,0|1,0,1]=4 5725 B11R1.28 CCNCCc1ccccc1 34a_100000106460_100000210202 [2,0,0,0,0,0|1,0,1]=4 5726 B11R1.28 CCOCCc1ccccc1 34a_100000210268_100000210202 [2,0,0,0,0,0|1,0,1]=4 5727 B11R1.28 CCOCCc1ccccc1 34a_100121572206_100000765856 [2,0,0,0,0,0|1,0,1]=4 5728 B11R1.28 CCOCCc1ccccc1 7a_100000210268_100000210202 [2,0,0,0,0,0|1,0,1]=4 5729 B11R1.28 CCSCCc1ccccc1 62a_100000210202_100011218657 [2,0,0,0,0,0|1,0,1]=4 5730 B11R1.28 CCSCCc1ccccc1 62a_100000765856_100000210202 [2,0,0,0,0,0|1,0,1]=4 5731 B11R1.28 CNCCCc1ccccc1 2230a_100000211184_200000210301 [2,0,0,0,0,0|1,0,1]=4 5732 B11R1.28 CNCCCc1ccccc1 2230a_106832991635_100000211621 [2,0,0,0,0,0|1,0,1]=4 5733 B11R1.28 CNCCCc1ccccc1 34a_100000211184_200000210301 [2,0,0,0,0,0|1,0,1]=4 5734 B11R1.28 CNCCCc1ccccc1 34a_100102657272_100000211621 [2,0,0,0,0,0|1,0,1]=4 5735 B11R1.28 CNCCCc1ccccc1 7a_106832991635_100000211621 [2,0,0,0,0,0|1,0,1]=4 5736 B11R1.28 COCCCc1ccccc1 34a_100000210828_200000210301 [2,0,0,0,0,0|1,0,1]=4 5737 B11R1.28 COCCCc1ccccc1 34a_100138415774_100000211621 [2,0,0,0,0,0|1,0,1]=4 5738 B11R1.28 COCCCc1ccccc1 7a_100000210828_200000210301 [2,0,0,0,0,0|1,0,1]=4 5739 B11R1.28 CSCCCc1ccccc1 62a_100000211621_200000210301 [2,0,0,0,0,0|1,0,1]=4 5740 B11R1.28 CSCCCc1ccccc1 62a_200000210301_100000211621 [2,0,0,0,0,0|1,0,1]=4 5741 B11R1.28 FCCCNc1ccccc1 34a_100000106764_100011934791 [2,0,0,0,0,0|2,0,0]=4 5742 B11R1.28 FCCCOc1ccccc1 34a_100000210340_100011934791 [2,0,0,0,0,0|2,0,0]=4 5743 B11R1.28 FCCCOc1ccccc1 7a_100000210340_100011934791 [2,0,0,0,0,0|2,0,0]=4 5744 B11R1.28 FCCCSc1ccccc1 62a_100000719477_100011934791 [2,0,0,0,0,0|2,0,0]=4 5745 B11R1.28 FCCCSc1ccccc1 62a_100011934791_100000041952 [2,0,0,0,0,0|2,0,0]=4 5746 B11R1.28 FCCNCc1ccccc1 2230a_100015324214_100011217306 [2,0,0,0,0,0|2,0,0]=4 5747 B11R1.28 FCCNCc1ccccc1 34a_100000724931_100015291786 [2,0,0,0,0,0|2,0,0]=4 5748 B11R1.28 FCCNCc1ccccc1 34a_100015324214_100011217306 [2,0,0,0,0,0|2,0,0]=4 5749 B11R1.28 FCCOCc1ccccc1 34a_100000210790_100011217306 [2,0,0,0,0,0|2,0,0]=4 5750 B11R1.28 FCCOCc1ccccc1 7a_100000210790_100011217306 [2,0,0,0,0,0|2,0,0]=4 5751 B11R1.28 FCCSCc1ccccc1 62a_100000211182_100011217306 [2,0,0,0,0,0|2,0,0]=4 5752 B11R1.28 FCCSCc1ccccc1 62a_100011217306_100015291786 [2,0,0,0,0,0|2,0,0]=4 5753 B11R1.28 FCNCCc1ccccc1 34a_100000106460_100015361967 [2,0,0,0,0,0|2,0,0]=4 5754 B11R1.28 FCOCCc1ccccc1 34a_100000210268_100015361967 [2,0,0,0,0,0|2,0,0]=4 5755 B11R1.28 FCOCCc1ccccc1 7a_100000210268_100015361967 [2,0,0,0,0,0|2,0,0]=4 5756 B11R1.28 FCSCCc1ccccc1 62a_100000765856_100015361967 [2,0,0,0,0,0|2,0,0]=4 5757 B11R1.28 FCSCCc1ccccc1 62a_100015361967_100011218657 [2,0,0,0,0,0|2,0,0]=4 5758 B11R1.28 NCCOCc1ccccc1 34a_100000210304_100015291786 [2,0,0,0,0,0|2,0,0]=4 5759 B11R1.28 O=CCNCc1ccccc1 2230a_100015324214_200015260668 [2,0,0,0,0,0|1,0,0]=3 5760 B11R1.28 O=CCNCc1ccccc1 34a_100015324214_200009817547 [2,0,0,0,0,0|1,0,0]=3 5761 B11R1.28 O=CCOCc1ccccc1 34a_100000210790_200009817547 [2,0,0,0,0,0|1,0,0]=3 5762 B11R1.28 O=CCOCc1ccccc1 7a_100000210790_200015260668 [2,0,0,0,0,0|1,0,0]=3 5763 B11R1.28 O=CCSCc1ccccc1 62a_100000211182_200015260668 [2,0,0,0,0,0|1,0,0]=3 5764 B11R1.28 O=CCSCc1ccccc1 62a_200015260668_100015291786 [2,0,0,0,0,0|1,0,0]=3 5765 B11R1.28 O=CCSCc1ccccn1 62a_100000721315_200015260668 [2,0,0,0,0,0|2,0,0]=4 5766 B11R1.28 O=CCSCc1ccccn1 62a_200015260668_100000721315 [2,0,0,0,0,0|2,0,0]=4 5767 B11R1.28 O=CCSCc1cccnc1 62a_100000741622_200015260668 [2,0,0,0,0,0|2,0,0]=4 5768 B11R1.28 O=CCSCc1cccnc1 62a_200015260668_100000741622 [2,0,0,0,0,0|2,0,0]=4 5769 B11R1.28 O=CCSCc1ccncc1 62a_100015193705_200015260668 [2,0,0,0,0,0|2,0,0]=4 5770 B11R1.28 O=CCSCc1ccncc1 62a_200015260668_100015193705 [2,0,0,0,0,0|2,0,0]=4 5771 B11R1.28 OCCCNc1ccccc1 34a_100000106764_100000230001 [2,0,0,0,0,0|1,0,0]=3 5772 B11R1.28 OCCCOc1ccccc1 34a_100000210340_100000230001 [2,0,0,0,0,0|1,0,0]=3 5773 B11R1.28 OCCCOc1ccccc1 7a_100000210340_100011215043 [2,0,0,0,0,0|1,0,0]=3 5774 B11R1.28 OCCCOc1cccnc1 34a_100000210849_100000230001 [2,0,0,0,0,0|2,0,0]=4 5775 B11R1.28 OCCCOc1cccnc1 7a_100000210849_100011215043 [2,0,0,0,0,0|2,0,0]=4 5776 B11R1.28 OCCCOc1ccncc1 34a_100000212176_100000230001 [2,0,0,0,0,0|2,0,0]=4 5777 B11R1.28 OCCCSc1ccccc1 62a_100000719477_100011215043 [2,0,0,0,0,0|1,0,0]=3 5778 B11R1.28 OCCCSc1ccccc1 62a_100011215043_100000041952 [2,0,0,0,0,0|1,0,0]=3 5779 B11R1.28 OCCCSc1ccccn1 62a_100011215043_100011216584 [2,0,0,0,0,0|2,0,0]=4 5780 B11R1.28 OCCCSc1ccccn1 62a_100011216584_100011215043 [2,0,0,0,0,0|2,0,0]=4 5781 B11R1.28 OCCCSc1cccnc1 62a_100000210063_100011215043 [2,0,0,0,0,0|2,0,0]=4 5782 B11R1.28 OCCCSc1cccnc1 62a_100011215043_100000210063 [2,0,0,0,0,0|2,0,0]=4 5783 B11R1.28 OCCCSc1ccncc1 62a_100000728582_100011215043 [2,0,0,0,0,0|2,0,0]=4 5784 B11R1.28 OCCCSc1ccncc1 62a_100011215043_100000728582 [2,0,0,0,0,0|2,0,0]=4 5785 B11R1.28 OCCNCc1ccccc1 207a_100000210304_100015611070 [2,0,0,0,0,0|1,0,0]=3 5786 B11R1.28 OCCNCc1ccccc1 2230a_100015324214_100000211926 [2,0,0,0,0,0|1,0,0]=3 5787 B11R1.28 OCCNCc1ccccc1 2230a_100016997473_100015291786 [2,0,0,0,0,0|1,0,0]=3 5788 B11R1.28 OCCNCc1ccccc1 270004a_100000210304_100015611070 [2,0,0,0,0,0|1,0,0]=3 5789 B11R1.28 OCCNCc1ccccc1 34a_100015324214_100000211926 [2,0,0,0,0,0|1,0,0]=3 5790 B11R1.28 OCCNCc1ccccc1 34a_100016990907_100015291786 [2,0,0,0,0,0|1,0,0]=3 5791 B11R1.28 OCCNCc1ccccn1 207a_100000210304_100000209966 [2,0,0,0,0,0|2,0,0]=4 5792 B11R1.28 OCCNCc1ccccn1 2230a_100016997473_100000721315 [2,0,0,0,0,0|2,0,0]=4 5793 B11R1.28 OCCNCc1ccccn1 270004a_100000210304_100000209966 [2,0,0,0,0,0|2,0,0]=4 5794 B11R1.28 OCCNCc1ccccn1 34a_100016990907_100000721315 [2,0,0,0,0,0|2,0,0]=4 5795 B11R1.28 OCCNCc1cccnc1 207a_100000210304_100000209961 [2,0,0,0,0,0|2,0,0]=4 5796 B11R1.28 OCCNCc1cccnc1 2230a_100016997473_100000741622 [2,0,0,0,0,0|2,0,0]=4 5797 B11R1.28 OCCNCc1cccnc1 270004a_100000210304_100000209961 [2,0,0,0,0,0|2,0,0]=4 5798 B11R1.28 OCCNCc1cccnc1 34a_100016990907_100000733263 [2,0,0,0,0,0|2,0,0]=4 5799 B11R1.28 OCCNCc1ccncc1 207a_100000210304_100000186114 [2,0,0,0,0,0|2,0,0]=4 5800 B11R1.28 OCCNCc1ccncc1 2230a_100016997473_100015193705 [2,0,0,0,0,0|2,0,0]=4 5801 B11R1.28 OCCOCc1ccccc1 34a_100000210790_100000211926 [2,0,0,0,0,0|1,0,0]=3 5802 B11R1.28 OCCOCc1ccccc1 7a_100000210790_100000211926 [2,0,0,0,0,0|1,0,0]=3 5803 B11R1.28 OCCSCc1ccccc1 62a_100000211182_100000211926 [2,0,0,0,0,0|1,0,0]=3 5804 B11R1.28 OCCSCc1ccccc1 62a_100000211926_100015291786 [2,0,0,0,0,0|1,0,0]=3 5805 B11R1.28 OCCSCc1ccccn1 62a_100000211926_100000721315 [2,0,0,0,0,0|2,0,0]=4 5806 B11R1.28 OCCSCc1ccccn1 62a_100000721315_100000211926 [2,0,0,0,0,0|2,0,0]=4 5807 B11R1.28 OCCSCc1cccnc1 62a_100000211926_100000741622 [2,0,0,0,0,0|2,0,0]=4 5808 B11R1.28 OCCSCc1cccnc1 62a_100000741622_100000211926 [2,0,0,0,0,0|2,0,0]=4 5809 B11R1.28 OCCSCc1ccncc1 62a_100000211926_100015193705 [2,0,0,0,0,0|2,0,0]=4 5810 B11R1.28 OCCSCc1ccncc1 62a_100015193705_100000211926 [2,0,0,0,0,0|2,0,0]=4 5811 B11R1.28 [13CH3]NCCCc1ccccc1 2230a_100000211184_200025704644 [2,0,0,0,0,0|1,0,1]=4 5812 B11R1.28 [13CH3]NCCCc1ccccc1 34a_100000211184_200025704644 [2,0,0,0,0,0|1,0,1]=4 5813 B11R1.28 [13CH3]OCCCc1ccccc1 34a_100000210828_200025704644 [2,0,0,0,0,0|1,0,1]=4 5814 B11R1.28 [13CH3]OCCCc1ccccc1 7a_100000210828_200025704644 [2,0,0,0,0,0|1,0,1]=4 5815 B11R1.28 [13CH3]SCCCc1ccccc1 62a_100000211621_200025704644 [2,0,0,0,0,0|1,0,1]=4 5816 B11R1.28 [13CH3]SCCCc1ccccc1 62a_200025704644_100000211621 [2,0,0,0,0,0|1,0,1]=4 5817 B13R0.113 C=CC=CC(=O)CCCCC(=O)OC 1458a_100016291481_100000204269 [0,1,1,0,0,0|1,0,0]=3 5818 B13R0.113 C=CC=CC(=O)CCOCC(=O)OC 1458a_100016291481_100000090808 [0,1,1,0,0,0|2,0,0]=4 5819 B13R0.188 C/C=C/C=CC(=O)CCCCC(=O)C 1458a_100000185730_100000735457 [0,1,1,0,0,0|2,0,0]=4 5820 B13R0.119 C=CC=CC(=O)CCCCCC(=O)N 1458a_100016291481_100009817443 [0,1,1,0,0,0|1,0,1]=4 5821 B13R0.119 C=CC=CC(=O)NCCCCC(=O)N 1626a_100000696515_100016291481 [0,1,1,0,0,0|2,0,0]=4 5822 B13R1.6 C=CCCCNc1cccc(c1)Br 34a_100000210019_100000757094 [1,1,0,0,0,0|2,0,0]=4 5823 B13R1.6 C=CCCCNc1cccc(c1)C 2230a_100000188690_100011713584 [1,1,0,0,0,0|2,0,0]=4 5824 B13R1.6 C=CCCCNc1cccc(c1)C 34a_100000188690_100000757094 [1,1,0,0,0,0|2,0,0]=4 5825 B13R1.6 C=CCCCNc1cccc(c1)Cl 34a_100000185859_100000757094 [1,1,0,0,0,0|2,0,0]=4 5826 B13R1.6 C=CCCCNc1cccc(c1)F 34a_100000210047_100000757094 [1,1,0,0,0,0|2,0,0]=4 5827 B13R1.6 C=CCCCNc1cccc(c1)I 34a_100000211102_100000757094 [1,1,0,0,0,0|2,0,0]=4 5828 B13R1.6 C=CCCCNc1cccc(c1)O 34a_100000210217_100000757094 [1,1,0,0,0,0|2,0,0]=4 5829 B13R1.6 C=CCCCOc1cccc(c1)Br 34a_100000210342_100000757094 [1,1,0,0,0,0|2,0,0]=4 5830 B13R1.6 C=CCCCOc1cccc(c1)Br 7a_100000210342_100000757094 [1,1,0,0,0,0|2,0,0]=4 5831 B13R1.6 C=CCCCOc1cccc(c1)C 34a_100000210337_100000757094 [1,1,0,0,0,0|2,0,0]=4 5832 B13R1.6 C=CCCCOc1cccc(c1)C 7a_100000210337_100000757094 [1,1,0,0,0,0|2,0,0]=4 5833 B13R1.6 C=CCCCOc1cccc(c1)Cl 34a_100000210295_100000757094 [1,1,0,0,0,0|2,0,0]=4 5834 B13R1.6 C=CCCCOc1cccc(c1)Cl 7a_100000210295_100000757094 [1,1,0,0,0,0|2,0,0]=4 5835 B13R1.6 C=CCCCOc1cccc(c1)F 34a_100000210426_100000757094 [1,1,0,0,0,0|2,0,0]=4 5836 B13R1.6 C=CCCCOc1cccc(c1)F 7a_100000210426_100000757094 [1,1,0,0,0,0|2,0,0]=4 5837 B13R1.6 C=CCCCOc1cccc(c1)I 34a_100000211634_100000757094 [1,1,0,0,0,0|2,0,0]=4 5838 B13R1.6 C=CCCCOc1cccc(c1)I 7a_100000211634_100000757094 [1,1,0,0,0,0|2,0,0]=4 5839 B13R1.6 C=CCCCOc1cccc(c1)N 34a_100000210217_100000757094 [1,1,0,0,0,0|2,0,0]=4 5840 B13R1.6 C=CCCCSc1cccc(c1)Br 62a_100000691529_100000757094 [1,1,0,0,0,0|2,0,0]=4 5841 B13R1.6 C=CCCCSc1cccc(c1)Br 62a_100011713584_100000691529 [1,1,0,0,0,0|2,0,0]=4 5842 B13R1.6 C=CCCCSc1cccc(c1)C 62a_100011215228_100000757094 [1,1,0,0,0,0|2,0,0]=4 5843 B13R1.6 C=CCCCSc1cccc(c1)C 62a_100011713584_100011215228 [1,1,0,0,0,0|2,0,0]=4 5844 B13R1.6 C=CCCCSc1cccc(c1)Cl 62a_100000699651_100000757094 [1,1,0,0,0,0|2,0,0]=4 5845 B13R1.6 C=CCCCSc1cccc(c1)Cl 62a_100011713584_100000699651 [1,1,0,0,0,0|2,0,0]=4 5846 B13R1.6 C=CCCCSc1cccc(c1)F 62a_100000685547_100000757094 [1,1,0,0,0,0|2,0,0]=4 5847 B13R1.6 C=CCCCSc1cccc(c1)F 62a_100011713584_100000685547 [1,1,0,0,0,0|2,0,0]=4 5848 B13R1.6 C=CCCCSc1cccc(c1)N 62a_100000210019_100000757094 [1,1,0,0,0,0|2,0,0]=4 5849 B13R1.6 C=CCCCSc1cccc(c1)N 62a_100011713584_100000210019 [1,1,0,0,0,0|2,0,0]=4 5850 B13R1.6 C=CCCCSc1cccc(c1)O 62a_100011713584_100000211634 [1,1,0,0,0,0|2,0,0]=4 5851 B13R1.6 C=CCCCSc1cccc(c1)[S] 62a_100011713584_114929384022 [1,1,0,0,0,0|2,0,0]=4 5852 B13R1.6 C=CCCCSc1cccc(c1)[S] 62a_114929384022_100000757094 [1,1,0,0,0,0|2,0,0]=4 5853 B13R1.6 C=CCCNCc1cccc(c1)Br 207a_100015191253_100000210085 [1,1,0,0,0,0|2,0,0]=4 5854 B13R1.6 C=CCCNCc1cccc(c1)Br 2230a_100000174977_100000754431 [1,1,0,0,0,0|2,0,0]=4 5855 B13R1.6 C=CCCNCc1cccc(c1)Br 2230a_100015191253_100000698116 [1,1,0,0,0,0|2,0,0]=4 5856 B13R1.6 C=CCCNCc1cccc(c1)Br 270004a_100015191253_100000210085 [1,1,0,0,0,0|2,0,0]=4 5857 B13R1.6 C=CCCNCc1cccc(c1)Br 34a_100000174977_100000754431 [1,1,0,0,0,0|2,0,0]=4 5858 B13R1.6 C=CCCNCc1cccc(c1)C 207a_100015191253_100000211157 [1,1,0,0,0,0|2,0,0]=4 5859 B13R1.6 C=CCCNCc1cccc(c1)C 2230a_100000185548_100000754431 [1,1,0,0,0,0|2,0,0]=4 5860 B13R1.6 C=CCCNCc1cccc(c1)C 2230a_100015191253_100000211840 [1,1,0,0,0,0|2,0,0]=4 5861 B13R1.6 C=CCCNCc1cccc(c1)C 270004a_100015191253_100000211157 [1,1,0,0,0,0|2,0,0]=4 5862 B13R1.6 C=CCCNCc1cccc(c1)C 34a_100000185548_100000754431 [1,1,0,0,0,0|2,0,0]=4 5863 B13R1.6 C=CCCNCc1cccc(c1)Cl 207a_100015191253_100000210801 [1,1,0,0,0,0|2,0,0]=4 5864 B13R1.6 C=CCCNCc1cccc(c1)Cl 2230a_100000174878_100000754431 [1,1,0,0,0,0|2,0,0]=4 5865 B13R1.6 C=CCCNCc1cccc(c1)Cl 2230a_100015191253_100000181238 [1,1,0,0,0,0|2,0,0]=4 5866 B13R1.6 C=CCCNCc1cccc(c1)Cl 270004a_100015191253_100000210801 [1,1,0,0,0,0|2,0,0]=4 5867 B13R1.6 C=CCCNCc1cccc(c1)Cl 34a_100000174878_100000754431 [1,1,0,0,0,0|2,0,0]=4 5868 B13R1.6 C=CCCNCc1cccc(c1)F 207a_100015191253_100000210812 [1,1,0,0,0,0|2,0,0]=4 5869 B13R1.6 C=CCCNCc1cccc(c1)F 2230a_100000174948_100000754431 [1,1,0,0,0,0|2,0,0]=4 5870 B13R1.6 C=CCCNCc1cccc(c1)F 2230a_100015191253_100000230114 [1,1,0,0,0,0|2,0,0]=4 5871 B13R1.6 C=CCCNCc1cccc(c1)F 270004a_100015191253_100000210812 [1,1,0,0,0,0|2,0,0]=4 5872 B13R1.6 C=CCCNCc1cccc(c1)F 34a_100000174948_100000754431 [1,1,0,0,0,0|2,0,0]=4 5873 B13R1.6 C=CCCNCc1cccc(c1)I 207a_100015191253_100000014684 [1,1,0,0,0,0|2,0,0]=4 5874 B13R1.6 C=CCCNCc1cccc(c1)I 2230a_100000106179_100000754431 [1,1,0,0,0,0|2,0,0]=4 5875 B13R1.6 C=CCCNCc1cccc(c1)I 2230a_100015191253_100011218688 [1,1,0,0,0,0|2,0,0]=4 5876 B13R1.6 C=CCCNCc1cccc(c1)I 270004a_100015191253_100000014684 [1,1,0,0,0,0|2,0,0]=4 5877 B13R1.6 C=CCCNCc1cccc(c1)I 34a_100000106179_100000754431 [1,1,0,0,0,0|2,0,0]=4 5878 B13R1.6 C=CCCNCc1cccc(c1)O 207a_100015191253_100000188321 [1,1,0,0,0,0|2,0,0]=4 5879 B13R1.6 C=CCCNCc1cccc(c1)O 2230a_100000743036_100000754431 [1,1,0,0,0,0|2,0,0]=4 5880 B13R1.6 C=CCCNCc1cccc(c1)O 2230a_100015191253_100011660834 [1,1,0,0,0,0|2,0,0]=4 5881 B13R1.6 C=CCCNCc1cccc(c1)O 270004a_100015191253_100000188321 [1,1,0,0,0,0|2,0,0]=4 5882 B13R1.6 C=CCCNCc1cccc(c1)O 34a_100000743036_100000754431 [1,1,0,0,0,0|2,0,0]=4 5883 B13R1.6 C=CCCOCc1cccc(c1)Br 34a_100000687537_100000754431 [1,1,0,0,0,0|2,0,0]=4 5884 B13R1.6 C=CCCOCc1cccc(c1)Br 34a_100011205117_100000698116 [1,1,0,0,0,0|2,0,0]=4 5885 B13R1.6 C=CCCOCc1cccc(c1)Br 7a_100000687537_100000754431 [1,1,0,0,0,0|2,0,0]=4 5886 B13R1.6 C=CCCOCc1cccc(c1)C 34a_100011205117_100000211840 [1,1,0,0,0,0|2,0,0]=4 5887 B13R1.6 C=CCCOCc1cccc(c1)C 34a_100011217746_100000754431 [1,1,0,0,0,0|2,0,0]=4 5888 B13R1.6 C=CCCOCc1cccc(c1)C 7a_100011217746_100000754431 [1,1,0,0,0,0|2,0,0]=4 5889 B13R1.6 C=CCCOCc1cccc(c1)Cl 34a_100000241301_100000754431 [1,1,0,0,0,0|2,0,0]=4 5890 B13R1.6 C=CCCOCc1cccc(c1)Cl 34a_100011205117_100000187163 [1,1,0,0,0,0|2,0,0]=4 5891 B13R1.6 C=CCCOCc1cccc(c1)Cl 7a_100000241301_100000754431 [1,1,0,0,0,0|2,0,0]=4 5892 B13R1.6 C=CCCOCc1cccc(c1)F 34a_100000210976_100000754431 [1,1,0,0,0,0|2,0,0]=4 5893 B13R1.6 C=CCCOCc1cccc(c1)F 34a_100011205117_100000187166 [1,1,0,0,0,0|2,0,0]=4 5894 B13R1.6 C=CCCOCc1cccc(c1)F 7a_100000210976_100000754431 [1,1,0,0,0,0|2,0,0]=4 5895 B13R1.6 C=CCCOCc1cccc(c1)I 34a_100011205117_100011218688 [1,1,0,0,0,0|2,0,0]=4 5896 B13R1.6 C=CCCOCc1cccc(c1)I 34a_100011215336_100000754431 [1,1,0,0,0,0|2,0,0]=4 5897 B13R1.6 C=CCCOCc1cccc(c1)I 7a_100011215336_100000754431 [1,1,0,0,0,0|2,0,0]=4 5898 B13R1.6 C=CCCOCc1cccc(c1)N 34a_100000211919_100000754431 [1,1,0,0,0,0|2,0,0]=4 5899 B13R1.6 C=CCCOCc1cccc(c1)O 34a_100011205117_100011660834 [1,1,0,0,0,0|2,0,0]=4 5900 B13R1.6 C=CCCSCc1cccc(c1)Br 62a_100000211773_100000754431 [1,1,0,0,0,0|2,0,0]=4 5901 B13R1.6 C=CCCSCc1cccc(c1)Br 62a_100000754431_100000211773 [1,1,0,0,0,0|2,0,0]=4 5902 B13R1.6 C=CCCSCc1cccc(c1)C 62a_100000211840_100000754431 [1,1,0,0,0,0|2,0,0]=4 5903 B13R1.6 C=CCCSCc1cccc(c1)C 62a_100000754431_100000211840 [1,1,0,0,0,0|2,0,0]=4 5904 B13R1.6 C=CCCSCc1cccc(c1)Cl 62a_100000187163_100000754431 [1,1,0,0,0,0|2,0,0]=4 5905 B13R1.6 C=CCCSCc1cccc(c1)Cl 62a_100000754431_100000187163 [1,1,0,0,0,0|2,0,0]=4 5906 B13R1.6 C=CCCSCc1cccc(c1)F 62a_100000230114_100000754431 [1,1,0,0,0,0|2,0,0]=4 5907 B13R1.6 C=CCCSCc1cccc(c1)F 62a_100000754431_100000230114 [1,1,0,0,0,0|2,0,0]=4 5908 B13R1.6 C=CCCSCc1cccc(c1)I 62a_100000754431_100011218688 [1,1,0,0,0,0|2,0,0]=4 5909 B13R1.6 C=CCCSCc1cccc(c1)I 62a_100011218688_100000754431 [1,1,0,0,0,0|2,0,0]=4 5910 B13R1.6 C=CCCSCc1cccc(c1)O 62a_100000754431_100011660834 [1,1,0,0,0,0|2,0,0]=4 5911 B13R1.6 C=CCCSCc1cccc(c1)O 62a_100011660834_100000754431 [1,1,0,0,0,0|2,0,0]=4 5912 B13R1.6 C=CCNCCc1cccc(c1)Br 2230a_100011207229_100000210623 [1,1,0,0,0,0|2,0,0]=4 5913 B13R1.6 C=CCNCCc1cccc(c1)Br 2230a_100020586998_100011740638 [1,1,0,0,0,0|2,0,0]=4 5914 B13R1.6 C=CCNCCc1cccc(c1)Br 34a_100011207229_100015514636 [1,1,0,0,0,0|2,0,0]=4 5915 B13R1.6 C=CCNCCc1cccc(c1)C 2230a_100000749837_100000210623 [1,1,0,0,0,0|2,0,0]=4 5916 B13R1.6 C=CCNCCc1cccc(c1)C 2230a_100020586998_100011713685 [1,1,0,0,0,0|2,0,0]=4 5917 B13R1.6 C=CCNCCc1cccc(c1)C 34a_100000749837_100015514636 [1,1,0,0,0,0|2,0,0]=4 5918 B13R1.6 C=CCNCCc1cccc(c1)Cl 2230a_100000185263_100000210623 [1,1,0,0,0,0|2,0,0]=4 5919 B13R1.6 C=CCNCCc1cccc(c1)Cl 2230a_100020586998_100011713710 [1,1,0,0,0,0|2,0,0]=4 5920 B13R1.6 C=CCNCCc1cccc(c1)Cl 34a_100000185263_100015514636 [1,1,0,0,0,0|2,0,0]=4 5921 B13R1.6 C=CCNCCc1cccc(c1)F 2230a_100000205154_100000210623 [1,1,0,0,0,0|2,0,0]=4 5922 B13R1.6 C=CCNCCc1cccc(c1)F 2230a_100020586998_100011217235 [1,1,0,0,0,0|2,0,0]=4 5923 B13R1.6 C=CCNCCc1cccc(c1)F 34a_100000205154_100015514636 [1,1,0,0,0,0|2,0,0]=4 5924 B13R1.6 C=CCNCCc1cccc(c1)O 2230a_100000747277_100000210623 [1,1,0,0,0,0|2,0,0]=4 5925 B13R1.6 C=CCNCCc1cccc(c1)O 34a_100000747277_100015514636 [1,1,0,0,0,0|2,0,0]=4 5926 B13R1.6 C=CCOCCc1cccc(c1)Br 34a_100011217444_100015514636 [1,1,0,0,0,0|2,0,0]=4 5927 B13R1.6 C=CCOCCc1cccc(c1)Br 34a_200000210373_100011740638 [1,1,0,0,0,0|2,0,0]=4 5928 B13R1.6 C=CCOCCc1cccc(c1)Br 7a_100011217444_100015514636 [1,1,0,0,0,0|2,0,0]=4 5929 B13R1.6 C=CCOCCc1cccc(c1)C 34a_100011217157_100015514636 [1,1,0,0,0,0|2,0,0]=4 5930 B13R1.6 C=CCOCCc1cccc(c1)C 34a_200000210373_100011713685 [1,1,0,0,0,0|2,0,0]=4 5931 B13R1.6 C=CCOCCc1cccc(c1)C 7a_100011217157_100015514636 [1,1,0,0,0,0|2,0,0]=4 5932 B13R1.6 C=CCOCCc1cccc(c1)Cl 34a_100000754733_100015514636 [1,1,0,0,0,0|2,0,0]=4 5933 B13R1.6 C=CCOCCc1cccc(c1)Cl 34a_200000210373_100011713710 [1,1,0,0,0,0|2,0,0]=4 5934 B13R1.6 C=CCOCCc1cccc(c1)Cl 7a_100000754733_100015514636 [1,1,0,0,0,0|2,0,0]=4 5935 B13R1.6 C=CCOCCc1cccc(c1)F 34a_100000763591_100015514636 [1,1,0,0,0,0|2,0,0]=4 5936 B13R1.6 C=CCOCCc1cccc(c1)F 34a_200000210373_100011217235 [1,1,0,0,0,0|2,0,0]=4 5937 B13R1.6 C=CCOCCc1cccc(c1)F 7a_100000763591_100015514636 [1,1,0,0,0,0|2,0,0]=4 5938 B13R1.6 C=CCOCCc1cccc(c1)N 34a_100011996697_100015514636 [1,1,0,0,0,0|2,0,0]=4 5939 B13R1.6 C=CCSCCc1cccc(c1)Br 62a_100000210623_100011740638 [1,1,0,0,0,0|2,0,0]=4 5940 B13R1.6 C=CCSCCc1cccc(c1)Br 62a_100011740638_100000210623 [1,1,0,0,0,0|2,0,0]=4 5941 B13R1.6 C=CCSCCc1cccc(c1)C 62a_100000210623_100011713685 [1,1,0,0,0,0|2,0,0]=4 5942 B13R1.6 C=CCSCCc1cccc(c1)C 62a_100011713685_100000210623 [1,1,0,0,0,0|2,0,0]=4 5943 B13R1.6 C=CCSCCc1cccc(c1)Cl 62a_100000210623_100011713710 [1,1,0,0,0,0|2,0,0]=4 5944 B13R1.6 C=CCSCCc1cccc(c1)Cl 62a_100011713710_100000210623 [1,1,0,0,0,0|2,0,0]=4 5945 B13R1.6 C=CCSCCc1cccc(c1)F 62a_100000210623_100011217235 [1,1,0,0,0,0|2,0,0]=4 5946 B13R1.6 C=CCSCCc1cccc(c1)F 62a_100011217235_100000210623 [1,1,0,0,0,0|2,0,0]=4 5947 B13R1.6 CCCCCCc1cccc(c1)O 271570a_203496583355_100009816010 [1,1,0,0,0,0|1,0,1]=4 5948 B13R1.6 C[n+]1cccc(c1)SCCCC=O 62a_100009996589_200011292268 [1,1,0,0,0,0|2,0,0]=4 5949 B13R1.6 C[n+]1cccc(c1)SCCCC=O 62a_200011292268_100009996589 [1,1,0,0,0,0|2,0,0]=4 5950 B13R1.6 Cc1cc(ccn1)SCCCC=O 62a_100000758586_200011292268 [1,1,0,0,0,0|2,0,0]=4 5951 B13R1.6 Cc1cc(ccn1)SCCCC=O 62a_200011292268_100000758586 [1,1,0,0,0,0|2,0,0]=4 5952 B13R1.6 Cc1cccc(c1)CCNCC=O 2230a_100000749837_200015260668 [1,1,0,0,0,0|1,0,0]=3 5953 B13R1.6 Cc1cccc(c1)CCNCC=O 34a_100000749837_200009817547 [1,1,0,0,0,0|1,0,0]=3 5954 B13R1.6 Cc1cccc(c1)CCNCCO 2230a_100000749837_100000211926 [1,1,0,0,0,0|1,0,1]=4 5955 B13R1.6 Cc1cccc(c1)CCNCCO 2230a_100016997473_100011713685 [1,1,0,0,0,0|1,0,1]=4 5956 B13R1.6 Cc1cccc(c1)CCNCCO 34a_100000749837_100000211926 [1,1,0,0,0,0|1,0,1]=4 5957 B13R1.6 Cc1cccc(c1)CCNCCO 34a_100016990907_100011713685 [1,1,0,0,0,0|1,0,1]=4 5958 B13R1.6 Cc1cccc(c1)CCOCC=O 34a_100011217157_200009817547 [1,1,0,0,0,0|1,0,0]=3 5959 B13R1.6 Cc1cccc(c1)CCOCC=O 7a_100011217157_200015260668 [1,1,0,0,0,0|1,0,0]=3 5960 B13R1.6 Cc1cccc(c1)CCOCCO 34a_100011217157_100000211926 [1,1,0,0,0,0|1,0,1]=4 5961 B13R1.6 Cc1cccc(c1)CCOCCO 7a_100011217157_100000211926 [1,1,0,0,0,0|1,0,1]=4 5962 B13R1.6 Cc1cccc(c1)CCSCC=O 62a_100011713685_200015260668 [1,1,0,0,0,0|1,0,0]=3 5963 B13R1.6 Cc1cccc(c1)CCSCC=O 62a_200015260668_100011713685 [1,1,0,0,0,0|1,0,0]=3 5964 B13R1.6 Cc1cccc(c1)CCSCCO 62a_100000211926_100011713685 [1,1,0,0,0,0|1,0,1]=4 5965 B13R1.6 Cc1cccc(c1)CCSCCO 62a_100011713685_100000211926 [1,1,0,0,0,0|1,0,1]=4 5966 B13R1.6 Cc1cccc(c1)CNCCCO 207a_100000182051_100000211157 [1,1,0,0,0,0|1,0,1]=4 5967 B13R1.6 Cc1cccc(c1)CNCCCO 2230a_100000185548_100000230001 [1,1,0,0,0,0|1,0,1]=4 5968 B13R1.6 Cc1cccc(c1)CNCCCO 270004a_100000182051_100000211157 [1,1,0,0,0,0|1,0,1]=4 5969 B13R1.6 Cc1cccc(c1)CNCCCO 34a_100000185548_100000230001 [1,1,0,0,0,0|1,0,1]=4 5970 B13R1.6 Cc1cccc(c1)COCCCO 34a_100011217746_100000230001 [1,1,0,0,0,0|1,0,1]=4 5971 B13R1.6 Cc1cccc(c1)COCCCO 7a_100011217746_100011215043 [1,1,0,0,0,0|1,0,1]=4 5972 B13R1.6 Cc1cccc(c1)CSCCCO 62a_100000211840_100011215043 [1,1,0,0,0,0|1,0,1]=4 5973 B13R1.6 Cc1cccc(c1)CSCCCO 62a_100011215043_100000211840 [1,1,0,0,0,0|1,0,1]=4 5974 B13R1.6 Cc1cccc(c1)NCCCC=O 2230a_100000188690_200011292268 [1,1,0,0,0,0|1,0,0]=3 5975 B13R1.6 Cc1cccc(c1)NCCCCO 2230a_100000188690_100000210776 [1,1,0,0,0,0|1,0,1]=4 5976 B13R1.6 Cc1cccc(c1)NCCCCO 34a_100000188690_100011216708 [1,1,0,0,0,0|1,0,1]=4 5977 B13R1.6 Cc1cccc(c1)OCCCC=O 7a_100000210337_200011292268 [1,1,0,0,0,0|1,0,0]=3 5978 B13R1.6 Cc1cccc(c1)OCCCCO 34a_100000210337_100011216708 [1,1,0,0,0,0|1,0,1]=4 5979 B13R1.6 Cc1cccc(c1)OCCCCO 7a_100000210337_100000210776 [1,1,0,0,0,0|1,0,1]=4 5980 B13R1.6 Cc1cccc(c1)SCCCC=O 62a_100011215228_200011292268 [1,1,0,0,0,0|1,0,0]=3 5981 B13R1.6 Cc1cccc(c1)SCCCC=O 62a_200011292268_100011215228 [1,1,0,0,0,0|1,0,0]=3 5982 B13R1.6 Cc1cccc(c1)SCCCCO 62a_100000210776_100011215228 [1,1,0,0,0,0|1,0,1]=4 5983 B13R1.6 Cc1cccc(c1)SCCCCO 62a_100011215228_100000210776 [1,1,0,0,0,0|1,0,1]=4 5984 B13R1.6 Cc1cccc(n1)CCNCC=O 2230a_100011824523_200015260668 [1,1,0,0,0,0|2,0,0]=4 5985 B13R1.6 Cc1cccc(n1)CCNCC=O 34a_100011824523_200009817547 [1,1,0,0,0,0|2,0,0]=4 5986 B13R1.6 Cc1cccc(n1)SCCCC=O 62a_100000742759_200011292268 [1,1,0,0,0,0|2,0,0]=4 5987 B13R1.6 Cc1cccc(n1)SCCCC=O 62a_200011292268_100000742759 [1,1,0,0,0,0|2,0,0]=4 5988 B13R1.6 Cc1ccnc(c1)SCCCC=O 62a_100000750283_200011292268 [1,1,0,0,0,0|2,0,0]=4 5989 B13R1.6 Cc1ccnc(c1)SCCCC=O 62a_200011292268_100000750283 [1,1,0,0,0,0|2,0,0]=4 5990 B13R1.6 Cc1cncc(c1)OCCCC=O 7a_100011830280_200011292268 [1,1,0,0,0,0|2,0,0]=4 5991 B13R1.6 Cc1cncc(c1)SCCCC=O 62a_100000760492_200011292268 [1,1,0,0,0,0|2,0,0]=4 5992 B13R1.6 Cc1cncc(c1)SCCCC=O 62a_200011292268_100000760492 [1,1,0,0,0,0|2,0,0]=4 5993 B13R1.6 Nc1cc(ccn1)SCCCC=O 62a_100000049665_200011292268 [1,1,0,0,0,0|2,0,0]=4 5994 B13R1.6 Nc1cc(ccn1)SCCCC=O 62a_200011292268_100000049665 [1,1,0,0,0,0|2,0,0]=4 5995 B13R1.6 Nc1cccc(c1)CCOCC=O 34a_100011996697_200009817547 [1,1,0,0,0,0|1,0,0]=3 5996 B13R1.6 Nc1cccc(c1)CCOCCO 34a_100011996697_100000211926 [1,1,0,0,0,0|1,0,1]=4 5997 B13R1.6 Nc1cccc(c1)COCCCO 34a_100000211919_100000230001 [1,1,0,0,0,0|1,0,1]=4 5998 B13R1.6 Nc1cccc(c1)OCCCCO 34a_100000210217_100011216708 [1,1,0,0,0,0|1,0,1]=4 5999 B13R1.6 Nc1cccc(c1)SCCCC=O 62a_100000210019_200011292268 [1,1,0,0,0,0|1,0,0]=3 6000 B13R1.6 Nc1cccc(c1)SCCCC=O 62a_200011292268_100000210019 [1,1,0,0,0,0|1,0,0]=3 6001 B13R1.6 Nc1cccc(c1)SCCCCO 62a_100000210019_100000210776 [1,1,0,0,0,0|1,0,1]=4 6002 B13R1.6 Nc1cccc(c1)SCCCCO 62a_100000210776_100000210019 [1,1,0,0,0,0|1,0,1]=4 6003 B13R1.6 Nc1cccc(n1)SCCCC=O 62a_100000740741_200011292268 [1,1,0,0,0,0|2,0,0]=4 6004 B13R1.6 Nc1cccc(n1)SCCCC=O 62a_200011292268_100000740741 [1,1,0,0,0,0|2,0,0]=4 6005 B13R1.6 Nc1ccnc(c1)SCCCC=O 62a_100009814236_200011292268 [1,1,0,0,0,0|2,0,0]=4 6006 B13R1.6 Nc1ccnc(c1)SCCCC=O 62a_200011292268_100009814236 [1,1,0,0,0,0|2,0,0]=4 6007 B13R1.6 Nc1cncc(c1)SCCCC=O 62a_100000687067_200011292268 [1,1,0,0,0,0|2,0,0]=4 6008 B13R1.6 Nc1cncc(c1)SCCCC=O 62a_200011292268_100000687067 [1,1,0,0,0,0|2,0,0]=4 6009 B13R1.6 O=CCCCOc1ccc[n+](c1)[O-] 7a_100000039713_200011292268 [1,1,0,0,0,0|2,0,0]=4 6010 B13R1.6 O=CCCCOc1cccc(c1)Br 7a_100000210342_200011292268 [1,1,0,0,0,0|1,0,0]=3 6011 B13R1.6 O=CCCCOc1cccc(c1)Cl 7a_100000210295_200011292268 [1,1,0,0,0,0|1,0,0]=3 6012 B13R1.6 O=CCCCOc1cccc(c1)F 7a_100000210426_200011292268 [1,1,0,0,0,0|1,0,0]=3 6013 B13R1.6 O=CCCCOc1cccc(c1)I 7a_100000211634_200011292268 [1,1,0,0,0,0|1,0,0]=3 6014 B13R1.6 O=CCCCOc1cncc(c1)Br 7a_100000754920_200011292268 [1,1,0,0,0,0|2,0,0]=4 6015 B13R1.6 O=CCCCOc1cncc(c1)Cl 7a_100000032511_200011292268 [1,1,0,0,0,0|2,0,0]=4 6016 B13R1.6 O=CCCCOc1cncc(c1)F 7a_100011830296_200011292268 [1,1,0,0,0,0|2,0,0]=4 6017 B13R1.6 O=CCCCSc1cc(=O)cc[nH]1 62a_100009817434_200011292268 [1,1,0,0,0,0|2,0,0]=4 6018 B13R1.6 O=CCCCSc1cc(ccn1)Cl 62a_100010167805_200011292268 [1,1,0,0,0,0|2,0,0]=4 6019 B13R1.6 O=CCCCSc1cc(ccn1)Cl 62a_200011292268_100010167805 [1,1,0,0,0,0|2,0,0]=4 6020 B13R1.6 O=CCCCSc1cc(ccn1)F 62a_100000764206_200011292268 [1,1,0,0,0,0|2,0,0]=4 6021 B13R1.6 O=CCCCSc1cc(ccn1)F 62a_200011292268_100000764206 [1,1,0,0,0,0|2,0,0]=4 6022 B13R1.6 O=CCCCSc1cc(ccn1)O 62a_200011292268_100000762945 [1,1,0,0,0,0|2,0,0]=4 6023 B13R1.6 O=CCCCSc1cc[nH]c(=O)c1 62a_100009816521_200011292268 [1,1,0,0,0,0|2,0,0]=4 6024 B13R1.6 O=CCCCSc1cc[nH]c(=O)c1 62a_200011292268_100009816521 [1,1,0,0,0,0|2,0,0]=4 6025 B13R1.6 O=CCCCSc1ccc[n+](c1)[O-] 62a_200011292268_100009815978 [1,1,0,0,0,0|2,0,0]=4 6026 B13R1.6 O=CCCCSc1cccc(=O)[nH]1 62a_200011292268_100000752884 [1,1,0,0,0,0|2,0,0]=4 6027 B13R1.6 O=CCCCSc1cccc(c1)Br 62a_100000691529_200011292268 [1,1,0,0,0,0|1,0,0]=3 6028 B13R1.6 O=CCCCSc1cccc(c1)Br 62a_200011292268_100000691529 [1,1,0,0,0,0|1,0,0]=3 6029 B13R1.6 O=CCCCSc1cccc(c1)Cl 62a_100000699651_200011292268 [1,1,0,0,0,0|1,0,0]=3 6030 B13R1.6 O=CCCCSc1cccc(c1)Cl 62a_200011292268_100000699651 [1,1,0,0,0,0|1,0,0]=3 6031 B13R1.6 O=CCCCSc1cccc(c1)F 62a_100000685547_200011292268 [1,1,0,0,0,0|1,0,0]=3 6032 B13R1.6 O=CCCCSc1cccc(c1)F 62a_200011292268_100000685547 [1,1,0,0,0,0|1,0,0]=3 6033 B13R1.6 O=CCCCSc1cccc(c1)O 62a_200011292268_100000211634 [1,1,0,0,0,0|1,0,0]=3 6034 B13R1.6 O=CCCCSc1cccc(c1)[S] 62a_114929384022_200011292268 [1,1,0,0,0,0|1,0,0]=3 6035 B13R1.6 O=CCCCSc1cccc(c1)[S] 62a_200011292268_114929384022 [1,1,0,0,0,0|1,0,0]=3 6036 B13R1.6 O=CCCCSc1cccc(n1)Br 62a_100000684672_200011292268 [1,1,0,0,0,0|2,0,0]=4 6037 B13R1.6 O=CCCCSc1cccc(n1)Br 62a_200011292268_100000684672 [1,1,0,0,0,0|2,0,0]=4 6038 B13R1.6 O=CCCCSc1cccc(n1)Cl 62a_100000051397_200011292268 [1,1,0,0,0,0|2,0,0]=4 6039 B13R1.6 O=CCCCSc1cccc(n1)Cl 62a_200011292268_100000051397 [1,1,0,0,0,0|2,0,0]=4 6040 B13R1.6 O=CCCCSc1cccc(n1)F 62a_100009815982_200011292268 [1,1,0,0,0,0|2,0,0]=4 6041 B13R1.6 O=CCCCSc1cccc(n1)F 62a_200011292268_100009815982 [1,1,0,0,0,0|2,0,0]=4 6042 B13R1.6 O=CCCCSc1ccnc(c1)Br 62a_100009814637_200011292268 [1,1,0,0,0,0|2,0,0]=4 6043 B13R1.6 O=CCCCSc1ccnc(c1)Br 62a_200011292268_100009814637 [1,1,0,0,0,0|2,0,0]=4 6044 B13R1.6 O=CCCCSc1ccnc(c1)Cl 62a_100000035001_200011292268 [1,1,0,0,0,0|2,0,0]=4 6045 B13R1.6 O=CCCCSc1ccnc(c1)Cl 62a_200011292268_100000035001 [1,1,0,0,0,0|2,0,0]=4 6046 B13R1.6 O=CCCCSc1ccnc(c1)F 62a_100009816116_200011292268 [1,1,0,0,0,0|2,0,0]=4 6047 B13R1.6 O=CCCCSc1ccnc(c1)F 62a_200011292268_100009816116 [1,1,0,0,0,0|2,0,0]=4 6048 B13R1.6 O=CCCCSc1cncc(c1)Br 62a_100000728054_200011292268 [1,1,0,0,0,0|2,0,0]=4 6049 B13R1.6 O=CCCCSc1cncc(c1)Br 62a_200011292268_100000728054 [1,1,0,0,0,0|2,0,0]=4 6050 B13R1.6 O=CCCCSc1cncc(c1)Cl 62a_100000049639_200011292268 [1,1,0,0,0,0|2,0,0]=4 6051 B13R1.6 O=CCCCSc1cncc(c1)Cl 62a_200011292268_100000049639 [1,1,0,0,0,0|2,0,0]=4 6052 B13R1.6 O=CCCCSc1cncc(c1)F 62a_100000744099_200011292268 [1,1,0,0,0,0|2,0,0]=4 6053 B13R1.6 O=CCCCSc1cncc(c1)F 62a_200011292268_100000744099 [1,1,0,0,0,0|2,0,0]=4 6054 B13R1.6 O=CCCCSc1cncc(c1)O 62a_100000754920_200011292268 [1,1,0,0,0,0|2,0,0]=4 6055 B13R1.6 O=CCCCSc1cncc(c1)O 62a_200011292268_100000754920 [1,1,0,0,0,0|2,0,0]=4 6056 B13R1.6 O=CCNCCc1cccc(c1)Br 2230a_100011207229_200015260668 [1,1,0,0,0,0|1,0,0]=3 6057 B13R1.6 O=CCNCCc1cccc(c1)Br 34a_100011207229_200009817547 [1,1,0,0,0,0|1,0,0]=3 6058 B13R1.6 O=CCNCCc1cccc(c1)Cl 2230a_100000185263_200015260668 [1,1,0,0,0,0|1,0,0]=3 6059 B13R1.6 O=CCNCCc1cccc(c1)Cl 34a_100000185263_200009817547 [1,1,0,0,0,0|1,0,0]=3 6060 B13R1.6 O=CCNCCc1cccc(c1)F 2230a_100000205154_200015260668 [1,1,0,0,0,0|1,0,0]=3 6061 B13R1.6 O=CCNCCc1cccc(c1)F 34a_100000205154_200009817547 [1,1,0,0,0,0|1,0,0]=3 6062 B13R1.6 O=CCNCCc1cccc(c1)O 2230a_100000747277_200015260668 [1,1,0,0,0,0|1,0,0]=3 6063 B13R1.6 O=CCNCCc1cccc(c1)O 34a_100000747277_200009817547 [1,1,0,0,0,0|1,0,0]=3 6064 B13R1.6 O=CCOCCc1cccc(c1)Br 34a_100011217444_200009817547 [1,1,0,0,0,0|1,0,0]=3 6065 B13R1.6 O=CCOCCc1cccc(c1)Br 7a_100011217444_200015260668 [1,1,0,0,0,0|1,0,0]=3 6066 B13R1.6 O=CCOCCc1cccc(c1)Cl 34a_100000754733_200009817547 [1,1,0,0,0,0|1,0,0]=3 6067 B13R1.6 O=CCOCCc1cccc(c1)Cl 7a_100000754733_200015260668 [1,1,0,0,0,0|1,0,0]=3 6068 B13R1.6 O=CCOCCc1cccc(c1)F 34a_100000763591_200009817547 [1,1,0,0,0,0|1,0,0]=3 6069 B13R1.6 O=CCOCCc1cccc(c1)F 7a_100000763591_200015260668 [1,1,0,0,0,0|1,0,0]=3 6070 B13R1.6 O=CCOCCc1cccc(n1)Br 34a_100010221043_200009817547 [1,1,0,0,0,0|2,0,0]=4 6071 B13R1.6 O=CCOCCc1cccc(n1)Br 7a_100010221043_200015260668 [1,1,0,0,0,0|2,0,0]=4 6072 B13R1.6 O=CCSCCc1cccc(c1)Br 62a_100011740638_200015260668 [1,1,0,0,0,0|1,0,0]=3 6073 B13R1.6 O=CCSCCc1cccc(c1)Br 62a_200015260668_100011740638 [1,1,0,0,0,0|1,0,0]=3 6074 B13R1.6 O=CCSCCc1cccc(c1)Cl 62a_100011713710_200015260668 [1,1,0,0,0,0|1,0,0]=3 6075 B13R1.6 O=CCSCCc1cccc(c1)Cl 62a_200015260668_100011713710 [1,1,0,0,0,0|1,0,0]=3 6076 B13R1.6 O=CCSCCc1cccc(c1)F 62a_100011217235_200015260668 [1,1,0,0,0,0|1,0,0]=3 6077 B13R1.6 O=CCSCCc1cccc(c1)F 62a_200015260668_100011217235 [1,1,0,0,0,0|1,0,0]=3 6078 B13R1.6 OCCCCNc1cccc(c1)Br 34a_100000210019_100011216708 [1,1,0,0,0,0|1,0,1]=4 6079 B13R1.6 OCCCCNc1cccc(c1)Cl 34a_100000185859_100011216708 [1,1,0,0,0,0|1,0,1]=4 6080 B13R1.6 OCCCCNc1cccc(c1)F 34a_100000210047_100011216708 [1,1,0,0,0,0|1,0,1]=4 6081 B13R1.6 OCCCCNc1cccc(c1)I 34a_100000211102_100011216708 [1,1,0,0,0,0|1,0,1]=4 6082 B13R1.6 OCCCCNc1cccc(c1)O 34a_100000210217_100011216708 [1,1,0,0,0,0|1,0,1]=4 6083 B13R1.6 OCCCCOc1cccc(c1)Br 34a_100000210342_100011216708 [1,1,0,0,0,0|1,0,1]=4 6084 B13R1.6 OCCCCOc1cccc(c1)Br 7a_100000210342_100000210776 [1,1,0,0,0,0|1,0,1]=4 6085 B13R1.6 OCCCCOc1cccc(c1)Cl 34a_100000210295_100011216708 [1,1,0,0,0,0|1,0,1]=4 6086 B13R1.6 OCCCCOc1cccc(c1)Cl 7a_100000210295_100000210776 [1,1,0,0,0,0|1,0,1]=4 6087 B13R1.6 OCCCCOc1cccc(c1)F 34a_100000210426_100011216708 [1,1,0,0,0,0|1,0,1]=4 6088 B13R1.6 OCCCCOc1cccc(c1)F 7a_100000210426_100000210776 [1,1,0,0,0,0|1,0,1]=4 6089 B13R1.6 OCCCCOc1cccc(c1)I 34a_100000211634_100011216708 [1,1,0,0,0,0|1,0,1]=4 6090 B13R1.6 OCCCCOc1cccc(c1)I 7a_100000211634_100000210776 [1,1,0,0,0,0|1,0,1]=4 6091 B13R1.6 OCCCCSc1cccc(c1)Br 62a_100000210776_100000691529 [1,1,0,0,0,0|1,0,1]=4 6092 B13R1.6 OCCCCSc1cccc(c1)Br 62a_100000691529_100000210776 [1,1,0,0,0,0|1,0,1]=4 6093 B13R1.6 OCCCCSc1cccc(c1)Cl 62a_100000210776_100000699651 [1,1,0,0,0,0|1,0,1]=4 6094 B13R1.6 OCCCCSc1cccc(c1)Cl 62a_100000699651_100000210776 [1,1,0,0,0,0|1,0,1]=4 6095 B13R1.6 OCCCCSc1cccc(c1)F 62a_100000210776_100000685547 [1,1,0,0,0,0|1,0,1]=4 6096 B13R1.6 OCCCCSc1cccc(c1)F 62a_100000685547_100000210776 [1,1,0,0,0,0|1,0,1]=4 6097 B13R1.6 OCCCCSc1cccc(c1)O 62a_100000210776_100000211634 [1,1,0,0,0,0|1,0,1]=4 6098 B13R1.6 OCCCCSc1cccc(c1)[S] 62a_100000210776_114929384022 [1,1,0,0,0,0|1,0,1]=4 6099 B13R1.6 OCCCCSc1cccc(c1)[S] 62a_114929384022_100000210776 [1,1,0,0,0,0|1,0,1]=4 6100 B13R1.6 OCCCNCc1cccc(c1)Br 207a_100000182051_100000210085 [1,1,0,0,0,0|1,0,1]=4 6101 B13R1.6 OCCCNCc1cccc(c1)Br 2230a_100000174977_100000230001 [1,1,0,0,0,0|1,0,1]=4 6102 B13R1.6 OCCCNCc1cccc(c1)Br 270004a_100000182051_100000210085 [1,1,0,0,0,0|1,0,1]=4 6103 B13R1.6 OCCCNCc1cccc(c1)Br 34a_100000174977_100000230001 [1,1,0,0,0,0|1,0,1]=4 6104 B13R1.6 OCCCNCc1cccc(c1)Cl 207a_100000182051_100000210801 [1,1,0,0,0,0|1,0,1]=4 6105 B13R1.6 OCCCNCc1cccc(c1)Cl 2230a_100000174878_100000230001 [1,1,0,0,0,0|1,0,1]=4 6106 B13R1.6 OCCCNCc1cccc(c1)Cl 270004a_100000182051_100000210801 [1,1,0,0,0,0|1,0,1]=4 6107 B13R1.6 OCCCNCc1cccc(c1)Cl 34a_100000174878_100000230001 [1,1,0,0,0,0|1,0,1]=4 6108 B13R1.6 OCCCNCc1cccc(c1)F 207a_100000182051_100000210812 [1,1,0,0,0,0|1,0,1]=4 6109 B13R1.6 OCCCNCc1cccc(c1)F 2230a_100000174948_100000230001 [1,1,0,0,0,0|1,0,1]=4 6110 B13R1.6 OCCCNCc1cccc(c1)F 270004a_100000182051_100000210812 [1,1,0,0,0,0|1,0,1]=4 6111 B13R1.6 OCCCNCc1cccc(c1)F 34a_100000174948_100000230001 [1,1,0,0,0,0|1,0,1]=4 6112 B13R1.6 OCCCNCc1cccc(c1)I 207a_100000182051_100000014684 [1,1,0,0,0,0|1,0,1]=4 6113 B13R1.6 OCCCNCc1cccc(c1)I 2230a_100000106179_100000230001 [1,1,0,0,0,0|1,0,1]=4 6114 B13R1.6 OCCCNCc1cccc(c1)I 270004a_100000182051_100000014684 [1,1,0,0,0,0|1,0,1]=4 6115 B13R1.6 OCCCNCc1cccc(c1)I 34a_100000106179_100000230001 [1,1,0,0,0,0|1,0,1]=4 6116 B13R1.6 OCCCNCc1cccc(c1)O 207a_100000182051_100000188321 [1,1,0,0,0,0|1,0,1]=4 6117 B13R1.6 OCCCNCc1cccc(c1)O 2230a_100000743036_100000230001 [1,1,0,0,0,0|1,0,1]=4 6118 B13R1.6 OCCCNCc1cccc(c1)O 270004a_100000182051_100000188321 [1,1,0,0,0,0|1,0,1]=4 6119 B13R1.6 OCCCNCc1cccc(c1)O 34a_100000743036_100000230001 [1,1,0,0,0,0|1,0,1]=4 6120 B13R1.6 OCCCOCc1cccc(c1)Br 34a_100000687537_100000230001 [1,1,0,0,0,0|1,0,1]=4 6121 B13R1.6 OCCCOCc1cccc(c1)Br 7a_100000687537_100011215043 [1,1,0,0,0,0|1,0,1]=4 6122 B13R1.6 OCCCOCc1cccc(c1)Cl 34a_100000241301_100000230001 [1,1,0,0,0,0|1,0,1]=4 6123 B13R1.6 OCCCOCc1cccc(c1)Cl 7a_100000241301_100011215043 [1,1,0,0,0,0|1,0,1]=4 6124 B13R1.6 OCCCOCc1cccc(c1)F 34a_100000210976_100000230001 [1,1,0,0,0,0|1,0,1]=4 6125 B13R1.6 OCCCOCc1cccc(c1)F 7a_100000210976_100011215043 [1,1,0,0,0,0|1,0,1]=4 6126 B13R1.6 OCCCOCc1cccc(c1)I 34a_100011215336_100000230001 [1,1,0,0,0,0|1,0,1]=4 6127 B13R1.6 OCCCOCc1cccc(c1)I 7a_100011215336_100011215043 [1,1,0,0,0,0|1,0,1]=4 6128 B13R1.6 OCCCSCc1cccc(c1)Br 62a_100000211773_100011215043 [1,1,0,0,0,0|1,0,1]=4 6129 B13R1.6 OCCCSCc1cccc(c1)Br 62a_100011215043_100000211773 [1,1,0,0,0,0|1,0,1]=4 6130 B13R1.6 OCCCSCc1cccc(c1)Cl 62a_100000187163_100011215043 [1,1,0,0,0,0|1,0,1]=4 6131 B13R1.6 OCCCSCc1cccc(c1)Cl 62a_100011215043_100000187163 [1,1,0,0,0,0|1,0,1]=4 6132 B13R1.6 OCCCSCc1cccc(c1)F 62a_100000230114_100011215043 [1,1,0,0,0,0|1,0,1]=4 6133 B13R1.6 OCCCSCc1cccc(c1)F 62a_100011215043_100000230114 [1,1,0,0,0,0|1,0,1]=4 6134 B13R1.6 OCCCSCc1cccc(c1)I 62a_100011215043_100011218688 [1,1,0,0,0,0|1,0,1]=4 6135 B13R1.6 OCCCSCc1cccc(c1)I 62a_100011218688_100011215043 [1,1,0,0,0,0|1,0,1]=4 6136 B13R1.6 OCCCSCc1cccc(c1)O 62a_100011215043_100011660834 [1,1,0,0,0,0|1,0,1]=4 6137 B13R1.6 OCCCSCc1cccc(c1)O 62a_100011660834_100011215043 [1,1,0,0,0,0|1,0,1]=4 6138 B13R1.6 OCCNCCc1cccc(c1)Br 2230a_100011207229_100000211926 [1,1,0,0,0,0|1,0,1]=4 6139 B13R1.6 OCCNCCc1cccc(c1)Br 2230a_100016997473_100011740638 [1,1,0,0,0,0|1,0,1]=4 6140 B13R1.6 OCCNCCc1cccc(c1)Br 34a_100011207229_100000211926 [1,1,0,0,0,0|1,0,1]=4 6141 B13R1.6 OCCNCCc1cccc(c1)Br 34a_100016990907_100011740638 [1,1,0,0,0,0|1,0,1]=4 6142 B13R1.6 OCCNCCc1cccc(c1)Cl 2230a_100000185263_100000211926 [1,1,0,0,0,0|1,0,1]=4 6143 B13R1.6 OCCNCCc1cccc(c1)Cl 2230a_100016997473_100011713710 [1,1,0,0,0,0|1,0,1]=4 6144 B13R1.6 OCCNCCc1cccc(c1)Cl 34a_100000185263_100000211926 [1,1,0,0,0,0|1,0,1]=4 6145 B13R1.6 OCCNCCc1cccc(c1)Cl 34a_100016990907_100011713710 [1,1,0,0,0,0|1,0,1]=4 6146 B13R1.6 OCCNCCc1cccc(c1)F 2230a_100000205154_100000211926 [1,1,0,0,0,0|1,0,1]=4 6147 B13R1.6 OCCNCCc1cccc(c1)F 2230a_100016997473_100011217235 [1,1,0,0,0,0|1,0,1]=4 6148 B13R1.6 OCCNCCc1cccc(c1)F 34a_100000205154_100000211926 [1,1,0,0,0,0|1,0,1]=4 6149 B13R1.6 OCCNCCc1cccc(c1)F 34a_100016990907_100011217235 [1,1,0,0,0,0|1,0,1]=4 6150 B13R1.6 OCCNCCc1cccc(c1)O 2230a_100000747277_100000211926 [1,1,0,0,0,0|1,0,1]=4 6151 B13R1.6 OCCNCCc1cccc(c1)O 34a_100000747277_100000211926 [1,1,0,0,0,0|1,0,1]=4 6152 B13R1.6 OCCOCCc1cccc(c1)Br 34a_100011217444_100000211926 [1,1,0,0,0,0|1,0,1]=4 6153 B13R1.6 OCCOCCc1cccc(c1)Br 7a_100011217444_100000211926 [1,1,0,0,0,0|1,0,1]=4 6154 B13R1.6 OCCOCCc1cccc(c1)Cl 34a_100000754733_100000211926 [1,1,0,0,0,0|1,0,1]=4 6155 B13R1.6 OCCOCCc1cccc(c1)Cl 7a_100000754733_100000211926 [1,1,0,0,0,0|1,0,1]=4 6156 B13R1.6 OCCOCCc1cccc(c1)F 34a_100000763591_100000211926 [1,1,0,0,0,0|1,0,1]=4 6157 B13R1.6 OCCOCCc1cccc(c1)F 7a_100000763591_100000211926 [1,1,0,0,0,0|1,0,1]=4 6158 B13R1.6 OCCSCCc1cccc(c1)Br 62a_100000211926_100011740638 [1,1,0,0,0,0|1,0,1]=4 6159 B13R1.6 OCCSCCc1cccc(c1)Br 62a_100011740638_100000211926 [1,1,0,0,0,0|1,0,1]=4 6160 B13R1.6 OCCSCCc1cccc(c1)Cl 62a_100000211926_100011713710 [1,1,0,0,0,0|1,0,1]=4 6161 B13R1.6 OCCSCCc1cccc(c1)Cl 62a_100011713710_100000211926 [1,1,0,0,0,0|1,0,1]=4 6162 B13R1.6 OCCSCCc1cccc(c1)F 62a_100000211926_100011217235 [1,1,0,0,0,0|1,0,1]=4 6163 B13R1.6 OCCSCCc1cccc(c1)F 62a_100011217235_100000211926 [1,1,0,0,0,0|1,0,1]=4 6164 B13R1.9 C=CCCCNc1ccc(cc1)Br 2230a_100000210018_100011713584 [1,1,0,0,0,0|2,0,0]=4 6165 B13R1.9 C=CCCCNc1ccc(cc1)Br 34a_100000210018_100000757094 [1,1,0,0,0,0|2,0,0]=4 6166 B13R1.9 C=CCCCNc1ccc(cc1)C 34a_100000124888_100000757094 [1,1,0,0,0,0|2,0,0]=4 6167 B13R1.9 C=CCCCNc1ccc(cc1)Cl 2230a_100000210052_100011713584 [1,1,0,0,0,0|2,0,0]=4 6168 B13R1.9 C=CCCCNc1ccc(cc1)Cl 34a_100000210052_100000757094 [1,1,0,0,0,0|2,0,0]=4 6169 B13R1.9 C=CCCCNc1ccc(cc1)F 34a_100000185862_100000757094 [1,1,0,0,0,0|2,0,0]=4 6170 B13R1.9 C=CCCCNc1ccc(cc1)I 34a_100000185761_100000757094 [1,1,0,0,0,0|2,0,0]=4 6171 B13R1.9 C=CCCCNc1ccc(cc1)O 34a_100000185829_100000757094 [1,1,0,0,0,0|2,0,0]=4 6172 B13R1.9 C=CCCCOc1ccc(cc1)Br 34a_100000185759_100000757094 [1,1,0,0,0,0|2,0,0]=4 6173 B13R1.9 C=CCCCOc1ccc(cc1)Br 7a_100000185759_100000757094 [1,1,0,0,0,0|2,0,0]=4 6174 B13R1.9 C=CCCCOc1ccc(cc1)C 34a_100000210336_100000757094 [1,1,0,0,0,0|2,0,0]=4 6175 B13R1.9 C=CCCCOc1ccc(cc1)C 7a_100000210336_100000757094 [1,1,0,0,0,0|2,0,0]=4 6176 B13R1.9 C=CCCCOc1ccc(cc1)Cl 34a_100000210216_100000757094 [1,1,0,0,0,0|2,0,0]=4 6177 B13R1.9 C=CCCCOc1ccc(cc1)Cl 7a_100000210216_100000757094 [1,1,0,0,0,0|2,0,0]=4 6178 B13R1.9 C=CCCCOc1ccc(cc1)F 34a_100000210339_100000757094 [1,1,0,0,0,0|2,0,0]=4 6179 B13R1.9 C=CCCCOc1ccc(cc1)I 34a_100000212066_100000757094 [1,1,0,0,0,0|2,0,0]=4 6180 B13R1.9 C=CCCCOc1ccc(cc1)I 7a_100000212066_100000757094 [1,1,0,0,0,0|2,0,0]=4 6181 B13R1.9 C=CCCCOc1ccc(cc1)N 34a_100000185829_100000757094 [1,1,0,0,0,0|2,0,0]=4 6182 B13R1.9 C=CCCCSc1ccc(cc1)Br 62a_100000752885_100000757094 [1,1,0,0,0,0|2,0,0]=4 6183 B13R1.9 C=CCCCSc1ccc(cc1)Br 62a_100011713584_100000752885 [1,1,0,0,0,0|2,0,0]=4 6184 B13R1.9 C=CCCCSc1ccc(cc1)C 62a_100000186775_100000757094 [1,1,0,0,0,0|2,0,0]=4 6185 B13R1.9 C=CCCCSc1ccc(cc1)C 62a_100011713584_100000186775 [1,1,0,0,0,0|2,0,0]=4 6186 B13R1.9 C=CCCCSc1ccc(cc1)Cl 62a_100000755918_100000757094 [1,1,0,0,0,0|2,0,0]=4 6187 B13R1.9 C=CCCCSc1ccc(cc1)Cl 62a_100011713584_100000755918 [1,1,0,0,0,0|2,0,0]=4 6188 B13R1.9 C=CCCCSc1ccc(cc1)F 62a_100000211213_100000757094 [1,1,0,0,0,0|2,0,0]=4 6189 B13R1.9 C=CCCCSc1ccc(cc1)F 62a_100011713584_100000211213 [1,1,0,0,0,0|2,0,0]=4 6190 B13R1.9 C=CCCCSc1ccc(cc1)N 62a_100000185761_100000757094 [1,1,0,0,0,0|2,0,0]=4 6191 B13R1.9 C=CCCCSc1ccc(cc1)N 62a_100011713584_100000185761 [1,1,0,0,0,0|2,0,0]=4 6192 B13R1.9 C=CCCCSc1ccc(cc1)O 62a_100011713584_100000185759 [1,1,0,0,0,0|2,0,0]=4 6193 B13R1.9 C=CCCNCc1ccc(cc1)Br 207a_100015191253_100000186029 [1,1,0,0,0,0|2,0,0]=4 6194 B13R1.9 C=CCCNCc1ccc(cc1)Br 2230a_100000174875_100000754431 [1,1,0,0,0,0|2,0,0]=4 6195 B13R1.9 C=CCCNCc1ccc(cc1)Br 2230a_100015191253_100011217064 [1,1,0,0,0,0|2,0,0]=4 6196 B13R1.9 C=CCCNCc1ccc(cc1)Br 270004a_100015191253_100000186029 [1,1,0,0,0,0|2,0,0]=4 6197 B13R1.9 C=CCCNCc1ccc(cc1)Br 34a_100000174875_100000754431 [1,1,0,0,0,0|2,0,0]=4 6198 B13R1.9 C=CCCNCc1ccc(cc1)C 207a_100015191253_100000211033 [1,1,0,0,0,0|2,0,0]=4 6199 B13R1.9 C=CCCNCc1ccc(cc1)C 2230a_100000174908_100000754431 [1,1,0,0,0,0|2,0,0]=4 6200 B13R1.9 C=CCCNCc1ccc(cc1)C 2230a_100015191253_100000210814 [1,1,0,0,0,0|2,0,0]=4 6201 B13R1.9 C=CCCNCc1ccc(cc1)C 270004a_100015191253_100000211033 [1,1,0,0,0,0|2,0,0]=4 6202 B13R1.9 C=CCCNCc1ccc(cc1)C 34a_100000174908_100000754431 [1,1,0,0,0,0|2,0,0]=4 6203 B13R1.9 C=CCCNCc1ccc(cc1)Cl 207a_100015191253_100000189385 [1,1,0,0,0,0|2,0,0]=4 6204 B13R1.9 C=CCCNCc1ccc(cc1)Cl 2230a_100000174871_100000754431 [1,1,0,0,0,0|2,0,0]=4 6205 B13R1.9 C=CCCNCc1ccc(cc1)Cl 2230a_100015191253_100000694040 [1,1,0,0,0,0|2,0,0]=4 6206 B13R1.9 C=CCCNCc1ccc(cc1)Cl 270004a_100015191253_100000189385 [1,1,0,0,0,0|2,0,0]=4 6207 B13R1.9 C=CCCNCc1ccc(cc1)Cl 34a_100000174871_100000754431 [1,1,0,0,0,0|2,0,0]=4 6208 B13R1.9 C=CCCNCc1ccc(cc1)F 207a_100015191253_100000210084 [1,1,0,0,0,0|2,0,0]=4 6209 B13R1.9 C=CCCNCc1ccc(cc1)F 2230a_100000174882_100000754431 [1,1,0,0,0,0|2,0,0]=4 6210 B13R1.9 C=CCCNCc1ccc(cc1)F 2230a_100015191253_100000198546 [1,1,0,0,0,0|2,0,0]=4 6211 B13R1.9 C=CCCNCc1ccc(cc1)F 270004a_100015191253_100000210084 [1,1,0,0,0,0|2,0,0]=4 6212 B13R1.9 C=CCCNCc1ccc(cc1)F 34a_100000174882_100000754431 [1,1,0,0,0,0|2,0,0]=4 6213 B13R1.9 C=CCCNCc1ccc(cc1)I 207a_100015191253_100000188517 [1,1,0,0,0,0|2,0,0]=4 6214 B13R1.9 C=CCCNCc1ccc(cc1)I 2230a_100015191253_100000189116 [1,1,0,0,0,0|2,0,0]=4 6215 B13R1.9 C=CCCNCc1ccc(cc1)I 2230a_100016989417_100000754431 [1,1,0,0,0,0|2,0,0]=4 6216 B13R1.9 C=CCCNCc1ccc(cc1)I 34a_100016989417_100000754431 [1,1,0,0,0,0|2,0,0]=4 6217 B13R1.9 C=CCCNCc1ccc(cc1)O 34a_100000185549_100000754431 [1,1,0,0,0,0|2,0,0]=4 6218 B13R1.9 C=CCCOCc1ccc(cc1)Br 34a_100000695286_100000754431 [1,1,0,0,0,0|2,0,0]=4 6219 B13R1.9 C=CCCOCc1ccc(cc1)Br 34a_100011205117_100000189115 [1,1,0,0,0,0|2,0,0]=4 6220 B13R1.9 C=CCCOCc1ccc(cc1)C 34a_100011205117_100000210814 [1,1,0,0,0,0|2,0,0]=4 6221 B13R1.9 C=CCCOCc1ccc(cc1)C 34a_100011215236_100000754431 [1,1,0,0,0,0|2,0,0]=4 6222 B13R1.9 C=CCCOCc1ccc(cc1)C 7a_100011215236_100000754431 [1,1,0,0,0,0|2,0,0]=4 6223 B13R1.9 C=CCCOCc1ccc(cc1)Cl 34a_100000211118_100000754431 [1,1,0,0,0,0|2,0,0]=4 6224 B13R1.9 C=CCCOCc1ccc(cc1)Cl 34a_100011205117_100000694040 [1,1,0,0,0,0|2,0,0]=4 6225 B13R1.9 C=CCCOCc1ccc(cc1)Cl 7a_100000211118_100000754431 [1,1,0,0,0,0|2,0,0]=4 6226 B13R1.9 C=CCCOCc1ccc(cc1)F 34a_100000210977_100000754431 [1,1,0,0,0,0|2,0,0]=4 6227 B13R1.9 C=CCCOCc1ccc(cc1)F 34a_100011205117_100000198546 [1,1,0,0,0,0|2,0,0]=4 6228 B13R1.9 C=CCCOCc1ccc(cc1)F 7a_100000210977_100000754431 [1,1,0,0,0,0|2,0,0]=4 6229 B13R1.9 C=CCCOCc1ccc(cc1)I 34a_100000690907_100000754431 [1,1,0,0,0,0|2,0,0]=4 6230 B13R1.9 C=CCCOCc1ccc(cc1)I 34a_100011205117_100000189116 [1,1,0,0,0,0|2,0,0]=4 6231 B13R1.9 C=CCCOCc1ccc(cc1)I 7a_100000690907_100000754431 [1,1,0,0,0,0|2,0,0]=4 6232 B13R1.9 C=CCCOCc1ccc(cc1)N 34a_100011215238_100000754431 [1,1,0,0,0,0|2,0,0]=4 6233 B13R1.9 C=CCCSCc1ccc(cc1)Br 62a_100000189115_100000754431 [1,1,0,0,0,0|2,0,0]=4 6234 B13R1.9 C=CCCSCc1ccc(cc1)Br 62a_100000754431_100000189115 [1,1,0,0,0,0|2,0,0]=4 6235 B13R1.9 C=CCCSCc1ccc(cc1)C 62a_100000210814_100000754431 [1,1,0,0,0,0|2,0,0]=4 6236 B13R1.9 C=CCCSCc1ccc(cc1)C 62a_100000754431_100000210814 [1,1,0,0,0,0|2,0,0]=4 6237 B13R1.9 C=CCCSCc1ccc(cc1)Cl 62a_100000187161_100000754431 [1,1,0,0,0,0|2,0,0]=4 6238 B13R1.9 C=CCCSCc1ccc(cc1)Cl 62a_100000754431_100000187161 [1,1,0,0,0,0|2,0,0]=4 6239 B13R1.9 C=CCCSCc1ccc(cc1)F 62a_100000198546_100000754431 [1,1,0,0,0,0|2,0,0]=4 6240 B13R1.9 C=CCCSCc1ccc(cc1)F 62a_100000754431_100000187164 [1,1,0,0,0,0|2,0,0]=4 6241 B13R1.9 C=CCCSCc1ccc(cc1)I 62a_100000189116_100000754431 [1,1,0,0,0,0|2,0,0]=4 6242 B13R1.9 C=CCCSCc1ccc(cc1)I 62a_100000754431_100000189116 [1,1,0,0,0,0|2,0,0]=4 6243 B13R1.9 C=CCNCCc1ccc(cc1)Br 2230a_100000755846_100000210623 [1,1,0,0,0,0|2,0,0]=4 6244 B13R1.9 C=CCNCCc1ccc(cc1)Br 2230a_100020586998_100011740612 [1,1,0,0,0,0|2,0,0]=4 6245 B13R1.9 C=CCNCCc1ccc(cc1)Br 34a_100000755846_100015514636 [1,1,0,0,0,0|2,0,0]=4 6246 B13R1.9 C=CCNCCc1ccc(cc1)C 2230a_100000705350_100000210623 [1,1,0,0,0,0|2,0,0]=4 6247 B13R1.9 C=CCNCCc1ccc(cc1)C 2230a_100020586998_100011713686 [1,1,0,0,0,0|2,0,0]=4 6248 B13R1.9 C=CCNCCc1ccc(cc1)C 34a_100000705350_100015514636 [1,1,0,0,0,0|2,0,0]=4 6249 B13R1.9 C=CCNCCc1ccc(cc1)Cl 2230a_100000185265_100000210623 [1,1,0,0,0,0|2,0,0]=4 6250 B13R1.9 C=CCNCCc1ccc(cc1)Cl 2230a_100020586998_100011713675 [1,1,0,0,0,0|2,0,0]=4 6251 B13R1.9 C=CCNCCc1ccc(cc1)Cl 34a_100000185265_100015514636 [1,1,0,0,0,0|2,0,0]=4 6252 B13R1.9 C=CCNCCc1ccc(cc1)F 2230a_100000199005_100000210623 [1,1,0,0,0,0|2,0,0]=4 6253 B13R1.9 C=CCNCCc1ccc(cc1)F 2230a_100020586998_100011217392 [1,1,0,0,0,0|2,0,0]=4 6254 B13R1.9 C=CCNCCc1ccc(cc1)F 34a_100000199005_100015514636 [1,1,0,0,0,0|2,0,0]=4 6255 B13R1.9 C=CCNCCc1ccc(cc1)O 2230a_100020586998_100009816426 [1,1,0,0,0,0|2,0,0]=4 6256 B13R1.9 C=CCNCCc1ccc(cc1)O 34a_100000743037_100015514636 [1,1,0,0,0,0|2,0,0]=4 6257 B13R1.9 C=CCOCCc1ccc(cc1)Br 34a_100000766406_100015514636 [1,1,0,0,0,0|2,0,0]=4 6258 B13R1.9 C=CCOCCc1ccc(cc1)Br 34a_200000210373_100011740612 [1,1,0,0,0,0|2,0,0]=4 6259 B13R1.9 C=CCOCCc1ccc(cc1)Br 7a_100000766406_100015514636 [1,1,0,0,0,0|2,0,0]=4 6260 B13R1.9 C=CCOCCc1ccc(cc1)C 34a_100000756670_100015514636 [1,1,0,0,0,0|2,0,0]=4 6261 B13R1.9 C=CCOCCc1ccc(cc1)C 34a_200000210373_100011713686 [1,1,0,0,0,0|2,0,0]=4 6262 B13R1.9 C=CCOCCc1ccc(cc1)C 7a_100000756670_100015514636 [1,1,0,0,0,0|2,0,0]=4 6263 B13R1.9 C=CCOCCc1ccc(cc1)Cl 34a_100011219627_100015514636 [1,1,0,0,0,0|2,0,0]=4 6264 B13R1.9 C=CCOCCc1ccc(cc1)Cl 34a_200000210373_100011713675 [1,1,0,0,0,0|2,0,0]=4 6265 B13R1.9 C=CCOCCc1ccc(cc1)Cl 7a_100011219627_100015514636 [1,1,0,0,0,0|2,0,0]=4 6266 B13R1.9 C=CCOCCc1ccc(cc1)F 34a_100000754732_100015514636 [1,1,0,0,0,0|2,0,0]=4 6267 B13R1.9 C=CCOCCc1ccc(cc1)F 34a_200000210373_100011217392 [1,1,0,0,0,0|2,0,0]=4 6268 B13R1.9 C=CCOCCc1ccc(cc1)F 7a_100000754732_100015514636 [1,1,0,0,0,0|2,0,0]=4 6269 B13R1.9 C=CCOCCc1ccc(cc1)I 34a_100012291149_100015514636 [1,1,0,0,0,0|2,0,0]=4 6270 B13R1.9 C=CCOCCc1ccc(cc1)I 7a_100012291149_100015514636 [1,1,0,0,0,0|2,0,0]=4 6271 B13R1.9 C=CCOCCc1ccc(cc1)N 34a_100011204434_100015514636 [1,1,0,0,0,0|2,0,0]=4 6272 B13R1.9 C=CCSCCc1ccc(cc1)Br 62a_100000210623_100011740612 [1,1,0,0,0,0|2,0,0]=4 6273 B13R1.9 C=CCSCCc1ccc(cc1)Br 62a_100011740612_100000210623 [1,1,0,0,0,0|2,0,0]=4 6274 B13R1.9 C=CCSCCc1ccc(cc1)C 62a_100000210623_100011713686 [1,1,0,0,0,0|2,0,0]=4 6275 B13R1.9 C=CCSCCc1ccc(cc1)C 62a_100011713686_100000210623 [1,1,0,0,0,0|2,0,0]=4 6276 B13R1.9 C=CCSCCc1ccc(cc1)Cl 62a_100000210623_100011713675 [1,1,0,0,0,0|2,0,0]=4 6277 B13R1.9 C=CCSCCc1ccc(cc1)Cl 62a_100011713675_100000210623 [1,1,0,0,0,0|2,0,0]=4 6278 B13R1.9 C=CCSCCc1ccc(cc1)F 62a_100000210623_100011217392 [1,1,0,0,0,0|2,0,0]=4 6279 B13R1.9 C=CCSCCc1ccc(cc1)F 62a_100011217392_100000210623 [1,1,0,0,0,0|2,0,0]=4 6280 B13R1.9 C=CCSCCc1ccc(cc1)O 62a_100000210623_100009816426 [1,1,0,0,0,0|2,0,0]=4 6281 B13R1.9 C=CCSCCc1ccc(cc1)O 62a_100009816426_100000210623 [1,1,0,0,0,0|2,0,0]=4 6282 B13R1.9 CCCCCCc1ccc(cc1)O 271570a_203496583355_100009814338 [1,1,0,0,0,0|1,0,1]=4 6283 B13R1.9 CNCCCCc1ccc(cc1)Br 2230a_106832991635_200012094861 [1,1,0,0,0,0|2,0,0]=4 6284 B13R1.9 CNCCCCc1ccc(cc1)Br 34a_100102657272_200012094861 [1,1,0,0,0,0|2,0,0]=4 6285 B13R1.9 CNCCCCc1ccc(cc1)Br 7a_106832991635_200012094861 [1,1,0,0,0,0|2,0,0]=4 6286 B13R1.9 CNCCCCc1ccc(cc1)Cl 2230a_100160821348_200000210301 [1,1,0,0,0,0|2,0,0]=4 6287 B13R1.9 CNCCCCc1ccc(cc1)Cl 34a_100160821348_200000210301 [1,1,0,0,0,0|2,0,0]=4 6288 B13R1.9 CNCCCCc1ccc(cc1)F 2230a_106832991635_100012093538 [1,1,0,0,0,0|2,0,0]=4 6289 B13R1.9 CNCCCCc1ccc(cc1)F 34a_100102657272_100012093538 [1,1,0,0,0,0|2,0,0]=4 6290 B13R1.9 CNCCCCc1ccc(cc1)F 7a_106832991635_100012093538 [1,1,0,0,0,0|2,0,0]=4 6291 B13R1.9 COCCCCc1ccc(cc1)Br 34a_100138415774_200012094861 [1,1,0,0,0,0|2,0,0]=4 6292 B13R1.9 COCCCCc1ccc(cc1)F 34a_100138415774_100012093538 [1,1,0,0,0,0|2,0,0]=4 6293 B13R1.9 CSCCCCc1ccc(cc1)Br 62a_200000210301_200012094861 [1,1,0,0,0,0|2,0,0]=4 6294 B13R1.9 CSCCCCc1ccc(cc1)Br 62a_200012094861_200000210301 [1,1,0,0,0,0|2,0,0]=4 6295 B13R1.9 CSCCCCc1ccc(cc1)F 62a_100012093538_200000210301 [1,1,0,0,0,0|2,0,0]=4 6296 B13R1.9 CSCCCCc1ccc(cc1)F 62a_200000210301_100012093538 [1,1,0,0,0,0|2,0,0]=4 6297 B13R1.9 Cc1ccc(cc1)CCNCC=O 2230a_100000705350_200015260668 [1,1,0,0,0,0|1,0,0]=3 6298 B13R1.9 Cc1ccc(cc1)CCNCC=O 34a_100000705350_200009817547 [1,1,0,0,0,0|1,0,0]=3 6299 B13R1.9 Cc1ccc(cc1)CCNCCO 2230a_100000705350_100000211926 [1,1,0,0,0,0|1,0,1]=4 6300 B13R1.9 Cc1ccc(cc1)CCNCCO 2230a_100016997473_100011713686 [1,1,0,0,0,0|1,0,1]=4 6301 B13R1.9 Cc1ccc(cc1)CCNCCO 34a_100000705350_100000211926 [1,1,0,0,0,0|1,0,1]=4 6302 B13R1.9 Cc1ccc(cc1)CCNCCO 34a_100016990907_100011713686 [1,1,0,0,0,0|1,0,1]=4 6303 B13R1.9 Cc1ccc(cc1)CCOCC=O 34a_100000756670_200009817547 [1,1,0,0,0,0|1,0,0]=3 6304 B13R1.9 Cc1ccc(cc1)CCOCC=O 7a_100000756670_200015260668 [1,1,0,0,0,0|1,0,0]=3 6305 B13R1.9 Cc1ccc(cc1)CCOCCO 34a_100000756670_100000211926 [1,1,0,0,0,0|1,0,1]=4 6306 B13R1.9 Cc1ccc(cc1)CCOCCO 7a_100000756670_100000211926 [1,1,0,0,0,0|1,0,1]=4 6307 B13R1.9 Cc1ccc(cc1)CCSCC=O 62a_100011713686_200015260668 [1,1,0,0,0,0|1,0,0]=3 6308 B13R1.9 Cc1ccc(cc1)CCSCC=O 62a_200015260668_100011713686 [1,1,0,0,0,0|1,0,0]=3 6309 B13R1.9 Cc1ccc(cc1)CCSCCO 62a_100000211926_100011713686 [1,1,0,0,0,0|1,0,1]=4 6310 B13R1.9 Cc1ccc(cc1)CCSCCO 62a_100011713686_100000211926 [1,1,0,0,0,0|1,0,1]=4 6311 B13R1.9 Cc1ccc(cc1)CNCCCO 207a_100000182051_100000211033 [1,1,0,0,0,0|1,0,1]=4 6312 B13R1.9 Cc1ccc(cc1)CNCCCO 2230a_100000174908_100000230001 [1,1,0,0,0,0|1,0,1]=4 6313 B13R1.9 Cc1ccc(cc1)CNCCCO 270004a_100000182051_100000211033 [1,1,0,0,0,0|1,0,1]=4 6314 B13R1.9 Cc1ccc(cc1)CNCCCO 34a_100000174908_100000230001 [1,1,0,0,0,0|1,0,1]=4 6315 B13R1.9 Cc1ccc(cc1)COCCCO 34a_100011215236_100000230001 [1,1,0,0,0,0|1,0,1]=4 6316 B13R1.9 Cc1ccc(cc1)COCCCO 7a_100011215236_100011215043 [1,1,0,0,0,0|1,0,1]=4 6317 B13R1.9 Cc1ccc(cc1)CSCCCO 62a_100000210814_100011215043 [1,1,0,0,0,0|1,0,1]=4 6318 B13R1.9 Cc1ccc(cc1)CSCCCO 62a_100011215043_100000210814 [1,1,0,0,0,0|1,0,1]=4 6319 B13R1.9 Cc1ccc(cc1)NCCCCO 34a_100000124888_100011216708 [1,1,0,0,0,0|1,0,1]=4 6320 B13R1.9 Cc1ccc(cc1)OCCCC=O 7a_100000210336_200011292268 [1,1,0,0,0,0|1,0,0]=3 6321 B13R1.9 Cc1ccc(cc1)OCCCCO 34a_100000210336_100011216708 [1,1,0,0,0,0|1,0,1]=4 6322 B13R1.9 Cc1ccc(cc1)OCCCCO 7a_100000210336_100000210776 [1,1,0,0,0,0|1,0,1]=4 6323 B13R1.9 Cc1ccc(cc1)SCCCC=O 62a_100000186775_200011292268 [1,1,0,0,0,0|1,0,0]=3 6324 B13R1.9 Cc1ccc(cc1)SCCCC=O 62a_200011292268_100000186775 [1,1,0,0,0,0|1,0,0]=3 6325 B13R1.9 Cc1ccc(cc1)SCCCCO 62a_100000186775_100000210776 [1,1,0,0,0,0|1,0,1]=4 6326 B13R1.9 Cc1ccc(cc1)SCCCCO 62a_100000210776_100000186775 [1,1,0,0,0,0|1,0,1]=4 6327 B13R1.9 Cc1ccc(cn1)CCOCC=O 34a_100011815783_200009817547 [1,1,0,0,0,0|2,0,0]=4 6328 B13R1.9 Cc1ccc(cn1)OCCCC=O 7a_100000745506_200011292268 [1,1,0,0,0,0|2,0,0]=4 6329 B13R1.9 Cc1ccc(cn1)SCCCC=O 62a_100000751577_200011292268 [1,1,0,0,0,0|2,0,0]=4 6330 B13R1.9 Cc1ccc(cn1)SCCCC=O 62a_200011292268_100000751577 [1,1,0,0,0,0|2,0,0]=4 6331 B13R1.9 Cc1ccc(nc1)SCCCC=O 62a_100011192072_200011292268 [1,1,0,0,0,0|2,0,0]=4 6332 B13R1.9 Cc1ccc(nc1)SCCCC=O 62a_200011292268_100000754016 [1,1,0,0,0,0|2,0,0]=4 6333 B13R1.9 Nc1ccc(cc1)CCOCC=O 34a_100011204434_200009817547 [1,1,0,0,0,0|1,0,0]=3 6334 B13R1.9 Nc1ccc(cc1)CCOCCO 34a_100011204434_100000211926 [1,1,0,0,0,0|1,0,1]=4 6335 B13R1.9 Nc1ccc(cc1)COCCCO 34a_100011215238_100000230001 [1,1,0,0,0,0|1,0,1]=4 6336 B13R1.9 Nc1ccc(cc1)OCCCCO 34a_100000185829_100011216708 [1,1,0,0,0,0|1,0,1]=4 6337 B13R1.9 Nc1ccc(cc1)SCCCC=O 62a_100000185761_200011292268 [1,1,0,0,0,0|1,0,0]=3 6338 B13R1.9 Nc1ccc(cc1)SCCCC=O 62a_200011292268_100000185761 [1,1,0,0,0,0|1,0,0]=3 6339 B13R1.9 Nc1ccc(cc1)SCCCCO 62a_100000185761_100000210776 [1,1,0,0,0,0|1,0,1]=4 6340 B13R1.9 Nc1ccc(cc1)SCCCCO 62a_100000210776_100000185761 [1,1,0,0,0,0|1,0,1]=4 6341 B13R1.9 Nc1ccc(cn1)OCCCC=O 7a_100015188713_200011292268 [1,1,0,0,0,0|2,0,0]=4 6342 B13R1.9 Nc1ccc(cn1)SCCCC=O 62a_100000187370_200011292268 [1,1,0,0,0,0|2,0,0]=4 6343 B13R1.9 Nc1ccc(cn1)SCCCC=O 62a_200011292268_100000187370 [1,1,0,0,0,0|2,0,0]=4 6344 B13R1.9 Nc1ccc(nc1)SCCCC=O 62a_100000737798_200011292268 [1,1,0,0,0,0|2,0,0]=4 6345 B13R1.9 Nc1ccc(nc1)SCCCC=O 62a_200011292268_100000737798 [1,1,0,0,0,0|2,0,0]=4 6346 B13R1.9 O=CCCCNc1ccc(cc1)Br 2230a_100000210018_200011292268 [1,1,0,0,0,0|1,0,0]=3 6347 B13R1.9 O=CCCCNc1ccc(cc1)Cl 2230a_100000210052_200011292268 [1,1,0,0,0,0|1,0,0]=3 6348 B13R1.9 O=CCCCOc1ccc(cc1)Br 7a_100000185759_200011292268 [1,1,0,0,0,0|1,0,0]=3 6349 B13R1.9 O=CCCCOc1ccc(cc1)Cl 7a_100000210216_200011292268 [1,1,0,0,0,0|1,0,0]=3 6350 B13R1.9 O=CCCCOc1ccc(cc1)I 7a_100000212066_200011292268 [1,1,0,0,0,0|1,0,0]=3 6351 B13R1.9 O=CCCCOc1ccc(nc1)Br 7a_100000685995_200011292268 [1,1,0,0,0,0|2,0,0]=4 6352 B13R1.9 O=CCCCOc1ccc(nc1)Cl 7a_100000744096_200011292268 [1,1,0,0,0,0|2,0,0]=4 6353 B13R1.9 O=CCCCOc1ccc(nc1)F 7a_100000688820_200011292268 [1,1,0,0,0,0|2,0,0]=4 6354 B13R1.9 O=CCCCOc1ccc(nc1)I 7a_100000687607_200011292268 [1,1,0,0,0,0|2,0,0]=4 6355 B13R1.9 O=CCCCSc1cc[n+](cc1)[O-] 62a_200011292268_100000039755 [1,1,0,0,0,0|2,0,0]=4 6356 B13R1.9 O=CCCCSc1ccc(=O)[nH]c1 62a_100000212171_200011292268 [1,1,0,0,0,0|2,0,0]=4 6357 B13R1.9 O=CCCCSc1ccc(=O)[nH]c1 62a_200011292268_100000212171 [1,1,0,0,0,0|2,0,0]=4 6358 B13R1.9 O=CCCCSc1ccc(cc1)Br 62a_100000752885_200011292268 [1,1,0,0,0,0|1,0,0]=3 6359 B13R1.9 O=CCCCSc1ccc(cc1)Br 62a_200011292268_100000752885 [1,1,0,0,0,0|1,0,0]=3 6360 B13R1.9 O=CCCCSc1ccc(cc1)Cl 62a_100000755918_200011292268 [1,1,0,0,0,0|1,0,0]=3 6361 B13R1.9 O=CCCCSc1ccc(cc1)Cl 62a_200011292268_100000755918 [1,1,0,0,0,0|1,0,0]=3 6362 B13R1.9 O=CCCCSc1ccc(cc1)F 62a_100000211213_200011292268 [1,1,0,0,0,0|1,0,0]=3 6363 B13R1.9 O=CCCCSc1ccc(cc1)F 62a_200011292268_100000211213 [1,1,0,0,0,0|1,0,0]=3 6364 B13R1.9 O=CCCCSc1ccc(cc1)O 62a_200011292268_100000185759 [1,1,0,0,0,0|1,0,0]=3 6365 B13R1.9 O=CCCCSc1ccc(cn1)Br 62a_100000686858_200011292268 [1,1,0,0,0,0|2,0,0]=4 6366 B13R1.9 O=CCCCSc1ccc(cn1)Br 62a_200011292268_100000686858 [1,1,0,0,0,0|2,0,0]=4 6367 B13R1.9 O=CCCCSc1ccc(cn1)Cl 62a_100011356976_200011292268 [1,1,0,0,0,0|2,0,0]=4 6368 B13R1.9 O=CCCCSc1ccc(cn1)Cl 62a_200011292268_100011356976 [1,1,0,0,0,0|2,0,0]=4 6369 B13R1.9 O=CCCCSc1ccc(cn1)F 62a_100000744514_200011292268 [1,1,0,0,0,0|2,0,0]=4 6370 B13R1.9 O=CCCCSc1ccc(cn1)F 62a_200011292268_100000744514 [1,1,0,0,0,0|2,0,0]=4 6371 B13R1.9 O=CCCCSc1ccc(cn1)O 62a_100000685995_200011292268 [1,1,0,0,0,0|2,0,0]=4 6372 B13R1.9 O=CCCCSc1ccc(cn1)O 62a_200011292268_100000744096 [1,1,0,0,0,0|2,0,0]=4 6373 B13R1.9 O=CCCCSc1ccc(nc1)Br 62a_100009814638_200011292268 [1,1,0,0,0,0|2,0,0]=4 6374 B13R1.9 O=CCCCSc1ccc(nc1)Br 62a_200011292268_100009814638 [1,1,0,0,0,0|2,0,0]=4 6375 B13R1.9 O=CCCCSc1ccc(nc1)Cl 62a_100000034144_200011292268 [1,1,0,0,0,0|2,0,0]=4 6376 B13R1.9 O=CCCCSc1ccc(nc1)Cl 62a_200011292268_100000034144 [1,1,0,0,0,0|2,0,0]=4 6377 B13R1.9 O=CCCCSc1ccc(nc1)F 62a_100000042367_200011292268 [1,1,0,0,0,0|2,0,0]=4 6378 B13R1.9 O=CCCCSc1ccc(nc1)F 62a_200011292268_100000042367 [1,1,0,0,0,0|2,0,0]=4 6379 B13R1.9 O=CCNCCc1ccc(cc1)Br 2230a_100000755846_200015260668 [1,1,0,0,0,0|1,0,0]=3 6380 B13R1.9 O=CCNCCc1ccc(cc1)Br 34a_100000755846_200009817547 [1,1,0,0,0,0|1,0,0]=3 6381 B13R1.9 O=CCNCCc1ccc(cc1)Cl 2230a_100000185265_200015260668 [1,1,0,0,0,0|1,0,0]=3 6382 B13R1.9 O=CCNCCc1ccc(cc1)Cl 34a_100000185265_200009817547 [1,1,0,0,0,0|1,0,0]=3 6383 B13R1.9 O=CCNCCc1ccc(cc1)F 2230a_100000199005_200015260668 [1,1,0,0,0,0|1,0,0]=3 6384 B13R1.9 O=CCNCCc1ccc(cc1)F 34a_100000199005_200009817547 [1,1,0,0,0,0|1,0,0]=3 6385 B13R1.9 O=CCNCCc1ccc(cc1)O 34a_100000743037_200009817547 [1,1,0,0,0,0|1,0,0]=3 6386 B13R1.9 O=CCOCCc1ccc(cc1)Br 34a_100000766406_200009817547 [1,1,0,0,0,0|1,0,0]=3 6387 B13R1.9 O=CCOCCc1ccc(cc1)Br 7a_100000766406_200015260668 [1,1,0,0,0,0|1,0,0]=3 6388 B13R1.9 O=CCOCCc1ccc(cc1)Cl 34a_100011219627_200009817547 [1,1,0,0,0,0|1,0,0]=3 6389 B13R1.9 O=CCOCCc1ccc(cc1)Cl 7a_100011219627_200015260668 [1,1,0,0,0,0|1,0,0]=3 6390 B13R1.9 O=CCOCCc1ccc(cc1)F 34a_100000754732_200009817547 [1,1,0,0,0,0|1,0,0]=3 6391 B13R1.9 O=CCOCCc1ccc(cc1)F 7a_100000754732_200015260668 [1,1,0,0,0,0|1,0,0]=3 6392 B13R1.9 O=CCOCCc1ccc(cc1)I 34a_100012291149_200009817547 [1,1,0,0,0,0|1,0,0]=3 6393 B13R1.9 O=CCOCCc1ccc(cc1)I 7a_100012291149_200015260668 [1,1,0,0,0,0|1,0,0]=3 6394 B13R1.9 O=CCOCCc1ccc(cn1)Br 34a_100012357577_200009817547 [1,1,0,0,0,0|2,0,0]=4 6395 B13R1.9 O=CCOCCc1ccc(nc1)Cl 34a_100009880866_200009817547 [1,1,0,0,0,0|2,0,0]=4 6396 B13R1.9 O=CCOCCc1ccc(nc1)Cl 7a_100009880866_200015260668 [1,1,0,0,0,0|2,0,0]=4 6397 B13R1.9 O=CCSCCc1ccc(cc1)Br 62a_100011740612_200015260668 [1,1,0,0,0,0|1,0,0]=3 6398 B13R1.9 O=CCSCCc1ccc(cc1)Br 62a_200015260668_100011740612 [1,1,0,0,0,0|1,0,0]=3 6399 B13R1.9 O=CCSCCc1ccc(cc1)Cl 62a_100011713675_200015260668 [1,1,0,0,0,0|1,0,0]=3 6400 B13R1.9 O=CCSCCc1ccc(cc1)Cl 62a_200015260668_100011713675 [1,1,0,0,0,0|1,0,0]=3 6401 B13R1.9 O=CCSCCc1ccc(cc1)F 62a_100011217392_200015260668 [1,1,0,0,0,0|1,0,0]=3 6402 B13R1.9 O=CCSCCc1ccc(cc1)F 62a_200015260668_100011217392 [1,1,0,0,0,0|1,0,0]=3 6403 B13R1.9 O=CCSCCc1ccc(cc1)O 62a_100009816426_200015260668 [1,1,0,0,0,0|1,0,0]=3 6404 B13R1.9 O=CCSCCc1ccc(cc1)O 62a_200015260668_100009816426 [1,1,0,0,0,0|1,0,0]=3 6405 B13R1.9 OCCCCNc1ccc(cc1)Br 2230a_100000210018_100000210776 [1,1,0,0,0,0|1,0,1]=4 6406 B13R1.9 OCCCCNc1ccc(cc1)Br 34a_100000210018_100011216708 [1,1,0,0,0,0|1,0,1]=4 6407 B13R1.9 OCCCCNc1ccc(cc1)Cl 2230a_100000210052_100000210776 [1,1,0,0,0,0|1,0,1]=4 6408 B13R1.9 OCCCCNc1ccc(cc1)Cl 34a_100000210052_100011216708 [1,1,0,0,0,0|1,0,1]=4 6409 B13R1.9 OCCCCNc1ccc(cc1)F 34a_100000185862_100011216708 [1,1,0,0,0,0|1,0,1]=4 6410 B13R1.9 OCCCCNc1ccc(cc1)I 34a_100000185761_100011216708 [1,1,0,0,0,0|1,0,1]=4 6411 B13R1.9 OCCCCNc1ccc(cc1)O 34a_100000185829_100011216708 [1,1,0,0,0,0|1,0,1]=4 6412 B13R1.9 OCCCCOc1ccc(cc1)Br 34a_100000185759_100011216708 [1,1,0,0,0,0|1,0,1]=4 6413 B13R1.9 OCCCCOc1ccc(cc1)Br 7a_100000185759_100000210776 [1,1,0,0,0,0|1,0,1]=4 6414 B13R1.9 OCCCCOc1ccc(cc1)Cl 34a_100000210216_100011216708 [1,1,0,0,0,0|1,0,1]=4 6415 B13R1.9 OCCCCOc1ccc(cc1)Cl 7a_100000210216_100000210776 [1,1,0,0,0,0|1,0,1]=4 6416 B13R1.9 OCCCCOc1ccc(cc1)F 34a_100000210339_100011216708 [1,1,0,0,0,0|1,0,1]=4 6417 B13R1.9 OCCCCOc1ccc(cc1)I 34a_100000212066_100011216708 [1,1,0,0,0,0|1,0,1]=4 6418 B13R1.9 OCCCCOc1ccc(cc1)I 7a_100000212066_100000210776 [1,1,0,0,0,0|1,0,1]=4 6419 B13R1.9 OCCCCSc1ccc(cc1)Br 62a_100000210776_100000752885 [1,1,0,0,0,0|1,0,1]=4 6420 B13R1.9 OCCCCSc1ccc(cc1)Br 62a_100000752885_100000210776 [1,1,0,0,0,0|1,0,1]=4 6421 B13R1.9 OCCCCSc1ccc(cc1)Cl 62a_100000210776_100000755918 [1,1,0,0,0,0|1,0,1]=4 6422 B13R1.9 OCCCCSc1ccc(cc1)Cl 62a_100000755918_100000210776 [1,1,0,0,0,0|1,0,1]=4 6423 B13R1.9 OCCCCSc1ccc(cc1)F 62a_100000210776_100000211213 [1,1,0,0,0,0|1,0,1]=4 6424 B13R1.9 OCCCCSc1ccc(cc1)F 62a_100000211213_100000210776 [1,1,0,0,0,0|1,0,1]=4 6425 B13R1.9 OCCCCSc1ccc(cc1)O 62a_100000210776_100000185759 [1,1,0,0,0,0|1,0,1]=4 6426 B13R1.9 OCCCNCc1ccc(cc1)Br 207a_100000182051_100000186029 [1,1,0,0,0,0|1,0,1]=4 6427 B13R1.9 OCCCNCc1ccc(cc1)Br 2230a_100000174875_100000230001 [1,1,0,0,0,0|1,0,1]=4 6428 B13R1.9 OCCCNCc1ccc(cc1)Br 270004a_100000182051_100000186029 [1,1,0,0,0,0|1,0,1]=4 6429 B13R1.9 OCCCNCc1ccc(cc1)Br 34a_100000174875_100000230001 [1,1,0,0,0,0|1,0,1]=4 6430 B13R1.9 OCCCNCc1ccc(cc1)Cl 207a_100000182051_100000189385 [1,1,0,0,0,0|1,0,1]=4 6431 B13R1.9 OCCCNCc1ccc(cc1)Cl 2230a_100000174871_100000230001 [1,1,0,0,0,0|1,0,1]=4 6432 B13R1.9 OCCCNCc1ccc(cc1)Cl 270004a_100000182051_100000189385 [1,1,0,0,0,0|1,0,1]=4 6433 B13R1.9 OCCCNCc1ccc(cc1)Cl 34a_100000174871_100000230001 [1,1,0,0,0,0|1,0,1]=4 6434 B13R1.9 OCCCNCc1ccc(cc1)F 207a_100000182051_100000210084 [1,1,0,0,0,0|1,0,1]=4 6435 B13R1.9 OCCCNCc1ccc(cc1)F 2230a_100000174882_100000230001 [1,1,0,0,0,0|1,0,1]=4 6436 B13R1.9 OCCCNCc1ccc(cc1)F 270004a_100000182051_100000210084 [1,1,0,0,0,0|1,0,1]=4 6437 B13R1.9 OCCCNCc1ccc(cc1)F 34a_100000174882_100000230001 [1,1,0,0,0,0|1,0,1]=4 6438 B13R1.9 OCCCNCc1ccc(cc1)I 207a_100000182051_100000188517 [1,1,0,0,0,0|1,0,1]=4 6439 B13R1.9 OCCCNCc1ccc(cc1)I 2230a_100016989417_100000230001 [1,1,0,0,0,0|1,0,1]=4 6440 B13R1.9 OCCCNCc1ccc(cc1)I 34a_100016989417_100000230001 [1,1,0,0,0,0|1,0,1]=4 6441 B13R1.9 OCCCNCc1ccc(cc1)O 34a_100000185549_100000230001 [1,1,0,0,0,0|1,0,1]=4 6442 B13R1.9 OCCCOCc1ccc(cc1)Br 34a_100000695286_100000230001 [1,1,0,0,0,0|1,0,1]=4 6443 B13R1.9 OCCCOCc1ccc(cc1)Cl 34a_100000211118_100000230001 [1,1,0,0,0,0|1,0,1]=4 6444 B13R1.9 OCCCOCc1ccc(cc1)Cl 7a_100000211118_100011215043 [1,1,0,0,0,0|1,0,1]=4 6445 B13R1.9 OCCCOCc1ccc(cc1)F 34a_100000210977_100000230001 [1,1,0,0,0,0|1,0,1]=4 6446 B13R1.9 OCCCOCc1ccc(cc1)F 7a_100000210977_100011215043 [1,1,0,0,0,0|1,0,1]=4 6447 B13R1.9 OCCCOCc1ccc(cc1)I 34a_100000690907_100000230001 [1,1,0,0,0,0|1,0,1]=4 6448 B13R1.9 OCCCOCc1ccc(cc1)I 7a_100000690907_100011215043 [1,1,0,0,0,0|1,0,1]=4 6449 B13R1.9 OCCCSCc1ccc(cc1)Br 62a_100000189115_100011215043 [1,1,0,0,0,0|1,0,1]=4 6450 B13R1.9 OCCCSCc1ccc(cc1)Br 62a_100011215043_100000189115 [1,1,0,0,0,0|1,0,1]=4 6451 B13R1.9 OCCCSCc1ccc(cc1)Cl 62a_100000187161_100011215043 [1,1,0,0,0,0|1,0,1]=4 6452 B13R1.9 OCCCSCc1ccc(cc1)Cl 62a_100011215043_100000187161 [1,1,0,0,0,0|1,0,1]=4 6453 B13R1.9 OCCCSCc1ccc(cc1)F 62a_100000198546_100011215043 [1,1,0,0,0,0|1,0,1]=4 6454 B13R1.9 OCCCSCc1ccc(cc1)F 62a_100011215043_100000187164 [1,1,0,0,0,0|1,0,1]=4 6455 B13R1.9 OCCCSCc1ccc(cc1)I 62a_100000189116_100011215043 [1,1,0,0,0,0|1,0,1]=4 6456 B13R1.9 OCCCSCc1ccc(cc1)I 62a_100011215043_100000189116 [1,1,0,0,0,0|1,0,1]=4 6457 B13R1.9 OCCNCCc1ccc(cc1)Br 2230a_100000755846_100000211926 [1,1,0,0,0,0|1,0,1]=4 6458 B13R1.9 OCCNCCc1ccc(cc1)Br 2230a_100016997473_100011740612 [1,1,0,0,0,0|1,0,1]=4 6459 B13R1.9 OCCNCCc1ccc(cc1)Br 34a_100000755846_100000211926 [1,1,0,0,0,0|1,0,1]=4 6460 B13R1.9 OCCNCCc1ccc(cc1)Br 34a_100016990907_100011740612 [1,1,0,0,0,0|1,0,1]=4 6461 B13R1.9 OCCNCCc1ccc(cc1)Cl 2230a_100000185265_100000211926 [1,1,0,0,0,0|1,0,1]=4 6462 B13R1.9 OCCNCCc1ccc(cc1)Cl 2230a_100016997473_100011713675 [1,1,0,0,0,0|1,0,1]=4 6463 B13R1.9 OCCNCCc1ccc(cc1)Cl 34a_100000185265_100000211926 [1,1,0,0,0,0|1,0,1]=4 6464 B13R1.9 OCCNCCc1ccc(cc1)Cl 34a_100016990907_100011713675 [1,1,0,0,0,0|1,0,1]=4 6465 B13R1.9 OCCNCCc1ccc(cc1)F 2230a_100000199005_100000211926 [1,1,0,0,0,0|1,0,1]=4 6466 B13R1.9 OCCNCCc1ccc(cc1)F 2230a_100016997473_100011217392 [1,1,0,0,0,0|1,0,1]=4 6467 B13R1.9 OCCNCCc1ccc(cc1)F 34a_100000199005_100000211926 [1,1,0,0,0,0|1,0,1]=4 6468 B13R1.9 OCCNCCc1ccc(cc1)F 34a_100016990907_100011217392 [1,1,0,0,0,0|1,0,1]=4 6469 B13R1.9 OCCNCCc1ccc(cc1)O 2230a_100016997473_100009816426 [1,1,0,0,0,0|1,0,1]=4 6470 B13R1.9 OCCNCCc1ccc(cc1)O 34a_100000743037_100000211926 [1,1,0,0,0,0|1,0,1]=4 6471 B13R1.9 OCCOCCc1ccc(cc1)Br 34a_100000766406_100000211926 [1,1,0,0,0,0|1,0,1]=4 6472 B13R1.9 OCCOCCc1ccc(cc1)Br 7a_100000766406_100000211926 [1,1,0,0,0,0|1,0,1]=4 6473 B13R1.9 OCCOCCc1ccc(cc1)Cl 34a_100011219627_100000211926 [1,1,0,0,0,0|1,0,1]=4 6474 B13R1.9 OCCOCCc1ccc(cc1)Cl 7a_100011219627_100000211926 [1,1,0,0,0,0|1,0,1]=4 6475 B13R1.9 OCCOCCc1ccc(cc1)F 34a_100000754732_100000211926 [1,1,0,0,0,0|1,0,1]=4 6476 B13R1.9 OCCOCCc1ccc(cc1)F 7a_100000754732_100000211926 [1,1,0,0,0,0|1,0,1]=4 6477 B13R1.9 OCCOCCc1ccc(cc1)I 34a_100012291149_100000211926 [1,1,0,0,0,0|1,0,1]=4 6478 B13R1.9 OCCOCCc1ccc(cc1)I 7a_100012291149_100000211926 [1,1,0,0,0,0|1,0,1]=4 6479 B13R1.9 OCCSCCc1ccc(cc1)Br 62a_100000211926_100011740612 [1,1,0,0,0,0|1,0,1]=4 6480 B13R1.9 OCCSCCc1ccc(cc1)Br 62a_100011740612_100000211926 [1,1,0,0,0,0|1,0,1]=4 6481 B13R1.9 OCCSCCc1ccc(cc1)Cl 62a_100000211926_100011713675 [1,1,0,0,0,0|1,0,1]=4 6482 B13R1.9 OCCSCCc1ccc(cc1)Cl 62a_100011713675_100000211926 [1,1,0,0,0,0|1,0,1]=4 6483 B13R1.9 OCCSCCc1ccc(cc1)F 62a_100000211926_100011217392 [1,1,0,0,0,0|1,0,1]=4 6484 B13R1.9 OCCSCCc1ccc(cc1)F 62a_100011217392_100000211926 [1,1,0,0,0,0|1,0,1]=4 6485 B13R1.9 OCCSCCc1ccc(cc1)O 62a_100000211926_100009816426 [1,1,0,0,0,0|1,0,1]=4 6486 B13R1.9 OCCSCCc1ccc(cc1)O 62a_100009816426_100000211926 [1,1,0,0,0,0|1,0,1]=4 6487 B13R1.9 [13CH3]NCCCCc1ccc(cc1)Cl 2230a_100160821348_200025704644 [1,1,0,0,0,0|2,0,0]=4 6488 B13R1.9 [13CH3]NCCCCc1ccc(cc1)Cl 34a_100160821348_200025704644 [1,1,0,0,0,0|2,0,0]=4 6489 B13R1.9 [13CH3]SCCCCc1ccc(cc1)Br 62a_200012094861_200025704644 [1,1,0,0,0,0|2,0,0]=4 6490 B13R1.9 [13CH3]SCCCCc1ccc(cc1)Br 62a_200025704644_200012094861 [1,1,0,0,0,0|2,0,0]=4 6491 B13R1.9 [13CH3]SCCCCc1ccc(cc1)F 62a_100012093538_200025704644 [1,1,0,0,0,0|2,0,0]=4 6492 B13R1.9 [13CH3]SCCCCc1ccc(cc1)F 62a_200025704644_100012093538 [1,1,0,0,0,0|2,0,0]=4 6493 B13R1.24 C=CCCCC(=O)c1ccccc1 1458a_100000185807_100000757094 [1,1,0,0,0,0|1,0,1]=4 6494 B13R1.24 C=CCCCN(C)c1ccccc1 2230a_100000210012_100011713584 [1,1,0,0,0,0|2,0,0]=4 6495 B13R1.24 C=CCCCN(C)c1ccccc1 269982a_100000210012_100000757094 [1,1,0,0,0,0|2,0,0]=4 6496 B13R1.24 C=CCCCN(C)c1ccccc1 34a_100000210012_100000757094 [1,1,0,0,0,0|2,0,0]=4 6497 B13R1.24 C=CCCNC(C)c1ccccc1 2230a_100015191253_100000230085 [1,1,0,0,0,0|2,0,0]=4 6498 B13R1.24 C=CCCNC(C)c1ccccc1 269862a_100015191253_100000185851 [1,1,0,0,0,0|2,0,0]=4 6499 B13R1.24 C=CCCN[C@H](C)c1ccccc1 2230a_100000751104_100000754431 [1,1,0,0,0,0|2,0,0]=4 6500 B13R1.24 C=CCCOC(C)c1ccccc1 34a_100011205117_100000211855 [1,1,0,0,0,0|2,0,0]=4 6501 B13R1.24 C=CCCO[C@H](C)c1ccccc1 34a_100000761318_100000754431 [1,1,0,0,0,0|2,0,0]=4 6502 B13R1.24 C=CCCO[C@H](C)c1ccccc1 7a_100000761318_100000754431 [1,1,0,0,0,0|2,0,0]=4 6503 B13R1.24 C=CCCSC(C)c1ccccc1 62a_100000230085_100000754431 [1,1,0,0,0,0|2,0,0]=4 6504 B13R1.24 C=CCCSC(C)c1ccccc1 62a_100000754431_100000230085 [1,1,0,0,0,0|2,0,0]=4 6505 B13R1.24 C=CCNCC(C)c1ccccc1 2230a_100000701038_100000210623 [1,1,0,0,0,0|2,0,0]=4 6506 B13R1.24 C=CCNCC(C)c1ccccc1 2230a_100020586998_100000756946 [1,1,0,0,0,0|2,0,0]=4 6507 B13R1.24 C=CCNCC(C)c1ccccc1 270004a_100020586998_100000212034 [1,1,0,0,0,0|2,0,0]=4 6508 B13R1.24 C=CCNCC(C)c1ccccc1 34a_100000701038_100015514636 [1,1,0,0,0,0|2,0,0]=4 6509 B13R1.24 C=CCNCC(O)c1ccccc1 2230a_100000210709_100000210623 [1,1,0,0,0,0|2,0,0]=4 6510 B13R1.24 C=CCNCC(O)c1ccccc1 2230a_100020586998_100000185958 [1,1,0,0,0,0|2,0,0]=4 6511 B13R1.24 C=CCNC[C@@H](O)c1ccccc1 2230a_100020586998_100011933945 [1,1,0,0,0,0|2,0,0]=4 6512 B13R1.24 C=CCOCC(C)c1ccccc1 34a_100011215166_100015514636 [1,1,0,0,0,0|2,0,0]=4 6513 B13R1.24 C=CCOCC(C)c1ccccc1 34a_200000210373_100000756946 [1,1,0,0,0,0|2,0,0]=4 6514 B13R1.24 C=CCOCC(C)c1ccccc1 7a_100011215166_100015514636 [1,1,0,0,0,0|2,0,0]=4 6515 B13R1.24 C=CCOCC(O)c1ccccc1 34a_200000210373_100000185958 [1,1,0,0,0,0|2,0,0]=4 6516 B13R1.24 C=CCOC[C@@H](N)c1ccccc1 34a_100000751927_100015514636 [1,1,0,0,0,0|2,0,0]=4 6517 B13R1.24 C=CCOC[C@@H](O)c1ccccc1 34a_200000210373_100011933945 [1,1,0,0,0,0|2,0,0]=4 6518 B13R1.24 C=CCSCC(C)c1ccccc1 62a_100000210623_100000756946 [1,1,0,0,0,0|2,0,0]=4 6519 B13R1.24 C=CCSCC(C)c1ccccc1 62a_100000756946_100000210623 [1,1,0,0,0,0|2,0,0]=4 6520 B13R1.24 C=CCSCC(O)c1ccccc1 62a_100000185958_100000210623 [1,1,0,0,0,0|2,0,0]=4 6521 B13R1.24 C=CCSCC(O)c1ccccc1 62a_100000210623_100000185958 [1,1,0,0,0,0|2,0,0]=4 6522 B13R1.24 C=CCSC[C@@H](O)c1ccccc1 62a_100000210623_100011933945 [1,1,0,0,0,0|2,0,0]=4 6523 B13R1.24 C=CCSC[C@@H](O)c1ccccc1 62a_100011933945_100000210623 [1,1,0,0,0,0|2,0,0]=4 6524 B13R1.24 CC(CNCC=O)c1ccccc1 2230a_100000701038_200015260668 [1,1,0,0,0,0|1,0,0]=3 6525 B13R1.24 CC(CNCC=O)c1ccccc1 34a_100000701038_200009817547 [1,1,0,0,0,0|1,0,0]=3 6526 B13R1.24 CC(CNCCO)c1ccccc1 2230a_100000701038_100000211926 [1,1,0,0,0,0|1,0,1]=4 6527 B13R1.24 CC(CNCCO)c1ccccc1 2230a_100016997473_100000756946 [1,1,0,0,0,0|1,0,1]=4 6528 B13R1.24 CC(CNCCO)c1ccccc1 270004a_100000210304_100000212034 [1,1,0,0,0,0|1,0,1]=4 6529 B13R1.24 CC(CNCCO)c1ccccc1 34a_100000701038_100000211926 [1,1,0,0,0,0|1,0,1]=4 6530 B13R1.24 CC(CNCCO)c1ccccc1 34a_100016990907_100000756946 [1,1,0,0,0,0|1,0,1]=4 6531 B13R1.24 CC(COCC=O)c1ccccc1 34a_100011215166_200009817547 [1,1,0,0,0,0|1,0,0]=3 6532 B13R1.24 CC(COCC=O)c1ccccc1 7a_100011215166_200015260668 [1,1,0,0,0,0|1,0,0]=3 6533 B13R1.24 CC(COCCO)c1ccccc1 34a_100011215166_100000211926 [1,1,0,0,0,0|1,0,1]=4 6534 B13R1.24 CC(COCCO)c1ccccc1 7a_100011215166_100000211926 [1,1,0,0,0,0|1,0,1]=4 6535 B13R1.24 CC(CSCC=O)c1ccccc1 62a_100000756946_200015260668 [1,1,0,0,0,0|1,0,0]=3 6536 B13R1.24 CC(CSCC=O)c1ccccc1 62a_200015260668_100000756946 [1,1,0,0,0,0|1,0,0]=3 6537 B13R1.24 CC(CSCCO)c1ccccc1 62a_100000211926_100000756946 [1,1,0,0,0,0|1,0,1]=4 6538 B13R1.24 CC(CSCCO)c1ccccc1 62a_100000756946_100000211926 [1,1,0,0,0,0|1,0,1]=4 6539 B13R1.24 CC(NCCCO)c1ccccc1 269862a_100000182051_100000185851 [1,1,0,0,0,0|1,0,1]=4 6540 B13R1.24 CC(SCCCO)c1ccccc1 62a_100000230085_100011215043 [1,1,0,0,0,0|1,0,1]=4 6541 B13R1.24 CC(SCCCO)c1ccccc1 62a_100011215043_100000230085 [1,1,0,0,0,0|1,0,1]=4 6542 B13R1.24 CN(CCCC=O)c1ccccc1 2230a_100000210012_200011292268 [1,1,0,0,0,0|1,0,0]=3 6543 B13R1.24 CN(CCCC=O)c1ccccc1 269982a_100000210012_200011292268 [1,1,0,0,0,0|1,0,0]=3 6544 B13R1.24 CN(CCCCO)c1ccccc1 2230a_100000210012_100000210776 [1,1,0,0,0,0|1,0,1]=4 6545 B13R1.24 CN(CCCCO)c1ccccc1 269982a_100000210012_100000210776 [1,1,0,0,0,0|1,0,1]=4 6546 B13R1.24 CN(CCCCO)c1ccccc1 34a_100000210012_100011216708 [1,1,0,0,0,0|1,0,1]=4 6547 B13R1.24 COCCCC(N)c1ccccc1 34a_100000759318_200000210301 [1,1,0,0,0,0|2,0,0]=4 6548 B13R1.24 C[C@@H](NCCCO)c1ccccc1 2230a_100000751104_100000230001 [1,1,0,0,0,0|1,0,1]=4 6549 B13R1.24 C[C@@H](OCCCO)c1ccccc1 34a_100000761318_100000230001 [1,1,0,0,0,0|1,0,1]=4 6550 B13R1.24 C[C@@H](OCCCO)c1ccccc1 7a_100000761318_100011215043 [1,1,0,0,0,0|1,0,1]=4 6551 B13R1.24 N[C@H](COCC=O)c1ccccc1 34a_100000751927_200009817547 [1,1,0,0,0,0|1,0,0]=3 6552 B13R1.24 N[C@H](COCC=O)c1ccncc1 34a_100138412524_200009817547 [1,1,0,0,0,0|2,0,0]=4 6553 B13R1.24 N[C@H](COCCO)c1ccccc1 34a_100000751927_100000211926 [1,1,0,0,0,0|1,0,1]=4 6554 B13R1.24 O=C(CCCCO)c1ccccc1 1458a_100000185807_100000210776 [1,1,0,0,0,0|0,0,2]=4 6555 B13R1.24 O=CCNCC(O)c1ccccc1 2230a_100000210709_200015260668 [1,1,0,0,0,0|1,0,0]=3 6556 B13R1.24 O=CCNCC(O)c1ccccn1 2230a_100000691469_200015260668 [1,1,0,0,0,0|2,0,0]=4 6557 B13R1.24 O=CCNCC(O)c1cccnc1 2230a_100020605170_200015260668 [1,1,0,0,0,0|2,0,0]=4 6558 B13R1.24 O=CCSCC(=O)c1ccccc1 62a_100000211460_200015260668 [1,1,0,0,0,0|1,0,1]=4 6559 B13R1.24 O=CCSCC(=O)c1ccccc1 62a_200015260668_100000211460 [1,1,0,0,0,0|1,0,1]=4 6560 B13R1.24 O=CCSCC(O)c1ccccc1 62a_100000185958_200015260668 [1,1,0,0,0,0|1,0,0]=3 6561 B13R1.24 O=CCSCC(O)c1ccccc1 62a_200015260668_100000185958 [1,1,0,0,0,0|1,0,0]=3 6562 B13R1.24 O=CCSCS(=O)c1ccccc1 62a_200015260668_100000031784 [1,1,0,0,0,0|2,0,0]=4 6563 B13R1.24 O=CCSC[C@@H](O)c1ccccc1 62a_100011933945_200015260668 [1,1,0,0,0,0|1,0,0]=3 6564 B13R1.24 O=CCSC[C@@H](O)c1ccccc1 62a_200015260668_100011933945 [1,1,0,0,0,0|1,0,0]=3 6565 B13R1.24 OCCNCC(O)c1ccccc1 2230a_100000210709_100000211926 [1,1,0,0,0,0|1,0,1]=4 6566 B13R1.24 OCCNCC(O)c1ccccc1 2230a_100016997473_100000185958 [1,1,0,0,0,0|1,0,1]=4 6567 B13R1.24 OCCNCC(O)c1ccccc1 34a_100016990907_100000185958 [1,1,0,0,0,0|1,0,1]=4 6568 B13R1.24 OCCNC[C@@H](O)c1ccccc1 2230a_100016997473_100011933945 [1,1,0,0,0,0|1,0,1]=4 6569 B13R1.24 OCCNC[C@@H](O)c1ccccc1 34a_100016990907_100011933945 [1,1,0,0,0,0|1,0,1]=4 6570 B13R1.24 OCCSCC(O)c1ccccc1 62a_100000185958_100000211926 [1,1,0,0,0,0|1,0,1]=4 6571 B13R1.24 OCCSCC(O)c1ccccc1 62a_100000211926_100000185958 [1,1,0,0,0,0|1,0,1]=4 6572 B13R1.24 OCCSC[C@@H](O)c1ccccc1 62a_100000211926_100011933945 [1,1,0,0,0,0|1,0,1]=4 6573 B13R1.24 OCCSC[C@@H](O)c1ccccc1 62a_100011933945_100000211926 [1,1,0,0,0,0|1,0,1]=4 6574 B13R1.24 [13CH3]OCCCC(N)c1ccccc1 34a_100000759318_200025704644 [1,1,0,0,0,0|2,0,0]=4 6575 B13R1.28 BrCCCCOCc1ccccc1 34a_100011216708_100015291786 [1,1,0,0,0,0|1,0,1]=4 6576 B13R1.28 BrCCCOCCc1ccccc1 34a_100011217188_100000765856 [1,1,0,0,0,0|1,0,1]=4 6577 B13R1.28 BrCCOCCCc1ccccc1 34a_100000211926_100000211621 [1,1,0,0,0,0|1,0,1]=4 6578 B13R1.28 C#CCCCCNc1ccccc1 34a_100000106764_100010269958 [1,1,0,0,0,0|1,0,1]=4 6579 B13R1.28 C#CCCCCOc1ccccc1 34a_100000210340_100010269958 [1,1,0,0,0,0|1,0,1]=4 6580 B13R1.28 C#CCCCCOc1ccccc1 7a_100000210340_100010269958 [1,1,0,0,0,0|1,0,1]=4 6581 B13R1.28 C#CCCCCSc1ccccc1 62a_100000719477_100010269958 [1,1,0,0,0,0|1,0,1]=4 6582 B13R1.28 C#CCCCCSc1ccccc1 62a_100010269958_100000041952 [1,1,0,0,0,0|1,0,1]=4 6583 B13R1.28 C#CCCCNCc1ccccc1 207a_100000718082_100015611070 [1,1,0,0,0,0|1,0,1]=4 6584 B13R1.28 C#CCCCNCc1ccccc1 2230a_100015324214_100000731252 [1,1,0,0,0,0|1,0,1]=4 6585 B13R1.28 C#CCCCNCc1ccccc1 270004a_100000718082_100015611070 [1,1,0,0,0,0|1,0,1]=4 6586 B13R1.28 C#CCCCNCc1ccccc1 34a_100000718082_100015291786 [1,1,0,0,0,0|1,0,1]=4 6587 B13R1.28 C#CCCCNCc1ccccc1 34a_100015324214_100000695029 [1,1,0,0,0,0|1,0,1]=4 6588 B13R1.28 C#CCCCOCc1ccccc1 34a_100000210790_100000695029 [1,1,0,0,0,0|1,0,1]=4 6589 B13R1.28 C#CCCCOCc1ccccc1 34a_100000215630_100015291786 [1,1,0,0,0,0|1,0,1]=4 6590 B13R1.28 C#CCCCOCc1ccccc1 7a_100000210790_100011215417 [1,1,0,0,0,0|1,0,1]=4 6591 B13R1.28 C#CCCCOCc1ccccc1 7a_100000215630_100000211182 [1,1,0,0,0,0|1,0,1]=4 6592 B13R1.28 C#CCCCSCc1ccccc1 62a_100000211182_100011215417 [1,1,0,0,0,0|1,0,1]=4 6593 B13R1.28 C#CCCCSCc1ccccc1 62a_100011215417_100015291786 [1,1,0,0,0,0|1,0,1]=4 6594 B13R1.28 C#CCCNCCc1ccccc1 2230a_100000106460_100000688953 [1,1,0,0,0,0|1,0,1]=4 6595 B13R1.28 C#CCCNCCc1ccccc1 34a_100000106460_100000688953 [1,1,0,0,0,0|1,0,1]=4 6596 B13R1.28 C#CCCNCCc1ccccc1 34a_100000755551_100000765856 [1,1,0,0,0,0|1,0,1]=4 6597 B13R1.28 C#CCCOCCc1ccccc1 34a_100000210268_100000688953 [1,1,0,0,0,0|1,0,1]=4 6598 B13R1.28 C#CCCOCCc1ccccc1 34a_100011215631_100000765856 [1,1,0,0,0,0|1,0,1]=4 6599 B13R1.28 C#CCCOCCc1ccccc1 7a_100000210268_100000688953 [1,1,0,0,0,0|1,0,1]=4 6600 B13R1.28 C#CCCSCCc1ccccc1 62a_100000688953_100011218657 [1,1,0,0,0,0|1,0,1]=4 6601 B13R1.28 C#CCCSCCc1ccccc1 62a_100000765856_100000688953 [1,1,0,0,0,0|1,0,1]=4 6602 B13R1.28 C#CCNCCCc1ccccc1 2230a_100000211184_100000038162 [1,1,0,0,0,0|1,0,1]=4 6603 B13R1.28 C#CCNCCCc1ccccc1 34a_100000211184_100000184674 [1,1,0,0,0,0|1,0,1]=4 6604 B13R1.28 C#CCNCCCc1ccccc1 34a_100000212058_100000211621 [1,1,0,0,0,0|1,0,1]=4 6605 B13R1.28 C#CCOCCCc1ccccc1 34a_100000210247_100000211621 [1,1,0,0,0,0|1,0,1]=4 6606 B13R1.28 C#CCOCCCc1ccccc1 34a_100000210828_100000184674 [1,1,0,0,0,0|1,0,1]=4 6607 B13R1.28 C#CCOCCCc1ccccc1 7a_100000210828_100000038162 [1,1,0,0,0,0|1,0,1]=4 6608 B13R1.28 C#CCSCCCc1ccccc1 62a_100000038162_100000211621 [1,1,0,0,0,0|1,0,1]=4 6609 B13R1.28 C/C=C/CCOCc1ccccc1 34a_100016278192_100015291786 [1,1,0,0,0,0|1,0,1]=4 6610 B13R1.28 C/C=C/CNCCc1ccccc1 34a_100000106460_100102629194 [1,1,0,0,0,0|1,0,1]=4 6611 B13R1.28 C/C=C/COCCc1ccccc1 34a_100000210268_100102629194 [1,1,0,0,0,0|1,0,1]=4 6612 B13R1.28 C/C=C/COCCc1ccccc1 34a_100016270725_100000765856 [1,1,0,0,0,0|1,0,1]=4 6613 B13R1.28 C/C=C/COCCc1ccccc1 7a_100000210268_100102629194 [1,1,0,0,0,0|1,0,1]=4 6614 B13R1.28 C/C=C/CSCCc1ccccc1 62a_100000765856_100102629194 [1,1,0,0,0,0|1,0,1]=4 6615 B13R1.28 C/C=C/CSCCc1ccccc1 62a_100102629194_100011218657 [1,1,0,0,0,0|1,0,1]=4 6616 B13R1.28 C=CCCCCNc1ccccc1 34a_100000106764_100011215482 [1,1,0,0,0,0|1,0,0]=3 6617 B13R1.28 C=CCCCCOc1ccccc1 34a_100000210340_100011215482 [1,1,0,0,0,0|1,0,0]=3 6618 B13R1.28 C=CCCCCOc1ccccc1 7a_100000210340_100011215482 [1,1,0,0,0,0|1,0,0]=3 6619 B13R1.28 C=CCCCCOc1cccnc1 34a_100000210849_100011215482 [1,1,0,0,0,0|2,0,0]=4 6620 B13R1.28 C=CCCCCOc1cccnc1 7a_100000210849_100011215482 [1,1,0,0,0,0|2,0,0]=4 6621 B13R1.28 C=CCCCCOc1ccncc1 34a_100000212176_100011215482 [1,1,0,0,0,0|2,0,0]=4 6622 B13R1.28 C=CCCCCSc1ccccc1 62a_100000719477_100011215482 [1,1,0,0,0,0|1,0,0]=3 6623 B13R1.28 C=CCCCCSc1ccccc1 62a_100011215482_100000041952 [1,1,0,0,0,0|1,0,0]=3 6624 B13R1.28 C=CCCCCSc1ccccn1 62a_100011215482_100011216584 [1,1,0,0,0,0|2,0,0]=4 6625 B13R1.28 C=CCCCCSc1ccccn1 62a_100011216584_100011215482 [1,1,0,0,0,0|2,0,0]=4 6626 B13R1.28 C=CCCCCSc1cccnc1 62a_100000210063_100011215482 [1,1,0,0,0,0|2,0,0]=4 6627 B13R1.28 C=CCCCCSc1cccnc1 62a_100011215482_100000210063 [1,1,0,0,0,0|2,0,0]=4 6628 B13R1.28 C=CCCCCSc1ccncc1 62a_100000728582_100011215482 [1,1,0,0,0,0|2,0,0]=4 6629 B13R1.28 C=CCCCCSc1ccncc1 62a_100011215482_100000728582 [1,1,0,0,0,0|2,0,0]=4 6630 B13R1.28 C=CCCCNCc1ccccc1 2230a_100000700776_100015291786 [1,1,0,0,0,0|1,0,0]=3 6631 B13R1.28 C=CCCCNCc1ccccc1 2230a_100015324214_100011713584 [1,1,0,0,0,0|1,0,0]=3 6632 B13R1.28 C=CCCCNCc1ccccc1 270004a_100000700776_100015611070 [1,1,0,0,0,0|1,0,0]=3 6633 B13R1.28 C=CCCCNCc1ccccc1 34a_100000700776_100015291786 [1,1,0,0,0,0|1,0,0]=3 6634 B13R1.28 C=CCCCNCc1ccccc1 34a_100015324214_100000757094 [1,1,0,0,0,0|1,0,0]=3 6635 B13R1.28 C=CCCCNCc1ccccn1 2230a_100000700776_100000721315 [1,1,0,0,0,0|2,0,0]=4 6636 B13R1.28 C=CCCCNCc1ccccn1 270004a_100000700776_100000209966 [1,1,0,0,0,0|2,0,0]=4 6637 B13R1.28 C=CCCCNCc1ccccn1 34a_100000700776_100000721315 [1,1,0,0,0,0|2,0,0]=4 6638 B13R1.28 C=CCCCNCc1cccnc1 2230a_100000700776_100000741622 [1,1,0,0,0,0|2,0,0]=4 6639 B13R1.28 C=CCCCNCc1cccnc1 270004a_100000700776_100000209961 [1,1,0,0,0,0|2,0,0]=4 6640 B13R1.28 C=CCCCNCc1cccnc1 34a_100000700776_100000733263 [1,1,0,0,0,0|2,0,0]=4 6641 B13R1.28 C=CCCCNCc1ccncc1 2230a_100000700776_100015193705 [1,1,0,0,0,0|2,0,0]=4 6642 B13R1.28 C=CCCCOCc1ccccc1 34a_100000210790_100000757094 [1,1,0,0,0,0|1,0,0]=3 6643 B13R1.28 C=CCCCOCc1ccccc1 34a_100000758997_100015291786 [1,1,0,0,0,0|1,0,0]=3 6644 B13R1.28 C=CCCCOCc1ccccc1 7a_100000210790_100000757094 [1,1,0,0,0,0|1,0,0]=3 6645 B13R1.28 C=CCCCOCc1ccccc1 7a_100000758997_100000211182 [1,1,0,0,0,0|1,0,0]=3 6646 B13R1.28 C=CCCCOCc1ccccn1 34a_100000758997_100000721315 [1,1,0,0,0,0|2,0,0]=4 6647 B13R1.28 C=CCCCOCc1ccccn1 7a_100000758997_100000721315 [1,1,0,0,0,0|2,0,0]=4 6648 B13R1.28 C=CCCCOCc1cccnc1 34a_100000758997_100000733263 [1,1,0,0,0,0|2,0,0]=4 6649 B13R1.28 C=CCCCOCc1cccnc1 7a_100000758997_100000741622 [1,1,0,0,0,0|2,0,0]=4 6650 B13R1.28 C=CCCCOCc1ccncc1 7a_100000758997_100015193705 [1,1,0,0,0,0|2,0,0]=4 6651 B13R1.28 C=CCCCSCc1ccccc1 62a_100000211182_100000757094 [1,1,0,0,0,0|1,0,0]=3 6652 B13R1.28 C=CCCCSCc1ccccc1 62a_100011713584_100015291786 [1,1,0,0,0,0|1,0,0]=3 6653 B13R1.28 C=CCCCSCc1ccccn1 62a_100000721315_100000757094 [1,1,0,0,0,0|2,0,0]=4 6654 B13R1.28 C=CCCCSCc1ccccn1 62a_100011713584_100000721315 [1,1,0,0,0,0|2,0,0]=4 6655 B13R1.28 C=CCCCSCc1cccnc1 62a_100000741622_100000757094 [1,1,0,0,0,0|2,0,0]=4 6656 B13R1.28 C=CCCCSCc1cccnc1 62a_100011713584_100000741622 [1,1,0,0,0,0|2,0,0]=4 6657 B13R1.28 C=CCCCSCc1ccncc1 62a_100011713584_100015193705 [1,1,0,0,0,0|2,0,0]=4 6658 B13R1.28 C=CCCCSCc1ccncc1 62a_100015193705_100000757094 [1,1,0,0,0,0|2,0,0]=4 6659 B13R1.28 C=CCCNCCc1ccccc1 2230a_100000106460_100000754431 [1,1,0,0,0,0|1,0,0]=3 6660 B13R1.28 C=CCCNCCc1ccccc1 2230a_100015191253_100000765856 [1,1,0,0,0,0|1,0,0]=3 6661 B13R1.28 C=CCCNCCc1ccccc1 34a_100000106460_100000754431 [1,1,0,0,0,0|1,0,0]=3 6662 B13R1.28 C=CCCNCCc1ccccn1 2230a_100015191253_100015183660 [1,1,0,0,0,0|2,0,0]=4 6663 B13R1.28 C=CCCNCCc1cccnc1 2230a_100000736294_100000754431 [1,1,0,0,0,0|2,0,0]=4 6664 B13R1.28 C=CCCNCCc1cccnc1 2230a_100015191253_200011713674 [1,1,0,0,0,0|2,0,0]=4 6665 B13R1.28 C=CCCNCCc1ccncc1 2230a_100015191253_100000723409 [1,1,0,0,0,0|2,0,0]=4 6666 B13R1.28 C=CCCNCSc1ccccc1 2230a_100015191253_100011218342 [1,1,0,0,0,0|2,0,0]=4 6667 B13R1.28 C=CCCOCCc1ccccc1 34a_100000210268_100000754431 [1,1,0,0,0,0|1,0,0]=3 6668 B13R1.28 C=CCCOCCc1ccccc1 34a_100011205117_100000765856 [1,1,0,0,0,0|1,0,0]=3 6669 B13R1.28 C=CCCOCCc1ccccc1 7a_100000210268_100000754431 [1,1,0,0,0,0|1,0,0]=3 6670 B13R1.28 C=CCCOCCc1ccccn1 34a_100000210271_100000754431 [1,1,0,0,0,0|2,0,0]=4 6671 B13R1.28 C=CCCOCCc1cccnc1 34a_100011217484_100000754431 [1,1,0,0,0,0|2,0,0]=4 6672 B13R1.28 C=CCCOCCc1ccncc1 34a_100011216225_100000754431 [1,1,0,0,0,0|2,0,0]=4 6673 B13R1.28 C=CCCSCCc1ccccc1 62a_100000754431_100011218657 [1,1,0,0,0,0|1,0,0]=3 6674 B13R1.28 C=CCCSCCc1ccccc1 62a_100000765856_100000754431 [1,1,0,0,0,0|1,0,0]=3 6675 B13R1.28 C=CCCSCCc1ccccn1 62a_100000754431_100015183660 [1,1,0,0,0,0|2,0,0]=4 6676 B13R1.28 C=CCCSCCc1ccccn1 62a_100015183660_100000754431 [1,1,0,0,0,0|2,0,0]=4 6677 B13R1.28 C=CCCSCCc1cccnc1 62a_100000754431_200011713674 [1,1,0,0,0,0|2,0,0]=4 6678 B13R1.28 C=CCCSCCc1cccnc1 62a_200011713674_100000754431 [1,1,0,0,0,0|2,0,0]=4 6679 B13R1.28 C=CCCSCCc1ccncc1 62a_100000723409_100000754431 [1,1,0,0,0,0|2,0,0]=4 6680 B13R1.28 C=CCCSCCc1ccncc1 62a_100000754431_100000723409 [1,1,0,0,0,0|2,0,0]=4 6681 B13R1.28 C=CCCSCSc1ccccc1 62a_100000754431_100011218342 [1,1,0,0,0,0|2,0,0]=4 6682 B13R1.28 C=CCCSCSc1ccccc1 62a_100011218342_100000754431 [1,1,0,0,0,0|2,0,0]=4 6683 B13R1.28 C=CCNCCCc1ccccc1 2230a_100000211184_100000210623 [1,1,0,0,0,0|1,0,0]=3 6684 B13R1.28 C=CCNCCCc1ccccc1 2230a_100020586998_100000211621 [1,1,0,0,0,0|1,0,0]=3 6685 B13R1.28 C=CCNCCCc1ccccc1 34a_100000211184_100015514636 [1,1,0,0,0,0|1,0,0]=3 6686 B13R1.28 C=CCNCCCc1cccnc1 2230a_100011532358_100000210623 [1,1,0,0,0,0|2,0,0]=4 6687 B13R1.28 C=CCNCCCc1cccnc1 34a_100011532358_100015514636 [1,1,0,0,0,0|2,0,0]=4 6688 B13R1.28 C=CCNCCCc1ccncc1 2230a_100011275580_100000210623 [1,1,0,0,0,0|2,0,0]=4 6689 B13R1.28 C=CCNCCOc1ccccc1 2230a_100000174943_100000210623 [1,1,0,0,0,0|2,0,0]=4 6690 B13R1.28 C=CCNCCOc1ccccc1 2230a_100020586998_100000184471 [1,1,0,0,0,0|2,0,0]=4 6691 B13R1.28 C=CCNCCOc1ccccc1 270004a_100020586998_100000758736 [1,1,0,0,0,0|2,0,0]=4 6692 B13R1.28 C=CCNCCOc1ccccc1 34a_100000174943_100015514636 [1,1,0,0,0,0|2,0,0]=4 6693 B13R1.28 C=CCNCCSc1ccccc1 2230a_100000189519_100000210623 [1,1,0,0,0,0|2,0,0]=4 6694 B13R1.28 C=CCNCCSc1ccccc1 2230a_100020586998_100000246102 [1,1,0,0,0,0|2,0,0]=4 6695 B13R1.28 C=CCNCOCc1ccccc1 2230a_100020586998_100000763385 [1,1,0,0,0,0|2,0,0]=4 6696 B13R1.28 C=CCNCSCc1ccccc1 2230a_100020586998_200011217039 [1,1,0,0,0,0|2,0,0]=4 6697 B13R1.28 C=CCOCCCc1ccccc1 34a_100000210828_100015514636 [1,1,0,0,0,0|1,0,0]=3 6698 B13R1.28 C=CCOCCCc1ccccc1 34a_200000210373_100000211621 [1,1,0,0,0,0|1,0,0]=3 6699 B13R1.28 C=CCOCCCc1ccccc1 7a_100000210828_100015514636 [1,1,0,0,0,0|1,0,0]=3 6700 B13R1.28 C=CCOCCCc1ccccn1 34a_100011215068_100015514636 [1,1,0,0,0,0|2,0,0]=4 6701 B13R1.28 C=CCOCCCc1cccnc1 34a_100000211284_100015514636 [1,1,0,0,0,0|2,0,0]=4 6702 B13R1.28 C=CCOCCCc1ccncc1 34a_100000210659_100015514636 [1,1,0,0,0,0|2,0,0]=4 6703 B13R1.28 C=CCOCCNc1ccccc1 34a_100000211345_100015514636 [1,1,0,0,0,0|2,0,0]=4 6704 B13R1.28 C=CCOCCOc1ccccc1 34a_100000210260_100015514636 [1,1,0,0,0,0|2,0,0]=4 6705 B13R1.28 C=CCOCCOc1ccccc1 34a_200000210373_100000184471 [1,1,0,0,0,0|2,0,0]=4 6706 B13R1.28 C=CCOCCOc1ccccc1 7a_100000210260_100015514636 [1,1,0,0,0,0|2,0,0]=4 6707 B13R1.28 C=CCOCCSc1ccccc1 34a_200000210373_100000246102 [1,1,0,0,0,0|2,0,0]=4 6708 B13R1.28 C=CCOCCSc1ccccc1 7a_100000230494_100015514636 [1,1,0,0,0,0|2,0,0]=4 6709 B13R1.28 C=CCOCOCc1ccccc1 34a_200000210373_100000763385 [1,1,0,0,0,0|2,0,0]=4 6710 B13R1.28 C=CCOCSCc1ccccc1 34a_200000210373_200011217039 [1,1,0,0,0,0|2,0,0]=4 6711 B13R1.28 C=CCSCCCc1ccccc1 62a_100000210623_100000211621 [1,1,0,0,0,0|1,0,0]=3 6712 B13R1.28 C=CCSCCCc1ccccc1 62a_100000211621_100000210623 [1,1,0,0,0,0|1,0,0]=3 6713 B13R1.28 C=CCSCCOc1ccccc1 62a_100000184471_100000210623 [1,1,0,0,0,0|2,0,0]=4 6714 B13R1.28 C=CCSCCOc1ccccc1 62a_100000210623_100000184471 [1,1,0,0,0,0|2,0,0]=4 6715 B13R1.28 C=CCSCCSc1ccccc1 62a_100000210623_100000246102 [1,1,0,0,0,0|2,0,0]=4 6716 B13R1.28 C=CCSCCSc1ccccc1 62a_100000246102_100000210623 [1,1,0,0,0,0|2,0,0]=4 6717 B13R1.28 C=CCSCOCc1ccccc1 62a_100000210623_100000763385 [1,1,0,0,0,0|2,0,0]=4 6718 B13R1.28 C=CCSCOCc1ccccc1 62a_100000763385_100000210623 [1,1,0,0,0,0|2,0,0]=4 6719 B13R1.28 C=CCSCSCc1ccccc1 62a_100000210623_200011217039 [1,1,0,0,0,0|2,0,0]=4 6720 B13R1.28 C=CCSCSCc1ccccc1 62a_200011217039_100000210623 [1,1,0,0,0,0|2,0,0]=4 6721 B13R1.28 C=COCCNCc1ccccc1 2230a_100015324214_100000039644 [1,1,0,0,0,0|2,0,0]=4 6722 B13R1.28 C=COCCNCc1ccccc1 34a_100015324214_100000039644 [1,1,0,0,0,0|2,0,0]=4 6723 B13R1.28 C=COCCOCc1ccccc1 34a_100000033082_100015291786 [1,1,0,0,0,0|2,0,0]=4 6724 B13R1.28 C=COCCOCc1ccccc1 34a_100000210790_100000039644 [1,1,0,0,0,0|2,0,0]=4 6725 B13R1.28 C=COCCOCc1ccccc1 7a_100000210790_100000039644 [1,1,0,0,0,0|2,0,0]=4 6726 B13R1.28 C=COCCSCc1ccccc1 62a_100000039644_100015291786 [1,1,0,0,0,0|2,0,0]=4 6727 B13R1.28 C=COCCSCc1ccccc1 62a_100000211182_100000039644 [1,1,0,0,0,0|2,0,0]=4 6728 B13R1.28 CC=CCNCCc1ccccc1 2230a_100000106460_100000070051 [1,1,0,0,0,0|1,0,1]=4 6729 B13R1.28 CC=CCNCCc1ccccc1 34a_100000106460_100000070051 [1,1,0,0,0,0|1,0,1]=4 6730 B13R1.28 CC=CCOCCc1ccccc1 34a_100000210268_100000070051 [1,1,0,0,0,0|1,0,1]=4 6731 B13R1.28 CC=CCOCCc1ccccc1 7a_100000210268_100000070051 [1,1,0,0,0,0|1,0,1]=4 6732 B13R1.28 CC=CCSCCc1ccccc1 62a_100000070051_100011218657 [1,1,0,0,0,0|1,0,1]=4 6733 B13R1.28 CC=CCSCCc1ccccc1 62a_100000765856_100000070051 [1,1,0,0,0,0|1,0,1]=4 6734 B13R1.28 CCCCCCNc1ccccc1 34a_100000106764_100000210314 [1,1,0,0,0,0|1,0,1]=4 6735 B13R1.28 CCCCCCOc1ccccc1 34a_100000210340_100000210314 [1,1,0,0,0,0|1,0,1]=4 6736 B13R1.28 CCCCCCOc1ccccc1 7a_100000210340_100000210314 [1,1,0,0,0,0|1,0,1]=4 6737 B13R1.28 CCCCCCSc1ccccc1 62a_100000210314_100000041952 [1,1,0,0,0,0|1,0,1]=4 6738 B13R1.28 CCCCCCSc1ccccc1 62a_100000719477_100000210757 [1,1,0,0,0,0|1,0,1]=4 6739 B13R1.28 CCCCCNCc1ccccc1 207a_100000209983_100015611070 [1,1,0,0,0,0|1,0,1]=4 6740 B13R1.28 CCCCCNCc1ccccc1 2230a_100000209983_100015291786 [1,1,0,0,0,0|1,0,1]=4 6741 B13R1.28 CCCCCNCc1ccccc1 2230a_100015324214_100000210326 [1,1,0,0,0,0|1,0,1]=4 6742 B13R1.28 CCCCCNCc1ccccc1 270004a_100000209983_100015611070 [1,1,0,0,0,0|1,0,1]=4 6743 B13R1.28 CCCCCNCc1ccccc1 34a_100015324214_100000718602 [1,1,0,0,0,0|1,0,1]=4 6744 B13R1.28 CCCCCOCc1ccccc1 34a_100000210253_100015291786 [1,1,0,0,0,0|1,0,1]=4 6745 B13R1.28 CCCCCOCc1ccccc1 34a_100000210790_100000718602 [1,1,0,0,0,0|1,0,1]=4 6746 B13R1.28 CCCCCOCc1ccccc1 7a_100000210253_100000211182 [1,1,0,0,0,0|1,0,1]=4 6747 B13R1.28 CCCCCOCc1ccccc1 7a_100000210790_100000210326 [1,1,0,0,0,0|1,0,1]=4 6748 B13R1.28 CCCCCSCc1ccccc1 62a_100000210326_100015291786 [1,1,0,0,0,0|1,0,1]=4 6749 B13R1.28 CCCCCSCc1ccccc1 62a_100000211182_100000210326 [1,1,0,0,0,0|1,0,1]=4 6750 B13R1.28 CCCCNCCc1ccccc1 2230a_100000102301_100000765856 [1,1,0,0,0,0|1,0,1]=4 6751 B13R1.28 CCCCNCCc1ccccc1 2230a_100000106460_100000210211 [1,1,0,0,0,0|1,0,1]=4 6752 B13R1.28 CCCCNCCc1ccccc1 34a_100000106460_100000210210 [1,1,0,0,0,0|1,0,1]=4 6753 B13R1.28 CCCCNCCc1ccccc1 7a_106832991798_100000765856 [1,1,0,0,0,0|1,0,1]=4 6754 B13R1.28 CCCCOCCc1ccccc1 34a_100000210227_100000765856 [1,1,0,0,0,0|1,0,1]=4 6755 B13R1.28 CCCCOCCc1ccccc1 34a_100000210268_100000210210 [1,1,0,0,0,0|1,0,1]=4 6756 B13R1.28 CCCCOCCc1ccccc1 7a_100000210227_100000765856 [1,1,0,0,0,0|1,0,1]=4 6757 B13R1.28 CCCCOCCc1ccccc1 7a_100000210268_100000210211 [1,1,0,0,0,0|1,0,1]=4 6758 B13R1.28 CCCCSCCc1ccccc1 62a_100000210211_100011218657 [1,1,0,0,0,0|1,0,1]=4 6759 B13R1.28 CCCCSCCc1ccccc1 62a_100000765856_100000210210 [1,1,0,0,0,0|1,0,1]=4 6760 B13R1.28 CCCNCCCc1ccccc1 2230a_100000211184_100000210303 [1,1,0,0,0,0|1,0,1]=4 6761 B13R1.28 CCCNCCCc1ccccc1 34a_100000211184_100000210303 [1,1,0,0,0,0|1,0,1]=4 6762 B13R1.28 CCCOCCCc1ccccc1 34a_100000210258_100000211621 [1,1,0,0,0,0|1,0,1]=4 6763 B13R1.28 CCCOCCCc1ccccc1 34a_100000210828_100000210303 [1,1,0,0,0,0|1,0,1]=4 6764 B13R1.28 CCCOCCCc1ccccc1 7a_100000210828_100000210303 [1,1,0,0,0,0|1,0,1]=4 6765 B13R1.28 CCCSCCCc1ccccc1 62a_100000210303_100000211621 [1,1,0,0,0,0|1,0,1]=4 6766 B13R1.28 CCCSCCCc1ccccc1 62a_100000211621_100000210303 [1,1,0,0,0,0|1,0,1]=4 6767 B13R1.28 CCNCCCCc1ccccc1 2230a_100015280158_100000210202 [1,1,0,0,0,0|1,0,1]=4 6768 B13R1.28 CCNCCCCc1ccccc1 2230a_100015525214_100000701786 [1,1,0,0,0,0|1,0,1]=4 6769 B13R1.28 CCNCCCCc1ccccc1 34a_100015280158_100000210202 [1,1,0,0,0,0|1,0,1]=4 6770 B13R1.28 CCOCCCCc1ccccc1 34a_100000703073_100000210202 [1,1,0,0,0,0|1,0,1]=4 6771 B13R1.28 CCOCCCCc1ccccc1 34a_100121572206_100000701786 [1,1,0,0,0,0|1,0,1]=4 6772 B13R1.28 CCOCCCCc1ccccc1 7a_100000703073_100000210202 [1,1,0,0,0,0|1,0,1]=4 6773 B13R1.28 CCSCCCCc1ccccc1 62a_100000210202_100000701786 [1,1,0,0,0,0|1,0,1]=4 6774 B13R1.28 CCSCCCCc1ccccc1 62a_100000701786_100000210202 [1,1,0,0,0,0|1,0,1]=4 6775 B13R1.28 CNCCCCCc1ccccc1 2230a_100000750932_200000210301 [1,1,0,0,0,0|1,0,1]=4 6776 B13R1.28 CNCCCCCc1ccccc1 2230a_106832991635_200011217138 [1,1,0,0,0,0|1,0,1]=4 6777 B13R1.28 CNCCCCCc1ccccc1 34a_100000750932_200000210301 [1,1,0,0,0,0|1,0,1]=4 6778 B13R1.28 CNCCCCCc1ccccc1 34a_100102657272_200011217138 [1,1,0,0,0,0|1,0,1]=4 6779 B13R1.28 CNCCCCCc1ccccc1 7a_106832991635_200011217138 [1,1,0,0,0,0|1,0,1]=4 6780 B13R1.28 CNCCCCOc1ccccc1 2230a_106832991635_100011215240 [1,1,0,0,0,0|2,0,0]=4 6781 B13R1.28 CNCCCCOc1ccccc1 34a_100102657272_100011215240 [1,1,0,0,0,0|2,0,0]=4 6782 B13R1.28 CNCCCCOc1ccccc1 7a_106832991635_100011215240 [1,1,0,0,0,0|2,0,0]=4 6783 B13R1.28 CNCCCOCc1ccccc1 2230a_106832991635_100011215529 [1,1,0,0,0,0|2,0,0]=4 6784 B13R1.28 CNCCCOCc1ccccc1 2230a_200000206031_200000210301 [1,1,0,0,0,0|2,0,0]=4 6785 B13R1.28 CNCCCOCc1ccccc1 34a_100000213112_100015291786 [1,1,0,0,0,0|2,0,0]=4 6786 B13R1.28 CNCCCOCc1ccccc1 34a_100102657272_100011215529 [1,1,0,0,0,0|2,0,0]=4 6787 B13R1.28 CNCCCOCc1ccccc1 34a_200000206031_200000210301 [1,1,0,0,0,0|2,0,0]=4 6788 B13R1.28 CNCCCOCc1ccccc1 7a_106832991635_100011215529 [1,1,0,0,0,0|2,0,0]=4 6789 B13R1.28 COCCCCCc1ccccc1 34a_100138415774_200011217138 [1,1,0,0,0,0|0,0,1]=3 6790 B13R1.28 COCCCCCc1ccccc1 34a_200011219639_200000210301 [1,1,0,0,0,0|0,0,1]=3 6791 B13R1.28 COCCCCCc1ccccc1 7a_200011219639_200000210301 [1,1,0,0,0,0|0,0,1]=3 6792 B13R1.28 COCCCCNc1ccccc1 34a_100000106764_100000755781 [1,1,0,0,0,0|1,0,1]=4 6793 B13R1.28 COCCCCOc1ccccc1 34a_100000210340_100000755781 [1,1,0,0,0,0|1,0,1]=4 6794 B13R1.28 COCCCCOc1ccccc1 34a_100000752354_200000210301 [1,1,0,0,0,0|1,0,1]=4 6795 B13R1.28 COCCCCOc1ccccc1 34a_100138415774_100011215240 [1,1,0,0,0,0|1,0,1]=4 6796 B13R1.28 COCCCCOc1ccccc1 7a_100000210340_100000730899 [1,1,0,0,0,0|1,0,1]=4 6797 B13R1.28 COCCCCOc1ccccc1 7a_100000752354_200000210301 [1,1,0,0,0,0|1,0,1]=4 6798 B13R1.28 COCCCCSc1ccccc1 62a_100000719477_100000730899 [1,1,0,0,0,0|1,0,1]=4 6799 B13R1.28 COCCCCSc1ccccc1 62a_100000730899_100000041952 [1,1,0,0,0,0|1,0,1]=4 6800 B13R1.28 COCCCNCc1ccccc1 207a_100150723488_100015611070 [1,1,0,0,0,0|1,0,1]=4 6801 B13R1.28 COCCCNCc1ccccc1 2230a_100015324214_100000740836 [1,1,0,0,0,0|1,0,1]=4 6802 B13R1.28 COCCCNCc1ccccc1 270004a_100150723488_100015611070 [1,1,0,0,0,0|1,0,1]=4 6803 B13R1.28 COCCCNCc1ccccc1 34a_100000185501_200000210301 [1,1,0,0,0,0|1,0,1]=4 6804 B13R1.28 COCCCNCc1ccccc1 34a_100015324214_100000740836 [1,1,0,0,0,0|1,0,1]=4 6805 B13R1.28 COCCCNCc1ccccc1 34a_100150723488_100015291786 [1,1,0,0,0,0|1,0,1]=4 6806 B13R1.28 COCCCOCc1ccccc1 34a_100000210790_100000740836 [1,1,0,0,0,0|1,0,1]=4 6807 B13R1.28 COCCCOCc1ccccc1 34a_100000691849_200000210301 [1,1,0,0,0,0|1,0,1]=4 6808 B13R1.28 COCCCOCc1ccccc1 34a_100000740835_100015291786 [1,1,0,0,0,0|1,0,1]=4 6809 B13R1.28 COCCCOCc1ccccc1 34a_100138415774_100011215529 [1,1,0,0,0,0|1,0,1]=4 6810 B13R1.28 COCCCOCc1ccccc1 7a_100000210790_100000740836 [1,1,0,0,0,0|1,0,1]=4 6811 B13R1.28 COCCCOCc1ccccc1 7a_100000691849_200000210301 [1,1,0,0,0,0|1,0,1]=4 6812 B13R1.28 COCCCSCc1ccccc1 62a_100000211182_100000709357 [1,1,0,0,0,0|1,0,1]=4 6813 B13R1.28 COCCCSCc1ccccc1 62a_100000709357_100015291786 [1,1,0,0,0,0|1,0,1]=4 6814 B13R1.28 COCCNCCc1ccccc1 2230a_100000106460_100011201679 [1,1,0,0,0,0|1,0,1]=4 6815 B13R1.28 COCCNCCc1ccccc1 2230a_100000209980_100000765856 [1,1,0,0,0,0|1,0,1]=4 6816 B13R1.28 COCCNCCc1ccccc1 34a_100000106460_100011201679 [1,1,0,0,0,0|1,0,1]=4 6817 B13R1.28 COCCOCCc1ccccc1 34a_100000210237_100000765856 [1,1,0,0,0,0|1,0,1]=4 6818 B13R1.28 COCCOCCc1ccccc1 34a_100000210268_100011201679 [1,1,0,0,0,0|1,0,1]=4 6819 B13R1.28 COCCOCCc1ccccc1 7a_100000210268_100000233755 [1,1,0,0,0,0|1,0,1]=4 6820 B13R1.28 COCCSCCc1ccccc1 62a_100000233755_100011218657 [1,1,0,0,0,0|1,0,1]=4 6821 B13R1.28 COCCSCCc1ccccc1 62a_100000765856_100000233755 [1,1,0,0,0,0|1,0,1]=4 6822 B13R1.28 COCNCCCc1ccccc1 2230a_100000211184_100000766300 [1,1,0,0,0,0|1,0,1]=4 6823 B13R1.28 COCSCCCc1ccccc1 62a_100000211621_100000766300 [1,1,0,0,0,0|1,0,1]=4 6824 B13R1.28 COCSCCCc1ccccc1 62a_100000766300_100000211621 [1,1,0,0,0,0|1,0,1]=4 6825 B13R1.28 CSCCCCCc1ccccc1 62a_200000210301_200011217138 [1,1,0,0,0,0|0,1,1]=4 6826 B13R1.28 CSCCCCCc1ccccc1 62a_200011217138_200000210301 [1,1,0,0,0,0|0,1,1]=4 6827 B13R1.28 CSCCCCOc1ccccc1 62a_100011215240_200000210301 [1,1,0,0,0,0|2,0,0]=4 6828 B13R1.28 CSCCCCOc1ccccc1 62a_200000210301_100011215240 [1,1,0,0,0,0|2,0,0]=4 6829 B13R1.28 CSCCCNCc1ccccc1 207a_100000749238_100015611070 [1,1,0,0,0,0|2,0,0]=4 6830 B13R1.28 CSCCCNCc1ccccc1 2230a_100000749238_100015291786 [1,1,0,0,0,0|2,0,0]=4 6831 B13R1.28 CSCCCNCc1ccccc1 270004a_100000749238_100015611070 [1,1,0,0,0,0|2,0,0]=4 6832 B13R1.28 CSCCCOCc1ccccc1 34a_100000690336_100015291786 [1,1,0,0,0,0|2,0,0]=4 6833 B13R1.28 CSCCCOCc1ccccc1 62a_100011215529_200000210301 [1,1,0,0,0,0|2,0,0]=4 6834 B13R1.28 CSCCCOCc1ccccc1 62a_200000210301_100011215529 [1,1,0,0,0,0|2,0,0]=4 6835 B13R1.28 CSCCCOCc1ccccc1 7a_100000690336_100000211182 [1,1,0,0,0,0|2,0,0]=4 6836 B13R1.28 CSCCNCCc1ccccc1 2230a_100000106460_100000751147 [1,1,0,0,0,0|2,0,0]=4 6837 B13R1.28 CSCCNCCc1ccccc1 2230a_100020590264_100000765856 [1,1,0,0,0,0|2,0,0]=4 6838 B13R1.28 CSCCNCCc1ccccc1 34a_100000106460_100000212216 [1,1,0,0,0,0|2,0,0]=4 6839 B13R1.28 CSCCOCCc1ccccc1 34a_100000210268_100000212216 [1,1,0,0,0,0|2,0,0]=4 6840 B13R1.28 CSCCOCCc1ccccc1 34a_100000230434_100000765856 [1,1,0,0,0,0|2,0,0]=4 6841 B13R1.28 CSCCOCCc1ccccc1 7a_100000210268_100000212216 [1,1,0,0,0,0|2,0,0]=4 6842 B13R1.28 CSCCOCCc1ccccc1 7a_100000230434_100000765856 [1,1,0,0,0,0|2,0,0]=4 6843 B13R1.28 CSCCSCCc1ccccc1 62a_100000212216_100011218657 [1,1,0,0,0,0|2,0,0]=4 6844 B13R1.28 CSCCSCCc1ccccc1 62a_100000765856_100000751147 [1,1,0,0,0,0|2,0,0]=4 6845 B13R1.28 CSCNCCCc1ccccc1 2230a_100000211184_100011218213 [1,1,0,0,0,0|2,0,0]=4 6846 B13R1.28 CSCNCCCc1ccccc1 34a_100000211184_100011218213 [1,1,0,0,0,0|2,0,0]=4 6847 B13R1.28 CSCOCCCc1ccccc1 34a_100000210828_100011218213 [1,1,0,0,0,0|2,0,0]=4 6848 B13R1.28 CSCSCCCc1ccccc1 62a_100000211621_100011218213 [1,1,0,0,0,0|2,0,0]=4 6849 B13R1.28 CSCSCCCc1ccccc1 62a_100011218213_100000211621 [1,1,0,0,0,0|2,0,0]=4 6850 B13R1.28 ClCCCCOCc1ccccc1 34a_100000210776_100015291786 [1,1,0,0,0,0|1,0,1]=4 6851 B13R1.28 ClCCCCOCc1ccccc1 7a_100000210776_100000211182 [1,1,0,0,0,0|1,0,1]=4 6852 B13R1.28 ClCCCOCCc1ccccc1 34a_100000230001_100000765856 [1,1,0,0,0,0|1,0,1]=4 6853 B13R1.28 FCCCCCNc1ccccc1 34a_100000106764_100000729378 [1,1,0,0,0,0|1,0,1]=4 6854 B13R1.28 FCCCCCOc1ccccc1 34a_100000210340_100000729378 [1,1,0,0,0,0|1,0,1]=4 6855 B13R1.28 FCCCCCOc1ccccc1 7a_100000210340_100000729378 [1,1,0,0,0,0|1,0,1]=4 6856 B13R1.28 FCCCCCSc1ccccc1 62a_100000719477_100000729378 [1,1,0,0,0,0|1,0,1]=4 6857 B13R1.28 FCCCCCSc1ccccc1 62a_100000729378_100000041952 [1,1,0,0,0,0|1,0,1]=4 6858 B13R1.28 FCCCCNCc1ccccc1 2230a_100015324214_100000729493 [1,1,0,0,0,0|1,0,1]=4 6859 B13R1.28 FCCCCNCc1ccccc1 34a_100015324214_100000729493 [1,1,0,0,0,0|1,0,1]=4 6860 B13R1.28 FCCCCOCc1ccccc1 34a_100000210790_100000729493 [1,1,0,0,0,0|1,0,1]=4 6861 B13R1.28 FCCCCOCc1ccccc1 34a_100011995726_100015291786 [1,1,0,0,0,0|1,0,1]=4 6862 B13R1.28 FCCCCOCc1ccccc1 7a_100000210790_100000729493 [1,1,0,0,0,0|1,0,1]=4 6863 B13R1.28 FCCCCOCc1ccccc1 7a_100011995726_100000211182 [1,1,0,0,0,0|1,0,1]=4 6864 B13R1.28 FCCCCSCc1ccccc1 62a_100000211182_100000729493 [1,1,0,0,0,0|1,0,1]=4 6865 B13R1.28 FCCCCSCc1ccccc1 62a_100000729493_100015291786 [1,1,0,0,0,0|1,0,1]=4 6866 B13R1.28 FCCCNCCc1ccccc1 2230a_100000106460_100011934791 [1,1,0,0,0,0|1,0,1]=4 6867 B13R1.28 FCCCNCCc1ccccc1 2230a_100015189416_100000765856 [1,1,0,0,0,0|1,0,1]=4 6868 B13R1.28 FCCCNCCc1ccccc1 34a_100000106460_100011934791 [1,1,0,0,0,0|1,0,1]=4 6869 B13R1.28 FCCCNCCc1ccccc1 34a_100015189416_100000765856 [1,1,0,0,0,0|1,0,1]=4 6870 B13R1.28 FCCCOCCc1ccccc1 34a_100000210268_100011934791 [1,1,0,0,0,0|1,0,1]=4 6871 B13R1.28 FCCCOCCc1ccccc1 34a_100000759539_100000765856 [1,1,0,0,0,0|1,0,1]=4 6872 B13R1.28 FCCCOCCc1ccccc1 7a_100000210268_100011934791 [1,1,0,0,0,0|1,0,1]=4 6873 B13R1.28 FCCCSCCc1ccccc1 62a_100000765856_100011934791 [1,1,0,0,0,0|1,0,1]=4 6874 B13R1.28 FCCCSCCc1ccccc1 62a_100011934791_100011218657 [1,1,0,0,0,0|1,0,1]=4 6875 B13R1.28 FCCNCCCc1ccccc1 2230a_100000211184_100011217306 [1,1,0,0,0,0|1,0,1]=4 6876 B13R1.28 FCCNCCCc1ccccc1 34a_100000211184_100011217306 [1,1,0,0,0,0|1,0,1]=4 6877 B13R1.28 FCCNCCCc1ccccc1 34a_100000724931_100000211621 [1,1,0,0,0,0|1,0,1]=4 6878 B13R1.28 FCCOCCCc1ccccc1 34a_100000210828_100011217306 [1,1,0,0,0,0|1,0,1]=4 6879 B13R1.28 FCCOCCCc1ccccc1 7a_100000210828_100011217306 [1,1,0,0,0,0|1,0,1]=4 6880 B13R1.28 FCCSCCCc1ccccc1 62a_100000211621_100011217306 [1,1,0,0,0,0|1,0,1]=4 6881 B13R1.28 FCCSCCCc1ccccc1 62a_100011217306_100000211621 [1,1,0,0,0,0|1,0,1]=4 6882 B13R1.28 FCNCCCCc1ccccc1 34a_100015280158_100015361967 [1,1,0,0,0,0|1,0,1]=4 6883 B13R1.28 FCOCCCCc1ccccc1 34a_100000703073_100015361967 [1,1,0,0,0,0|1,0,1]=4 6884 B13R1.28 FCOCCCCc1ccccc1 7a_100000703073_100015361967 [1,1,0,0,0,0|1,0,1]=4 6885 B13R1.28 FCSCCCCc1ccccc1 62a_100000701786_100015361967 [1,1,0,0,0,0|1,0,1]=4 6886 B13R1.28 FCSCCCCc1ccccc1 62a_100015361967_100000701786 [1,1,0,0,0,0|1,0,1]=4 6887 B13R1.28 ICCCCOCc1ccccc1 34a_200012148704_100015291786 [1,1,0,0,0,0|1,0,1]=4 6888 B13R1.28 N#CCCCCOc1ccccc1 7a_100000210340_100000211819 [1,1,0,0,0,0|1,0,1]=4 6889 B13R1.28 N#CCCCCSc1ccccc1 62a_100000719477_100000211819 [1,1,0,0,0,0|1,0,1]=4 6890 B13R1.28 N#CCCCCSc1ccccc1 62a_100011219923_100000041952 [1,1,0,0,0,0|1,0,1]=4 6891 B13R1.28 N#CCCCNCc1ccccc1 2230a_100015324214_100000687738 [1,1,0,0,0,0|1,0,1]=4 6892 B13R1.28 N#CCCCOCc1ccccc1 7a_100000210790_100000687738 [1,1,0,0,0,0|1,0,1]=4 6893 B13R1.28 N#CCCCSCc1ccccc1 62a_100000211182_100000687738 [1,1,0,0,0,0|1,0,1]=4 6894 B13R1.28 N#CCCCSCc1ccccc1 62a_100000687738_100015291786 [1,1,0,0,0,0|1,0,1]=4 6895 B13R1.28 N#CCCNCCc1ccccc1 2230a_100000106460_100011215226 [1,1,0,0,0,0|1,0,1]=4 6896 B13R1.28 N#CCCOCCc1ccccc1 7a_100000210268_100000184422 [1,1,0,0,0,0|1,0,1]=4 6897 B13R1.28 N#CCCSCCc1ccccc1 62a_100000765856_100011215226 [1,1,0,0,0,0|1,0,1]=4 6898 B13R1.28 N#CCCSCCc1ccccc1 62a_100011215226_100011218657 [1,1,0,0,0,0|1,0,1]=4 6899 B13R1.28 N#CCNCCCc1ccccc1 2230a_100000211184_100011215382 [1,1,0,0,0,0|1,0,1]=4 6900 B13R1.28 N#CCOCCCc1ccccc1 7a_100000210828_100011215382 [1,1,0,0,0,0|1,0,1]=4 6901 B13R1.28 N#CCSCCCc1ccccc1 62a_100000211621_100011215382 [1,1,0,0,0,0|1,0,1]=4 6902 B13R1.28 N#CCSCCCc1ccccc1 62a_100011215382_100000211621 [1,1,0,0,0,0|1,0,1]=4 6903 B13R1.28 NCCCCOCc1ccccc1 34a_100000750430_100015291786 [1,1,0,0,0,0|1,0,1]=4 6904 B13R1.28 NCCCOCCc1ccccc1 34a_100000182051_100000765856 [1,1,0,0,0,0|1,0,1]=4 6905 B13R1.28 NCCOCCCc1ccccc1 34a_100000210304_100000211621 [1,1,0,0,0,0|1,0,1]=4 6906 B13R1.28 NOCCOCCc1ccccc1 34a_100000700252_100000765856 [1,1,0,0,0,0|1,0,1]=4 6907 B13R1.28 O=CCCCCOc1ccccc1 7a_100000210340_100000139335 [1,1,0,0,0,0|0,0,0]=2 6908 B13R1.28 O=CCCCCOc1cccnc1 7a_100000210849_100000139335 [1,1,0,0,0,0|1,0,0]=3 6909 B13R1.28 O=CCCCCOc1cncnc1 7a_100000754086_100000139335 [1,1,0,0,0,0|2,0,0]=4 6910 B13R1.28 O=CCCCCSc1ccccc1 62a_100000139335_100000041952 [1,1,0,0,0,0|0,0,0]=2 6911 B13R1.28 O=CCCCCSc1ccccc1 62a_100000719477_100000139335 [1,1,0,0,0,0|0,0,0]=2 6912 B13R1.28 O=CCCCCSc1ccccn1 62a_100000139335_100011216584 [1,1,0,0,0,0|1,0,0]=3 6913 B13R1.28 O=CCCCCSc1ccccn1 62a_100011216584_100000139335 [1,1,0,0,0,0|1,0,0]=3 6914 B13R1.28 O=CCCCCSc1cccnc1 62a_100000139335_100000210063 [1,1,0,0,0,0|1,0,0]=3 6915 B13R1.28 O=CCCCCSc1cccnc1 62a_100000210063_100000139335 [1,1,0,0,0,0|1,0,0]=3 6916 B13R1.28 O=CCCCCSc1cccnn1 62a_100000139335_100016991348 [1,1,0,0,0,0|2,0,0]=4 6917 B13R1.28 O=CCCCCSc1cccnn1 62a_100016991348_100000139335 [1,1,0,0,0,0|2,0,0]=4 6918 B13R1.28 O=CCCCCSc1ccncc1 62a_100000139335_100000728582 [1,1,0,0,0,0|1,0,0]=3 6919 B13R1.28 O=CCCCCSc1ccncc1 62a_100000728582_100000139335 [1,1,0,0,0,0|1,0,0]=3 6920 B13R1.28 O=CCCCCSc1ccncn1 62a_100000139335_100000703185 [1,1,0,0,0,0|2,0,0]=4 6921 B13R1.28 O=CCCCCSc1ccncn1 62a_100000703185_100000139335 [1,1,0,0,0,0|2,0,0]=4 6922 B13R1.28 O=CCCCCSc1ccnnc1 62a_100000139335_100000732662 [1,1,0,0,0,0|2,0,0]=4 6923 B13R1.28 O=CCCCCSc1ccnnc1 62a_100000732662_100000139335 [1,1,0,0,0,0|2,0,0]=4 6924 B13R1.28 O=CCCCCSc1cnccn1 62a_100000139335_100000211759 [1,1,0,0,0,0|2,0,0]=4 6925 B13R1.28 O=CCCCCSc1cnccn1 62a_100000211759_100000139335 [1,1,0,0,0,0|2,0,0]=4 6926 B13R1.28 O=CCCCCSc1cncnc1 62a_100000139335_100011206942 [1,1,0,0,0,0|2,0,0]=4 6927 B13R1.28 O=CCCCCSc1cncnc1 62a_100011206942_100000139335 [1,1,0,0,0,0|2,0,0]=4 6928 B13R1.28 O=CCCCCSc1ncccn1 62a_100000139335_100000211032 [1,1,0,0,0,0|2,0,0]=4 6929 B13R1.28 O=CCCCCSc1ncccn1 62a_100000211032_100000139335 [1,1,0,0,0,0|2,0,0]=4 6930 B13R1.28 O=CCCCNCc1ccccc1 2230a_100015324214_200011292268 [1,1,0,0,0,0|0,0,0]=2 6931 B13R1.28 O=CCCCNCc1cccnn1 2230a_100159270163_200011292268 [1,1,0,0,0,0|2,0,0]=4 6932 B13R1.28 O=CCCCNCc1cncnc1 2230a_100011243677_200011292268 [1,1,0,0,0,0|2,0,0]=4 6933 B13R1.28 O=CCCCOCc1ccccc1 7a_100000210790_200011292268 [1,1,0,0,0,0|0,0,0]=2 6934 B13R1.28 O=CCCCSCc1ccccc1 62a_100000211182_200011292268 [1,1,0,0,0,0|0,0,0]=2 6935 B13R1.28 O=CCCCSCc1ccccc1 62a_200011292268_100015291786 [1,1,0,0,0,0|0,0,0]=2 6936 B13R1.28 O=CCCCSCc1ccccn1 62a_100000721315_200011292268 [1,1,0,0,0,0|1,0,0]=3 6937 B13R1.28 O=CCCCSCc1ccccn1 62a_200011292268_100000721315 [1,1,0,0,0,0|1,0,0]=3 6938 B13R1.28 O=CCCCSCc1cccnc1 62a_100000741622_200011292268 [1,1,0,0,0,0|1,0,0]=3 6939 B13R1.28 O=CCCCSCc1cccnc1 62a_200011292268_100000741622 [1,1,0,0,0,0|1,0,0]=3 6940 B13R1.28 O=CCCCSCc1cccnn1 62a_100016990269_200011292268 [1,1,0,0,0,0|2,0,0]=4 6941 B13R1.28 O=CCCCSCc1cccnn1 62a_200011292268_100016990269 [1,1,0,0,0,0|2,0,0]=4 6942 B13R1.28 O=CCCCSCc1ccncc1 62a_100015193705_200011292268 [1,1,0,0,0,0|1,0,0]=3 6943 B13R1.28 O=CCCCSCc1ccncc1 62a_200011292268_100015193705 [1,1,0,0,0,0|1,0,0]=3 6944 B13R1.28 O=CCCCSCc1cnccn1 62a_100016995436_200011292268 [1,1,0,0,0,0|2,0,0]=4 6945 B13R1.28 O=CCCCSCc1cnccn1 62a_200011292268_100016995436 [1,1,0,0,0,0|2,0,0]=4 6946 B13R1.28 O=CCCCSCc1cncnc1 62a_100015196519_200011292268 [1,1,0,0,0,0|2,0,0]=4 6947 B13R1.28 O=CCCCSCc1cncnc1 62a_200011292268_100015196519 [1,1,0,0,0,0|2,0,0]=4 6948 B13R1.28 O=CCCCSCc1ncccn1 62a_100000703007_200011292268 [1,1,0,0,0,0|2,0,0]=4 6949 B13R1.28 O=CCCCSCc1ncccn1 62a_200011292268_100000703007 [1,1,0,0,0,0|2,0,0]=4 6950 B13R1.28 O=CCNC/C=C/c1ccccc1 2230a_100020603302_200015260668 [1,1,0,0,0,0|0,0,2]=4 6951 B13R1.28 O=CCNC/C=C/c1ccccc1 34a_100020603302_200009817547 [1,1,0,0,0,0|0,0,2]=4 6952 B13R1.28 O=CCNCC#Cc1ccccc1 34a_100000735379_200009817547 [1,1,0,0,0,0|0,0,2]=4 6953 B13R1.28 O=CCNCCCc1ccccc1 2230a_100000211184_200015260668 [1,1,0,0,0,0|0,0,0]=2 6954 B13R1.28 O=CCNCCCc1ccccc1 34a_100000211184_200009817547 [1,1,0,0,0,0|0,0,0]=2 6955 B13R1.28 O=CCNCCCc1cccnc1 2230a_100011532358_200015260668 [1,1,0,0,0,0|1,0,0]=3 6956 B13R1.28 O=CCNCCCc1cccnc1 34a_100011532358_200009817547 [1,1,0,0,0,0|1,0,0]=3 6957 B13R1.28 O=CCNCCCc1ccncc1 2230a_100011275580_200015260668 [1,1,0,0,0,0|1,0,0]=3 6958 B13R1.28 O=CCNCCOc1ccccc1 2230a_100000174943_200015260668 [1,1,0,0,0,0|1,0,0]=3 6959 B13R1.28 O=CCNCCOc1ccccc1 34a_100000174943_200009817547 [1,1,0,0,0,0|1,0,0]=3 6960 B13R1.28 O=CCNCCOc1ccccn1 2230a_106741647558_200015260668 [1,1,0,0,0,0|2,0,0]=4 6961 B13R1.28 O=CCNCCOc1cccnc1 2230a_100000754688_200015260668 [1,1,0,0,0,0|2,0,0]=4 6962 B13R1.28 O=CCNCCSc1ccccc1 2230a_100000189519_200015260668 [1,1,0,0,0,0|1,0,0]=3 6963 B13R1.28 O=CCOC/C=C/c1ccccc1 34a_100000210256_200009817547 [1,1,0,0,0,0|0,0,2]=4 6964 B13R1.28 O=CCOCC#Cc1ccccc1 34a_100011217464_200009817547 [1,1,0,0,0,0|0,0,2]=4 6965 B13R1.28 O=CCOCC#Cc1ccccc1 7a_100011217464_200015260668 [1,1,0,0,0,0|0,0,2]=4 6966 B13R1.28 O=CCOCCCC1=CCC=CC1 34a_100020667889_200009817547 [1,1,0,0,0,0|0,0,2]=4 6967 B13R1.28 O=CCOCCCc1ccccc1 34a_100000210828_200009817547 [1,1,0,0,0,0|0,0,0]=2 6968 B13R1.28 O=CCOCCCc1ccccc1 7a_100000210828_200015260668 [1,1,0,0,0,0|0,0,0]=2 6969 B13R1.28 O=CCOCCCc1ccccn1 34a_100011215068_200009817547 [1,1,0,0,0,0|1,0,0]=3 6970 B13R1.28 O=CCOCCCc1cccnc1 34a_100000211284_200009817547 [1,1,0,0,0,0|1,0,0]=3 6971 B13R1.28 O=CCOCCCc1ccncc1 34a_100000210659_200009817547 [1,1,0,0,0,0|1,0,0]=3 6972 B13R1.28 O=CCOCCNc1ccccc1 34a_100000211345_200009817547 [1,1,0,0,0,0|1,0,0]=3 6973 B13R1.28 O=CCOCCNc1ccncc1 34a_200011243140_200009817547 [1,1,0,0,0,0|2,0,0]=4 6974 B13R1.28 O=CCOCCOc1ccccc1 34a_100000210260_200009817547 [1,1,0,0,0,0|1,0,0]=3 6975 B13R1.28 O=CCOCCOc1ccccc1 7a_100000210260_200015260668 [1,1,0,0,0,0|1,0,0]=3 6976 B13R1.28 O=CCOCCSc1ccccc1 7a_100000230494_200015260668 [1,1,0,0,0,0|1,0,0]=3 6977 B13R1.28 O=CCOCCSc1ccccn1 7a_100000156319_200015260668 [1,1,0,0,0,0|2,0,0]=4 6978 B13R1.28 O=CCSC/C=C/c1ccccc1 62a_100016265936_200015260668 [1,1,0,0,0,0|0,0,2]=4 6979 B13R1.28 O=CCSC/C=C/c1ccccc1 62a_200015260668_100016265936 [1,1,0,0,0,0|0,0,2]=4 6980 B13R1.28 O=CCSCC#Cc1ccccc1 62a_200015260668_100011352542 [1,1,0,0,0,0|0,0,2]=4 6981 B13R1.28 O=CCSCCCc1ccccc1 62a_100000211621_200015260668 [1,1,0,0,0,0|0,0,0]=2 6982 B13R1.28 O=CCSCCCc1ccccc1 62a_200015260668_100000211621 [1,1,0,0,0,0|0,0,0]=2 6983 B13R1.28 O=CCSCCOc1ccccc1 62a_100000184471_200015260668 [1,1,0,0,0,0|1,0,0]=3 6984 B13R1.28 O=CCSCCOc1ccccc1 62a_200015260668_100000184471 [1,1,0,0,0,0|1,0,0]=3 6985 B13R1.28 O=CCSCCSc1ccccc1 62a_100000246102_200015260668 [1,1,0,0,0,0|1,0,0]=3 6986 B13R1.28 O=CCSCCSc1ccccc1 62a_200015260668_100000246102 [1,1,0,0,0,0|1,0,0]=3 6987 B13R1.28 O=CCSCOCc1ccccc1 62a_100000763385_200015260668 [1,1,0,0,0,0|1,0,0]=3 6988 B13R1.28 O=CCSCOCc1ccccc1 62a_200015260668_100000763385 [1,1,0,0,0,0|1,0,0]=3 6989 B13R1.28 O=CCSCSCc1ccccc1 62a_200011217039_200015260668 [1,1,0,0,0,0|1,0,0]=3 6990 B13R1.28 O=CCSCSCc1ccccc1 62a_200015260668_200011217039 [1,1,0,0,0,0|1,0,0]=3 6991 B13R1.28 OCCCCCNc1ccccc1 34a_100000106764_100000746330 [1,1,0,0,0,0|0,0,1]=3 6992 B13R1.28 OCCCCCOc1ccccc1 34a_100000210340_100000746330 [1,1,0,0,0,0|0,0,1]=3 6993 B13R1.28 OCCCCCOc1ccccc1 7a_100000210340_100000746330 [1,1,0,0,0,0|0,0,1]=3 6994 B13R1.28 OCCCCCOc1cccnc1 34a_100000210849_100000746330 [1,1,0,0,0,0|1,0,1]=4 6995 B13R1.28 OCCCCCOc1cccnc1 7a_100000210849_100000746330 [1,1,0,0,0,0|1,0,1]=4 6996 B13R1.28 OCCCCCOc1ccncc1 34a_100000212176_100000746330 [1,1,0,0,0,0|1,0,1]=4 6997 B13R1.28 OCCCCCSc1ccccc1 62a_100000719477_100000746330 [1,1,0,0,0,0|0,0,1]=3 6998 B13R1.28 OCCCCCSc1ccccc1 62a_100000746330_100000041952 [1,1,0,0,0,0|0,0,1]=3 6999 B13R1.28 OCCCCCSc1ccccn1 62a_100000746330_100011216584 [1,1,0,0,0,0|1,0,1]=4 7000 B13R1.28 OCCCCCSc1ccccn1 62a_100011216584_100000746330 [1,1,0,0,0,0|1,0,1]=4 7001 B13R1.28 OCCCCCSc1cccnc1 62a_100000210063_100000746330 [1,1,0,0,0,0|1,0,1]=4 7002 B13R1.28 OCCCCCSc1cccnc1 62a_100000746330_100000210063 [1,1,0,0,0,0|1,0,1]=4 7003 B13R1.28 OCCCCCSc1ccncc1 62a_100000728582_100000746330 [1,1,0,0,0,0|1,0,1]=4 7004 B13R1.28 OCCCCCSc1ccncc1 62a_100000746330_100000728582 [1,1,0,0,0,0|1,0,1]=4 7005 B13R1.28 OCCCCNCc1ccccc1 207a_100000750430_100015611070 [1,1,0,0,0,0|0,0,1]=3 7006 B13R1.28 OCCCCNCc1ccccc1 2230a_100000750430_100015291786 [1,1,0,0,0,0|0,0,1]=3 7007 B13R1.28 OCCCCNCc1ccccc1 2230a_100015324214_100000210776 [1,1,0,0,0,0|0,0,1]=3 7008 B13R1.28 OCCCCNCc1ccccc1 270004a_100000750430_100015611070 [1,1,0,0,0,0|0,0,1]=3 7009 B13R1.28 OCCCCNCc1ccccc1 34a_100000750430_100015291786 [1,1,0,0,0,0|0,0,1]=3 7010 B13R1.28 OCCCCNCc1ccccc1 34a_100015324214_100011216708 [1,1,0,0,0,0|0,0,1]=3 7011 B13R1.28 OCCCCNCc1ccccn1 207a_100000750430_100000209966 [1,1,0,0,0,0|1,0,1]=4 7012 B13R1.28 OCCCCNCc1ccccn1 2230a_100000750430_100000721315 [1,1,0,0,0,0|1,0,1]=4 7013 B13R1.28 OCCCCNCc1ccccn1 270004a_100000750430_100000209966 [1,1,0,0,0,0|1,0,1]=4 7014 B13R1.28 OCCCCNCc1ccccn1 34a_100000750430_100000721315 [1,1,0,0,0,0|1,0,1]=4 7015 B13R1.28 OCCCCNCc1cccnc1 207a_100000750430_100000209961 [1,1,0,0,0,0|1,0,1]=4 7016 B13R1.28 OCCCCNCc1cccnc1 2230a_100000750430_100000741622 [1,1,0,0,0,0|1,0,1]=4 7017 B13R1.28 OCCCCNCc1cccnc1 270004a_100000750430_100000209961 [1,1,0,0,0,0|1,0,1]=4 7018 B13R1.28 OCCCCNCc1cccnc1 34a_100000750430_100000733263 [1,1,0,0,0,0|1,0,1]=4 7019 B13R1.28 OCCCCNCc1ccncc1 207a_100000750430_100000186114 [1,1,0,0,0,0|1,0,1]=4 7020 B13R1.28 OCCCCNCc1ccncc1 2230a_100000750430_100015193705 [1,1,0,0,0,0|1,0,1]=4 7021 B13R1.28 OCCCCOCc1ccccc1 34a_100000210790_100011216708 [1,1,0,0,0,0|0,0,1]=3 7022 B13R1.28 OCCCCOCc1ccccc1 7a_100000210790_100000210776 [1,1,0,0,0,0|0,0,1]=3 7023 B13R1.28 OCCCCSCc1ccccc1 62a_100000210776_100015291786 [1,1,0,0,0,0|0,0,1]=3 7024 B13R1.28 OCCCCSCc1ccccc1 62a_100000211182_100000210776 [1,1,0,0,0,0|0,0,1]=3 7025 B13R1.28 OCCCCSCc1ccccn1 62a_100000210776_100000721315 [1,1,0,0,0,0|1,0,1]=4 7026 B13R1.28 OCCCCSCc1ccccn1 62a_100000721315_100000210776 [1,1,0,0,0,0|1,0,1]=4 7027 B13R1.28 OCCCCSCc1cccnc1 62a_100000210776_100000741622 [1,1,0,0,0,0|1,0,1]=4 7028 B13R1.28 OCCCCSCc1cccnc1 62a_100000741622_100000210776 [1,1,0,0,0,0|1,0,1]=4 7029 B13R1.28 OCCCCSCc1ccncc1 62a_100000210776_100015193705 [1,1,0,0,0,0|1,0,1]=4 7030 B13R1.28 OCCCCSCc1ccncc1 62a_100015193705_100000210776 [1,1,0,0,0,0|1,0,1]=4 7031 B13R1.28 OCCCNCCc1ccccc1 2230a_100000106460_100000230001 [1,1,0,0,0,0|0,0,1]=3 7032 B13R1.28 OCCCNCCc1ccccc1 34a_100000106460_100000230001 [1,1,0,0,0,0|0,0,1]=3 7033 B13R1.28 OCCCNCCc1cccnc1 2230a_100000736294_100000230001 [1,1,0,0,0,0|1,0,1]=4 7034 B13R1.28 OCCCOCCc1ccccc1 34a_100000210268_100000230001 [1,1,0,0,0,0|0,0,1]=3 7035 B13R1.28 OCCCOCCc1ccccc1 7a_100000210268_100011215043 [1,1,0,0,0,0|0,0,1]=3 7036 B13R1.28 OCCCOCCc1ccccn1 34a_100000210271_100000230001 [1,1,0,0,0,0|1,0,1]=4 7037 B13R1.28 OCCCOCCc1cccnc1 34a_100011217484_100000230001 [1,1,0,0,0,0|1,0,1]=4 7038 B13R1.28 OCCCOCCc1ccncc1 34a_100011216225_100000230001 [1,1,0,0,0,0|1,0,1]=4 7039 B13R1.28 OCCCSCCc1ccccc1 62a_100000765856_100011215043 [1,1,0,0,0,0|0,0,1]=3 7040 B13R1.28 OCCCSCCc1ccccc1 62a_100011215043_100011218657 [1,1,0,0,0,0|0,0,1]=3 7041 B13R1.28 OCCCSCCc1ccccn1 62a_100011215043_100015183660 [1,1,0,0,0,0|1,0,1]=4 7042 B13R1.28 OCCCSCCc1ccccn1 62a_100015183660_100011215043 [1,1,0,0,0,0|1,0,1]=4 7043 B13R1.28 OCCCSCCc1cccnc1 62a_100011215043_200011713674 [1,1,0,0,0,0|1,0,1]=4 7044 B13R1.28 OCCCSCCc1cccnc1 62a_200011713674_100011215043 [1,1,0,0,0,0|1,0,1]=4 7045 B13R1.28 OCCCSCCc1ccncc1 62a_100000723409_100011215043 [1,1,0,0,0,0|1,0,1]=4 7046 B13R1.28 OCCCSCCc1ccncc1 62a_100011215043_100000723409 [1,1,0,0,0,0|1,0,1]=4 7047 B13R1.28 OCCCSCSc1ccccc1 62a_100011215043_100011218342 [1,1,0,0,0,0|1,0,1]=4 7048 B13R1.28 OCCCSCSc1ccccc1 62a_100011218342_100011215043 [1,1,0,0,0,0|1,0,1]=4 7049 B13R1.28 OCCNCCCc1ccccc1 2230a_100000211184_100000211926 [1,1,0,0,0,0|0,0,1]=3 7050 B13R1.28 OCCNCCCc1ccccc1 2230a_100016997473_100000211621 [1,1,0,0,0,0|0,0,1]=3 7051 B13R1.28 OCCNCCCc1ccccc1 34a_100000211184_100000211926 [1,1,0,0,0,0|0,0,1]=3 7052 B13R1.28 OCCNCCCc1ccccc1 34a_100016990907_100000211621 [1,1,0,0,0,0|0,0,1]=3 7053 B13R1.28 OCCNCCCc1cccnc1 2230a_100011532358_100000211926 [1,1,0,0,0,0|1,0,1]=4 7054 B13R1.28 OCCNCCCc1cccnc1 34a_100011532358_100000211926 [1,1,0,0,0,0|1,0,1]=4 7055 B13R1.28 OCCNCCCc1ccncc1 2230a_100011275580_100000211926 [1,1,0,0,0,0|1,0,1]=4 7056 B13R1.28 OCCNCCOc1ccccc1 2230a_100000174943_100000211926 [1,1,0,0,0,0|1,0,1]=4 7057 B13R1.28 OCCNCCOc1ccccc1 2230a_100016997473_100000184471 [1,1,0,0,0,0|1,0,1]=4 7058 B13R1.28 OCCNCCOc1ccccc1 270004a_100000210304_100000758736 [1,1,0,0,0,0|1,0,1]=4 7059 B13R1.28 OCCNCCOc1ccccc1 34a_100000174943_100000211926 [1,1,0,0,0,0|1,0,1]=4 7060 B13R1.28 OCCNCCOc1ccccc1 34a_100016990907_100000184471 [1,1,0,0,0,0|1,0,1]=4 7061 B13R1.28 OCCNCCSc1ccccc1 2230a_100000189519_100000211926 [1,1,0,0,0,0|1,0,1]=4 7062 B13R1.28 OCCNCCSc1ccccc1 2230a_100016997473_100000246102 [1,1,0,0,0,0|1,0,1]=4 7063 B13R1.28 OCCNCCSc1ccccc1 34a_100016990907_100000246102 [1,1,0,0,0,0|1,0,1]=4 7064 B13R1.28 OCCNCOCc1ccccc1 2230a_100016997473_100000763385 [1,1,0,0,0,0|1,0,1]=4 7065 B13R1.28 OCCNCOCc1ccccc1 34a_100016990907_100000763385 [1,1,0,0,0,0|1,0,1]=4 7066 B13R1.28 OCCNCSCc1ccccc1 2230a_100016997473_200011217039 [1,1,0,0,0,0|1,0,1]=4 7067 B13R1.28 OCCNCSCc1ccccc1 34a_100016990907_200011217039 [1,1,0,0,0,0|1,0,1]=4 7068 B13R1.28 OCCOCCCc1ccccc1 34a_100000210828_100000211926 [1,1,0,0,0,0|0,0,1]=3 7069 B13R1.28 OCCOCCCc1ccccc1 7a_100000210828_100000211926 [1,1,0,0,0,0|0,0,1]=3 7070 B13R1.28 OCCOCCCc1ccccn1 34a_100011215068_100000211926 [1,1,0,0,0,0|1,0,1]=4 7071 B13R1.28 OCCOCCCc1cccnc1 34a_100000211284_100000211926 [1,1,0,0,0,0|1,0,1]=4 7072 B13R1.28 OCCOCCCc1ccncc1 34a_100000210659_100000211926 [1,1,0,0,0,0|1,0,1]=4 7073 B13R1.28 OCCOCCNc1ccccc1 34a_100000106764_100000692535 [1,1,0,0,0,0|1,0,1]=4 7074 B13R1.28 OCCOCCNc1ccccc1 34a_100000211345_100000211926 [1,1,0,0,0,0|1,0,1]=4 7075 B13R1.28 OCCOCCOc1ccccc1 34a_100000210260_100000211926 [1,1,0,0,0,0|1,0,1]=4 7076 B13R1.28 OCCOCCOc1ccccc1 34a_100000210340_100000692535 [1,1,0,0,0,0|1,0,1]=4 7077 B13R1.28 OCCOCCOc1ccccc1 7a_100000210260_100000211926 [1,1,0,0,0,0|1,0,1]=4 7078 B13R1.28 OCCOCCOc1ccccc1 7a_100000210340_100011215305 [1,1,0,0,0,0|1,0,1]=4 7079 B13R1.28 OCCOCCSc1ccccc1 62a_100000719477_100011215305 [1,1,0,0,0,0|1,0,1]=4 7080 B13R1.28 OCCOCCSc1ccccc1 62a_100011215305_100000041952 [1,1,0,0,0,0|1,0,1]=4 7081 B13R1.28 OCCOCCSc1ccccc1 7a_100000230494_100000211926 [1,1,0,0,0,0|1,0,1]=4 7082 B13R1.28 OCCSCCCc1ccccc1 62a_100000211621_100000211926 [1,1,0,0,0,0|0,0,1]=3 7083 B13R1.28 OCCSCCCc1ccccc1 62a_100000211926_100000211621 [1,1,0,0,0,0|0,0,1]=3 7084 B13R1.28 OCCSCCOc1ccccc1 62a_100000184471_100000211926 [1,1,0,0,0,0|1,0,1]=4 7085 B13R1.28 OCCSCCOc1ccccc1 62a_100000211926_100000184471 [1,1,0,0,0,0|1,0,1]=4 7086 B13R1.28 OCCSCCSc1ccccc1 62a_100000211926_100000246102 [1,1,0,0,0,0|1,0,1]=4 7087 B13R1.28 OCCSCCSc1ccccc1 62a_100000246102_100000211926 [1,1,0,0,0,0|1,0,1]=4 7088 B13R1.28 OCCSCOCc1ccccc1 62a_100000211926_100000763385 [1,1,0,0,0,0|1,0,1]=4 7089 B13R1.28 OCCSCOCc1ccccc1 62a_100000763385_100000211926 [1,1,0,0,0,0|1,0,1]=4 7090 B13R1.28 OCCSCSCc1ccccc1 62a_100000211926_200011217039 [1,1,0,0,0,0|1,0,1]=4 7091 B13R1.28 OCCSCSCc1ccccc1 62a_200011217039_100000211926 [1,1,0,0,0,0|1,0,1]=4 7092 B13R1.28 [13CH3]NCCCCCc1ccccc1 2230a_100000750932_200025704644 [1,1,0,0,0,0|1,0,1]=4 7093 B13R1.28 [13CH3]NCCCCCc1ccccc1 34a_100000750932_200025704644 [1,1,0,0,0,0|1,0,1]=4 7094 B13R1.28 [13CH3]NCCCOCc1ccccc1 2230a_200000206031_200025704644 [1,1,0,0,0,0|2,0,0]=4 7095 B13R1.28 [13CH3]NCCCOCc1ccccc1 34a_200000206031_200025704644 [1,1,0,0,0,0|2,0,0]=4 7096 B13R1.28 [13CH3]OCCCCCc1ccccc1 34a_200011219639_200025704644 [1,1,0,0,0,0|0,0,1]=3 7097 B13R1.28 [13CH3]OCCCCCc1ccccc1 7a_200011219639_200025704644 [1,1,0,0,0,0|0,0,1]=3 7098 B13R1.28 [13CH3]OCCCCOc1ccccc1 34a_100000752354_200025704644 [1,1,0,0,0,0|1,0,1]=4 7099 B13R1.28 [13CH3]OCCCCOc1ccccc1 7a_100000752354_200025704644 [1,1,0,0,0,0|1,0,1]=4 7100 B13R1.28 [13CH3]OCCCNCc1ccccc1 34a_100000185501_200025704644 [1,1,0,0,0,0|1,0,1]=4 7101 B13R1.28 [13CH3]OCCCOCc1ccccc1 34a_100000691849_200025704644 [1,1,0,0,0,0|1,0,1]=4 7102 B13R1.28 [13CH3]OCCCOCc1ccccc1 7a_100000691849_200025704644 [1,1,0,0,0,0|1,0,1]=4 7103 B13R1.28 [13CH3]SCCCCCc1ccccc1 62a_200011217138_200025704644 [1,1,0,0,0,0|0,1,1]=4 7104 B13R1.28 [13CH3]SCCCCCc1ccccc1 62a_200025704644_200011217138 [1,1,0,0,0,0|0,1,1]=4 7105 B13R1.28 [13CH3]SCCCCOc1ccccc1 62a_100011215240_200025704644 [1,1,0,0,0,0|2,0,0]=4 7106 B13R1.28 [13CH3]SCCCCOc1ccccc1 62a_200025704644_100011215240 [1,1,0,0,0,0|2,0,0]=4 7107 B13R1.28 [13CH3]SCCCOCc1ccccc1 62a_100011215529_200025704644 [1,1,0,0,0,0|2,0,0]=4 7108 B13R1.28 [13CH3]SCCCOCc1ccccc1 62a_200025704644_100011215529 [1,1,0,0,0,0|2,0,0]=4 7109 B13R1.42 C=CCC(=O)CCc1ccccc1 1458a_100000185753_100000210623 [1,1,0,0,0,0|1,0,1]=4 7110 B13R1.42 C=CCC(=O)CCc1ccccc1 1458a_100000210193_100000765856 [1,1,0,0,0,0|1,0,1]=4 7111 B13R1.42 C=CCN(C)CCc1ccccc1 2230a_100000207497_100000210623 [1,1,0,0,0,0|2,0,0]=4 7112 B13R1.42 C=CCN(C)CCc1ccccc1 2230a_100000225617_100000765856 [1,1,0,0,0,0|2,0,0]=4 7113 B13R1.42 C=CCN(C)CCc1ccccc1 269982a_100000207497_100000210623 [1,1,0,0,0,0|2,0,0]=4 7114 B13R1.42 C=CCN(C)CCc1ccccc1 269982a_100000225617_100000765856 [1,1,0,0,0,0|2,0,0]=4 7115 B13R1.42 C=CC[C@@H](C)OCc1ccccc1 34a_100000731007_100015291786 [1,1,0,0,0,0|2,0,0]=4 7116 B13R1.42 C=CC[C@@H](C)OCc1ccccc1 7a_100000731007_100000211182 [1,1,0,0,0,0|2,0,0]=4 7117 B13R1.42 CC(CCO)NCc1ccccc1 2230a_100015324214_100009893172 [1,1,0,0,0,0|1,0,1]=4 7118 B13R1.42 CC(CCO)NCc1ccccc1 34a_100015324214_100009893172 [1,1,0,0,0,0|1,0,1]=4 7119 B13R1.42 CC(CCO)OCc1ccccc1 34a_100000210790_100009893172 [1,1,0,0,0,0|1,0,1]=4 7120 B13R1.42 CC(CCO)OCc1ccccc1 7a_100000210790_100009893172 [1,1,0,0,0,0|1,0,1]=4 7121 B13R1.42 CC(CCO)SCc1ccccc1 62a_100000211182_100009893172 [1,1,0,0,0,0|1,0,1]=4 7122 B13R1.42 CC(CCO)SCc1ccccc1 62a_100009893172_100015291786 [1,1,0,0,0,0|1,0,1]=4 7123 B13R1.42 CN(CC=O)CCc1ccccc1 2230a_100000207497_200015260668 [1,1,0,0,0,0|1,0,0]=3 7124 B13R1.42 CN(CC=O)CCc1ccccc1 269982a_100000207497_200015260668 [1,1,0,0,0,0|1,0,0]=3 7125 B13R1.42 CN(CC=O)CCc1ccccn1 2230a_100000737206_200015260668 [1,1,0,0,0,0|2,0,0]=4 7126 B13R1.42 CN(CC=O)CCc1ccccn1 269982a_100000737206_200015260668 [1,1,0,0,0,0|2,0,0]=4 7127 B13R1.42 CN(CC=O)CCc1cccnc1 2230a_100000763209_200015260668 [1,1,0,0,0,0|2,0,0]=4 7128 B13R1.42 CN(CC=O)CCc1cccnc1 269982a_100000763209_200015260668 [1,1,0,0,0,0|2,0,0]=4 7129 B13R1.42 CN(CC=O)CCc1ccncc1 2230a_100000742850_200015260668 [1,1,0,0,0,0|2,0,0]=4 7130 B13R1.42 CN(CC=O)CCc1ccncc1 269982a_100000742850_200015260668 [1,1,0,0,0,0|2,0,0]=4 7131 B13R1.42 CN(CCO)CCc1ccccc1 2230a_100000207497_100000211926 [1,1,0,0,0,0|1,0,1]=4 7132 B13R1.42 CN(CCO)CCc1ccccc1 2230a_100000210263_100000765856 [1,1,0,0,0,0|1,0,1]=4 7133 B13R1.42 CN(CCO)CCc1ccccc1 269982a_100000207497_100000211926 [1,1,0,0,0,0|1,0,1]=4 7134 B13R1.42 CN(CCO)CCc1ccccc1 269982a_100000210263_100000765856 [1,1,0,0,0,0|1,0,1]=4 7135 B13R1.42 C[C@H](CCO)NCc1ccccc1 207a_100000706166_100015611070 [1,1,0,0,0,0|1,0,1]=4 7136 B13R1.42 C[C@H](CCO)NCc1ccccc1 2230a_100000706166_100015291786 [1,1,0,0,0,0|1,0,1]=4 7137 B13R1.42 C[C@H](CCO)NCc1ccccc1 270004a_100000706166_100015611070 [1,1,0,0,0,0|1,0,1]=4 7138 B13R1.42 C[C@H](CCO)NCc1ccccc1 34a_100000706166_100015291786 [1,1,0,0,0,0|1,0,1]=4 7139 B13R1.42 O=C(CCO)CCc1ccccc1 1458a_100000185753_100000211926 [1,1,0,0,0,0|0,0,2]=4 7140 B13R1.42 O=C(CCO)CCc1ccccc1 1458a_100011216618_100000765856 [1,1,0,0,0,0|0,0,2]=4 7141 B13R1.44 C=CCCC(=O)Cc1ccccc1 1458a_100000749702_100015291786 [1,1,0,0,0,0|1,0,1]=4 7142 B13R1.44 C=CCCN(C)Cc1ccccc1 2230a_100000186898_100000754431 [1,1,0,0,0,0|2,0,0]=4 7143 B13R1.44 C=CCCN(C)Cc1ccccc1 2230a_100011934112_200000210301 [1,1,0,0,0,0|2,0,0]=4 7144 B13R1.44 C=CCCN(C)Cc1ccccc1 2230a_100020639649_100015291786 [1,1,0,0,0,0|2,0,0]=4 7145 B13R1.44 C=CCCN(C)Cc1ccccc1 269982a_100000186898_100000754431 [1,1,0,0,0,0|2,0,0]=4 7146 B13R1.44 C=CCCN(C)Cc1ccccc1 269982a_100011934112_200000210301 [1,1,0,0,0,0|2,0,0]=4 7147 B13R1.44 C=CCCN(C)Cc1ccccc1 269982a_100020639649_100000211182 [1,1,0,0,0,0|2,0,0]=4 7148 B13R1.44 C=CCCN(C)Cc1ccccc1 270004a_100020639649_100015611070 [1,1,0,0,0,0|2,0,0]=4 7149 B13R1.44 C=CCCN([13CH3])Cc1ccccc1 2230a_100011934112_200025704644 [1,1,0,0,0,0|2,0,0]=4 7150 B13R1.44 C=CCCN([13CH3])Cc1ccccc1 269982a_100011934112_200025704644 [1,1,0,0,0,0|2,0,0]=4 7151 B13R1.44 C=CCOC(C)Cc1ccccc1 34a_100000748627_100015514636 [1,1,0,0,0,0|2,0,0]=4 7152 B13R1.44 C=CCOC(C)Cc1ccccc1 34a_200000210373_200011218536 [1,1,0,0,0,0|2,0,0]=4 7153 B13R1.44 C=CCOC(C)Cc1ccccc1 7a_100000748627_100015514636 [1,1,0,0,0,0|2,0,0]=4 7154 B13R1.44 C=CCSC(C)Cc1ccccc1 62a_100000210623_200011218536 [1,1,0,0,0,0|2,0,0]=4 7155 B13R1.44 C=CCSC(C)Cc1ccccc1 62a_200011218536_100000210623 [1,1,0,0,0,0|2,0,0]=4 7156 B13R1.44 CC(Cc1ccccc1)NCCO 34a_100016990907_200011218536 [1,1,0,0,0,0|1,0,1]=4 7157 B13R1.44 CC(Cc1ccccc1)OCC=O 34a_100000748627_200009817547 [1,1,0,0,0,0|1,0,0]=3 7158 B13R1.44 CC(Cc1ccccc1)OCC=O 7a_100000748627_200015260668 [1,1,0,0,0,0|1,0,0]=3 7159 B13R1.44 CC(Cc1ccccc1)OCCO 34a_100000748627_100000211926 [1,1,0,0,0,0|1,0,1]=4 7160 B13R1.44 CC(Cc1ccccc1)OCCO 7a_100000748627_100000211926 [1,1,0,0,0,0|1,0,1]=4 7161 B13R1.44 CC(Cc1ccccc1)SCC=O 62a_200011218536_200015260668 [1,1,0,0,0,0|1,0,0]=3 7162 B13R1.44 CC(Cc1ccccc1)SCC=O 62a_200015260668_200011218536 [1,1,0,0,0,0|1,0,0]=3 7163 B13R1.44 CC(Cc1ccccc1)SCCO 62a_100000211926_200011218536 [1,1,0,0,0,0|1,0,1]=4 7164 B13R1.44 CC(Cc1ccccc1)SCCO 62a_200011218536_100000211926 [1,1,0,0,0,0|1,0,1]=4 7165 B13R1.44 CC(Cc1ccccn1)NCC=O 2230a_100000238496_200015260668 [1,1,0,0,0,0|2,0,0]=4 7166 B13R1.44 CC(Cc1cccnc1)NCC=O 2230a_100011207255_200015260668 [1,1,0,0,0,0|2,0,0]=4 7167 B13R1.44 CN(CCCO)Cc1ccccc1 2230a_100000185501_200000210301 [1,1,0,0,0,0|1,0,1]=4 7168 B13R1.44 CN(CCCO)Cc1ccccc1 2230a_100000186898_100000230001 [1,1,0,0,0,0|1,0,1]=4 7169 B13R1.44 CN(CCCO)Cc1ccccc1 2230a_100000213112_100015291786 [1,1,0,0,0,0|1,0,1]=4 7170 B13R1.44 CN(CCCO)Cc1ccccc1 269982a_100000185501_200000210301 [1,1,0,0,0,0|1,0,1]=4 7171 B13R1.44 CN(CCCO)Cc1ccccc1 269982a_100000186898_100011215043 [1,1,0,0,0,0|1,0,1]=4 7172 B13R1.44 CN(CCCO)Cc1ccccc1 269982a_100000213112_100000211182 [1,1,0,0,0,0|1,0,1]=4 7173 B13R1.44 CN(CCCO)Cc1ccccc1 270004a_100000213112_100015611070 [1,1,0,0,0,0|1,0,1]=4 7174 B13R1.44 [13CH3]N(CCCO)Cc1ccccc1 2230a_100000185501_200025704644 [1,1,0,0,0,0|1,0,1]=4 7175 B13R1.44 [13CH3]N(CCCO)Cc1ccccc1 269982a_100000185501_200025704644 [1,1,0,0,0,0|1,0,1]=4 7176 B13R1.555 C=CCCCNc1ccccc1Br 34a_100000210017_100000757094 [1,1,0,0,0,0|2,0,0]=4 7177 B13R1.555 C=CCCCNc1ccccc1C 34a_100015192222_100000757094 [1,1,0,0,0,0|2,0,0]=4 7178 B13R1.555 C=CCCCNc1ccccc1Cl 34a_100000185783_100000757094 [1,1,0,0,0,0|2,0,0]=4 7179 B13R1.555 C=CCCCNc1ccccc1F 34a_100000210422_100000757094 [1,1,0,0,0,0|2,0,0]=4 7180 B13R1.555 C=CCCCNc1ccccc1I 34a_100000210053_100000757094 [1,1,0,0,0,0|2,0,0]=4 7181 B13R1.555 C=CCCCNc1ccccc1O 34a_100000185747_100000757094 [1,1,0,0,0,0|2,0,0]=4 7182 B13R1.555 C=CCCCOc1ccccc1Br 34a_100000181306_100000757094 [1,1,0,0,0,0|2,0,0]=4 7183 B13R1.555 C=CCCCOc1ccccc1Br 7a_100000181306_100000757094 [1,1,0,0,0,0|2,0,0]=4 7184 B13R1.555 C=CCCCOc1ccccc1C 34a_100000210338_100000757094 [1,1,0,0,0,0|2,0,0]=4 7185 B13R1.555 C=CCCCOc1ccccc1C 7a_100000210338_100000757094 [1,1,0,0,0,0|2,0,0]=4 7186 B13R1.555 C=CCCCOc1ccccc1Cl 34a_100000210172_100000757094 [1,1,0,0,0,0|2,0,0]=4 7187 B13R1.555 C=CCCCOc1ccccc1Cl 7a_100000210172_100000757094 [1,1,0,0,0,0|2,0,0]=4 7188 B13R1.555 C=CCCCOc1ccccc1F 34a_100000210171_100000757094 [1,1,0,0,0,0|2,0,0]=4 7189 B13R1.555 C=CCCCOc1ccccc1F 7a_100000210171_100000757094 [1,1,0,0,0,0|2,0,0]=4 7190 B13R1.555 C=CCCCOc1ccccc1I 34a_100000739446_100000757094 [1,1,0,0,0,0|2,0,0]=4 7191 B13R1.555 C=CCCCOc1ccccc1I 7a_100000739446_100000757094 [1,1,0,0,0,0|2,0,0]=4 7192 B13R1.555 C=CCCCOc1ccccc1N 34a_100000185747_100000757094 [1,1,0,0,0,0|2,0,0]=4 7193 B13R1.555 C=CCCCOc1ccccc1N 7a_100000185747_100000757094 [1,1,0,0,0,0|2,0,0]=4 7194 B13R1.555 C=CCCCSc1ccccc1Br 62a_100000695589_100000757094 [1,1,0,0,0,0|2,0,0]=4 7195 B13R1.555 C=CCCCSc1ccccc1Br 62a_100011713584_100000695589 [1,1,0,0,0,0|2,0,0]=4 7196 B13R1.555 C=CCCCSc1ccccc1C 62a_100000210755_100000757094 [1,1,0,0,0,0|2,0,0]=4 7197 B13R1.555 C=CCCCSc1ccccc1C 62a_100011713584_100000210755 [1,1,0,0,0,0|2,0,0]=4 7198 B13R1.555 C=CCCCSc1ccccc1Cl 62a_100000764095_100000757094 [1,1,0,0,0,0|2,0,0]=4 7199 B13R1.555 C=CCCCSc1ccccc1Cl 62a_100011713584_100000764095 [1,1,0,0,0,0|2,0,0]=4 7200 B13R1.555 C=CCCCSc1ccccc1F 62a_100011215700_100000757094 [1,1,0,0,0,0|2,0,0]=4 7201 B13R1.555 C=CCCCSc1ccccc1F 62a_100011713584_100011215700 [1,1,0,0,0,0|2,0,0]=4 7202 B13R1.555 C=CCCCSc1ccccc1N 62a_100000210017_100000757094 [1,1,0,0,0,0|2,0,0]=4 7203 B13R1.555 C=CCCCSc1ccccc1N 62a_100011713584_100000210017 [1,1,0,0,0,0|2,0,0]=4 7204 B13R1.555 C=CCCCSc1ccccc1O 62a_100000739446_100000757094 [1,1,0,0,0,0|2,0,0]=4 7205 B13R1.555 C=CCCCSc1ccccc1O 62a_100011713584_100000739446 [1,1,0,0,0,0|2,0,0]=4 7206 B13R1.555 C=CCCNCc1ccccc1Br 207a_100015191253_100000211189 [1,1,0,0,0,0|2,0,0]=4 7207 B13R1.555 C=CCCNCc1ccccc1Br 2230a_100000689332_100000754431 [1,1,0,0,0,0|2,0,0]=4 7208 B13R1.555 C=CCCNCc1ccccc1Br 2230a_100015191253_100000184730 [1,1,0,0,0,0|2,0,0]=4 7209 B13R1.555 C=CCCNCc1ccccc1Br 270004a_100015191253_100000211189 [1,1,0,0,0,0|2,0,0]=4 7210 B13R1.555 C=CCCNCc1ccccc1Br 34a_100000689332_100000754431 [1,1,0,0,0,0|2,0,0]=4 7211 B13R1.555 C=CCCNCc1ccccc1C 207a_100015191253_100000211143 [1,1,0,0,0,0|2,0,0]=4 7212 B13R1.555 C=CCCNCc1ccccc1C 2230a_100015191253_100000211839 [1,1,0,0,0,0|2,0,0]=4 7213 B13R1.555 C=CCCNCc1ccccc1C 270004a_100015191253_100000211143 [1,1,0,0,0,0|2,0,0]=4 7214 B13R1.555 C=CCCNCc1ccccc1C 34a_100000174972_100000754431 [1,1,0,0,0,0|2,0,0]=4 7215 B13R1.555 C=CCCNCc1ccccc1Cl 207a_100015191253_100000210073 [1,1,0,0,0,0|2,0,0]=4 7216 B13R1.555 C=CCCNCc1ccccc1Cl 2230a_100000174879_100000754431 [1,1,0,0,0,0|2,0,0]=4 7217 B13R1.555 C=CCCNCc1ccccc1Cl 2230a_100015191253_100000187162 [1,1,0,0,0,0|2,0,0]=4 7218 B13R1.555 C=CCCNCc1ccccc1Cl 270004a_100015191253_100000210073 [1,1,0,0,0,0|2,0,0]=4 7219 B13R1.555 C=CCCNCc1ccccc1Cl 34a_100000174879_100000754431 [1,1,0,0,0,0|2,0,0]=4 7220 B13R1.555 C=CCCNCc1ccccc1F 207a_100015191253_100000210811 [1,1,0,0,0,0|2,0,0]=4 7221 B13R1.555 C=CCCNCc1ccccc1F 2230a_100015191253_100000211605 [1,1,0,0,0,0|2,0,0]=4 7222 B13R1.555 C=CCCNCc1ccccc1F 270004a_100015191253_100000210811 [1,1,0,0,0,0|2,0,0]=4 7223 B13R1.555 C=CCCNCc1ccccc1F 34a_100000174869_100000754431 [1,1,0,0,0,0|2,0,0]=4 7224 B13R1.555 C=CCCNCc1ccccc1I 207a_100015191253_100000010305 [1,1,0,0,0,0|2,0,0]=4 7225 B13R1.555 C=CCCNCc1ccccc1I 2230a_100015191253_100011215278 [1,1,0,0,0,0|2,0,0]=4 7226 B13R1.555 C=CCCNCc1ccccc1I 270004a_100015191253_100000010305 [1,1,0,0,0,0|2,0,0]=4 7227 B13R1.555 C=CCCNCc1ccccc1O 34a_100000185550_100000754431 [1,1,0,0,0,0|2,0,0]=4 7228 B13R1.555 C=CCCOCc1ccccc1Br 34a_100000756307_100000754431 [1,1,0,0,0,0|2,0,0]=4 7229 B13R1.555 C=CCCOCc1ccccc1Br 34a_100011205117_100000184730 [1,1,0,0,0,0|2,0,0]=4 7230 B13R1.555 C=CCCOCc1ccccc1Br 7a_100000756307_100000754431 [1,1,0,0,0,0|2,0,0]=4 7231 B13R1.555 C=CCCOCc1ccccc1C 34a_100000698903_100000754431 [1,1,0,0,0,0|2,0,0]=4 7232 B13R1.555 C=CCCOCc1ccccc1C 34a_100011205117_100000211839 [1,1,0,0,0,0|2,0,0]=4 7233 B13R1.555 C=CCCOCc1ccccc1C 7a_100000698903_100000754431 [1,1,0,0,0,0|2,0,0]=4 7234 B13R1.555 C=CCCOCc1ccccc1Cl 34a_100000210847_100000754431 [1,1,0,0,0,0|2,0,0]=4 7235 B13R1.555 C=CCCOCc1ccccc1Cl 34a_100011205117_100000187162 [1,1,0,0,0,0|2,0,0]=4 7236 B13R1.555 C=CCCOCc1ccccc1Cl 7a_100000210847_100000754431 [1,1,0,0,0,0|2,0,0]=4 7237 B13R1.555 C=CCCOCc1ccccc1F 34a_100000211962_100000754431 [1,1,0,0,0,0|2,0,0]=4 7238 B13R1.555 C=CCCOCc1ccccc1F 34a_100011205117_100000211605 [1,1,0,0,0,0|2,0,0]=4 7239 B13R1.555 C=CCCOCc1ccccc1F 7a_100000211962_100000754431 [1,1,0,0,0,0|2,0,0]=4 7240 B13R1.555 C=CCCOCc1ccccc1I 34a_100000187465_100000754431 [1,1,0,0,0,0|2,0,0]=4 7241 B13R1.555 C=CCCOCc1ccccc1I 34a_100011205117_100011215278 [1,1,0,0,0,0|2,0,0]=4 7242 B13R1.555 C=CCCOCc1ccccc1I 7a_100000187465_100000754431 [1,1,0,0,0,0|2,0,0]=4 7243 B13R1.555 C=CCCOCc1ccccc1N 34a_100000212039_100000754431 [1,1,0,0,0,0|2,0,0]=4 7244 B13R1.555 C=CCCSCc1ccccc1Br 62a_100000184730_100000754431 [1,1,0,0,0,0|2,0,0]=4 7245 B13R1.555 C=CCCSCc1ccccc1Br 62a_100000754431_100000184730 [1,1,0,0,0,0|2,0,0]=4 7246 B13R1.555 C=CCCSCc1ccccc1C 62a_100000211839_100000754431 [1,1,0,0,0,0|2,0,0]=4 7247 B13R1.555 C=CCCSCc1ccccc1C 62a_100000754431_100000211839 [1,1,0,0,0,0|2,0,0]=4 7248 B13R1.555 C=CCCSCc1ccccc1Cl 62a_100000187162_100000754431 [1,1,0,0,0,0|2,0,0]=4 7249 B13R1.555 C=CCCSCc1ccccc1Cl 62a_100000754431_100000187162 [1,1,0,0,0,0|2,0,0]=4 7250 B13R1.555 C=CCCSCc1ccccc1F 62a_100000211605_100000754431 [1,1,0,0,0,0|2,0,0]=4 7251 B13R1.555 C=CCCSCc1ccccc1F 62a_100000754431_100000211605 [1,1,0,0,0,0|2,0,0]=4 7252 B13R1.555 C=CCCSCc1ccccc1I 62a_100000754431_100011216222 [1,1,0,0,0,0|2,0,0]=4 7253 B13R1.555 C=CCCSCc1ccccc1I 62a_100011216222_100000754431 [1,1,0,0,0,0|2,0,0]=4 7254 B13R1.555 C=CCNCCc1ccccc1Br 2230a_100000747383_100000210623 [1,1,0,0,0,0|2,0,0]=4 7255 B13R1.555 C=CCNCCc1ccccc1Br 2230a_100020586998_100012161201 [1,1,0,0,0,0|2,0,0]=4 7256 B13R1.555 C=CCNCCc1ccccc1Br 34a_100000747383_100015514636 [1,1,0,0,0,0|2,0,0]=4 7257 B13R1.555 C=CCNCCc1ccccc1C 2230a_100000685071_100000210623 [1,1,0,0,0,0|2,0,0]=4 7258 B13R1.555 C=CCNCCc1ccccc1C 2230a_100020586998_100011713688 [1,1,0,0,0,0|2,0,0]=4 7259 B13R1.555 C=CCNCCc1ccccc1C 34a_100000685071_100015514636 [1,1,0,0,0,0|2,0,0]=4 7260 B13R1.555 C=CCNCCc1ccccc1Cl 2230a_100011207228_100000210623 [1,1,0,0,0,0|2,0,0]=4 7261 B13R1.555 C=CCNCCc1ccccc1Cl 2230a_100020586998_100011713703 [1,1,0,0,0,0|2,0,0]=4 7262 B13R1.555 C=CCNCCc1ccccc1Cl 270004a_100020586998_200011713468 [1,1,0,0,0,0|2,0,0]=4 7263 B13R1.555 C=CCNCCc1ccccc1Cl 34a_100011207228_100015514636 [1,1,0,0,0,0|2,0,0]=4 7264 B13R1.555 C=CCNCCc1ccccc1F 2230a_100000185272_100000210623 [1,1,0,0,0,0|2,0,0]=4 7265 B13R1.555 C=CCNCCc1ccccc1F 2230a_100020586998_100011713696 [1,1,0,0,0,0|2,0,0]=4 7266 B13R1.555 C=CCNCCc1ccccc1F 34a_100000185272_100015514636 [1,1,0,0,0,0|2,0,0]=4 7267 B13R1.555 C=CCNCCc1ccccc1O 34a_100011207237_100015514636 [1,1,0,0,0,0|2,0,0]=4 7268 B13R1.555 C=CCOCCc1ccccc1Br 34a_100000731337_100015514636 [1,1,0,0,0,0|2,0,0]=4 7269 B13R1.555 C=CCOCCc1ccccc1Br 34a_200000210373_100012161201 [1,1,0,0,0,0|2,0,0]=4 7270 B13R1.555 C=CCOCCc1ccccc1Br 7a_100000731337_100015514636 [1,1,0,0,0,0|2,0,0]=4 7271 B13R1.555 C=CCOCCc1ccccc1C 34a_100011220023_100015514636 [1,1,0,0,0,0|2,0,0]=4 7272 B13R1.555 C=CCOCCc1ccccc1C 34a_200000210373_100011713688 [1,1,0,0,0,0|2,0,0]=4 7273 B13R1.555 C=CCOCCc1ccccc1C 7a_100011220023_100015514636 [1,1,0,0,0,0|2,0,0]=4 7274 B13R1.555 C=CCOCCc1ccccc1Cl 34a_100011215284_100015514636 [1,1,0,0,0,0|2,0,0]=4 7275 B13R1.555 C=CCOCCc1ccccc1Cl 34a_200000210373_100011713703 [1,1,0,0,0,0|2,0,0]=4 7276 B13R1.555 C=CCOCCc1ccccc1Cl 7a_100011215284_100015514636 [1,1,0,0,0,0|2,0,0]=4 7277 B13R1.555 C=CCOCCc1ccccc1F 34a_100000753711_100015514636 [1,1,0,0,0,0|2,0,0]=4 7278 B13R1.555 C=CCOCCc1ccccc1F 34a_200000210373_100000720011 [1,1,0,0,0,0|2,0,0]=4 7279 B13R1.555 C=CCOCCc1ccccc1F 7a_100000753711_100015514636 [1,1,0,0,0,0|2,0,0]=4 7280 B13R1.555 C=CCOCCc1ccccc1I 34a_100010255290_100015514636 [1,1,0,0,0,0|2,0,0]=4 7281 B13R1.555 C=CCOCCc1ccccc1I 7a_100010255290_100015514636 [1,1,0,0,0,0|2,0,0]=4 7282 B13R1.555 C=CCOCCc1ccccc1N 34a_100011215289_100015514636 [1,1,0,0,0,0|2,0,0]=4 7283 B13R1.555 C=CCOCCc1ccccc1O 34a_200000210373_100000722297 [1,1,0,0,0,0|2,0,0]=4 7284 B13R1.555 C=CCSCCc1ccccc1Br 62a_100000210623_100012161201 [1,1,0,0,0,0|2,0,0]=4 7285 B13R1.555 C=CCSCCc1ccccc1Br 62a_100012161201_100000210623 [1,1,0,0,0,0|2,0,0]=4 7286 B13R1.555 C=CCSCCc1ccccc1C 62a_100000210623_100011713688 [1,1,0,0,0,0|2,0,0]=4 7287 B13R1.555 C=CCSCCc1ccccc1C 62a_100011713688_100000210623 [1,1,0,0,0,0|2,0,0]=4 7288 B13R1.555 C=CCSCCc1ccccc1Cl 62a_100000210623_100011713703 [1,1,0,0,0,0|2,0,0]=4 7289 B13R1.555 C=CCSCCc1ccccc1Cl 62a_100011713703_100000210623 [1,1,0,0,0,0|2,0,0]=4 7290 B13R1.555 C=CCSCCc1ccccc1F 62a_100000210623_100011713696 [1,1,0,0,0,0|2,0,0]=4 7291 B13R1.555 C=CCSCCc1ccccc1F 62a_100011713696_100000210623 [1,1,0,0,0,0|2,0,0]=4 7292 B13R1.555 C=CCSCCc1ccccc1O 62a_100000210623_100000722297 [1,1,0,0,0,0|2,0,0]=4 7293 B13R1.555 C=CCSCCc1ccccc1O 62a_100000722297_100000210623 [1,1,0,0,0,0|2,0,0]=4 7294 B13R1.555 COCCCCc1ccccc1Br 34a_100012092669_200000210301 [1,1,0,0,0,0|2,0,0]=4 7295 B13R1.555 COCCCCc1ccccc1Br 7a_100012092669_200000210301 [1,1,0,0,0,0|2,0,0]=4 7296 B13R1.555 C[n+]1ccccc1SCCCC=O 62a_200011292268_100000212160 [1,1,0,0,0,0|2,0,0]=4 7297 B13R1.555 Cc1ccccc1CCNCC=O 2230a_100000685071_200015260668 [1,1,0,0,0,0|1,0,0]=3 7298 B13R1.555 Cc1ccccc1CCNCC=O 34a_100000685071_200009817547 [1,1,0,0,0,0|1,0,0]=3 7299 B13R1.555 Cc1ccccc1CCNCCO 2230a_100000685071_100000211926 [1,1,0,0,0,0|1,0,1]=4 7300 B13R1.555 Cc1ccccc1CCNCCO 2230a_100016997473_100011713688 [1,1,0,0,0,0|1,0,1]=4 7301 B13R1.555 Cc1ccccc1CCNCCO 34a_100000685071_100000211926 [1,1,0,0,0,0|1,0,1]=4 7302 B13R1.555 Cc1ccccc1CCNCCO 34a_100016990907_100011713688 [1,1,0,0,0,0|1,0,1]=4 7303 B13R1.555 Cc1ccccc1CCOCC=O 34a_100011220023_200009817547 [1,1,0,0,0,0|1,0,0]=3 7304 B13R1.555 Cc1ccccc1CCOCC=O 7a_100011220023_200015260668 [1,1,0,0,0,0|1,0,0]=3 7305 B13R1.555 Cc1ccccc1CCOCCO 34a_100011220023_100000211926 [1,1,0,0,0,0|1,0,1]=4 7306 B13R1.555 Cc1ccccc1CCOCCO 7a_100011220023_100000211926 [1,1,0,0,0,0|1,0,1]=4 7307 B13R1.555 Cc1ccccc1CCSCC=O 62a_100011713688_200015260668 [1,1,0,0,0,0|1,0,0]=3 7308 B13R1.555 Cc1ccccc1CCSCC=O 62a_200015260668_100011713688 [1,1,0,0,0,0|1,0,0]=3 7309 B13R1.555 Cc1ccccc1CCSCCO 62a_100000211926_100011713688 [1,1,0,0,0,0|1,0,1]=4 7310 B13R1.555 Cc1ccccc1CCSCCO 62a_100011713688_100000211926 [1,1,0,0,0,0|1,0,1]=4 7311 B13R1.555 Cc1ccccc1CNCCCO 207a_100000182051_100000211143 [1,1,0,0,0,0|1,0,1]=4 7312 B13R1.555 Cc1ccccc1CNCCCO 270004a_100000182051_100000211143 [1,1,0,0,0,0|1,0,1]=4 7313 B13R1.555 Cc1ccccc1CNCCCO 34a_100000174972_100000230001 [1,1,0,0,0,0|1,0,1]=4 7314 B13R1.555 Cc1ccccc1COCCCO 34a_100000698903_100000230001 [1,1,0,0,0,0|1,0,1]=4 7315 B13R1.555 Cc1ccccc1COCCCO 7a_100000698903_100011215043 [1,1,0,0,0,0|1,0,1]=4 7316 B13R1.555 Cc1ccccc1CSCCCO 62a_100000211839_100011215043 [1,1,0,0,0,0|1,0,1]=4 7317 B13R1.555 Cc1ccccc1CSCCCO 62a_100011215043_100000211839 [1,1,0,0,0,0|1,0,1]=4 7318 B13R1.555 Cc1ccccc1NCCCCO 34a_100015192222_100011216708 [1,1,0,0,0,0|1,0,1]=4 7319 B13R1.555 Cc1ccccc1OCCCC=O 7a_100000210338_200011292268 [1,1,0,0,0,0|1,0,0]=3 7320 B13R1.555 Cc1ccccc1OCCCCO 34a_100000210338_100011216708 [1,1,0,0,0,0|1,0,1]=4 7321 B13R1.555 Cc1ccccc1OCCCCO 7a_100000210338_100000210776 [1,1,0,0,0,0|1,0,1]=4 7322 B13R1.555 Cc1ccccc1SCCCC=O 62a_100000210755_200011292268 [1,1,0,0,0,0|1,0,0]=3 7323 B13R1.555 Cc1ccccc1SCCCC=O 62a_200011292268_100000210755 [1,1,0,0,0,0|1,0,0]=3 7324 B13R1.555 Cc1ccccc1SCCCCO 62a_100000210755_100000210776 [1,1,0,0,0,0|1,0,1]=4 7325 B13R1.555 Cc1ccccc1SCCCCO 62a_100000210776_100000210755 [1,1,0,0,0,0|1,0,1]=4 7326 B13R1.555 Cc1cccnc1CCOCC=O 34a_100011997706_200009817547 [1,1,0,0,0,0|2,0,0]=4 7327 B13R1.555 Cc1cccnc1CCOCC=O 7a_100011997706_200015260668 [1,1,0,0,0,0|2,0,0]=4 7328 B13R1.555 Cc1cccnc1SCCCC=O 62a_100000751373_200011292268 [1,1,0,0,0,0|2,0,0]=4 7329 B13R1.555 Cc1cccnc1SCCCC=O 62a_200011292268_100000751373 [1,1,0,0,0,0|2,0,0]=4 7330 B13R1.555 Cc1ccncc1OCCCC=O 7a_100011997053_200011292268 [1,1,0,0,0,0|2,0,0]=4 7331 B13R1.555 Cc1ccncc1SCCCC=O 62a_100000761580_200011292268 [1,1,0,0,0,0|2,0,0]=4 7332 B13R1.555 Cc1ccncc1SCCCC=O 62a_200011292268_100000761580 [1,1,0,0,0,0|2,0,0]=4 7333 B13R1.555 Cc1cnccc1SCCCC=O 62a_100000765111_200011292268 [1,1,0,0,0,0|2,0,0]=4 7334 B13R1.555 Cc1cnccc1SCCCC=O 62a_200011292268_100000765111 [1,1,0,0,0,0|2,0,0]=4 7335 B13R1.555 Cc1ncccc1OCCCC=O 7a_100000745507_200011292268 [1,1,0,0,0,0|2,0,0]=4 7336 B13R1.555 Cc1ncccc1SCCCC=O 62a_100000751574_200011292268 [1,1,0,0,0,0|2,0,0]=4 7337 B13R1.555 Cc1ncccc1SCCCC=O 62a_200011292268_100000751574 [1,1,0,0,0,0|2,0,0]=4 7338 B13R1.555 Nc1ccccc1CCOCC=O 34a_100011215289_200009817547 [1,1,0,0,0,0|1,0,0]=3 7339 B13R1.555 Nc1ccccc1CCOCCO 34a_100011215289_100000211926 [1,1,0,0,0,0|1,0,1]=4 7340 B13R1.555 Nc1ccccc1COCCCO 34a_100000212039_100000230001 [1,1,0,0,0,0|1,0,1]=4 7341 B13R1.555 Nc1ccccc1OCCCC=O 7a_100000185747_200011292268 [1,1,0,0,0,0|1,0,0]=3 7342 B13R1.555 Nc1ccccc1OCCCCO 34a_100000185747_100011216708 [1,1,0,0,0,0|1,0,1]=4 7343 B13R1.555 Nc1ccccc1OCCCCO 7a_100000185747_100000210776 [1,1,0,0,0,0|1,0,1]=4 7344 B13R1.555 Nc1ccccc1SCCCC=O 62a_100000210017_200011292268 [1,1,0,0,0,0|1,0,0]=3 7345 B13R1.555 Nc1ccccc1SCCCC=O 62a_200011292268_100000210017 [1,1,0,0,0,0|1,0,0]=3 7346 B13R1.555 Nc1ccccc1SCCCCO 62a_100000210017_100000210776 [1,1,0,0,0,0|1,0,1]=4 7347 B13R1.555 Nc1ccccc1SCCCCO 62a_100000210776_100000210017 [1,1,0,0,0,0|1,0,1]=4 7348 B13R1.555 Nc1cccnc1SCCCC=O 62a_100000688686_200011292268 [1,1,0,0,0,0|2,0,0]=4 7349 B13R1.555 Nc1cccnc1SCCCC=O 62a_200011292268_100000688686 [1,1,0,0,0,0|2,0,0]=4 7350 B13R1.555 Nc1ccncc1SCCCC=O 62a_100000047001_200011292268 [1,1,0,0,0,0|2,0,0]=4 7351 B13R1.555 Nc1ccncc1SCCCC=O 62a_200011292268_100000047001 [1,1,0,0,0,0|2,0,0]=4 7352 B13R1.555 Nc1cnccc1SCCCC=O 62a_100000756074_200011292268 [1,1,0,0,0,0|2,0,0]=4 7353 B13R1.555 Nc1cnccc1SCCCC=O 62a_200011292268_100000756074 [1,1,0,0,0,0|2,0,0]=4 7354 B13R1.555 Nc1ncccc1OCCCC=O 7a_100000211975_200011292268 [1,1,0,0,0,0|2,0,0]=4 7355 B13R1.555 Nc1ncccc1SCCCC=O 62a_100000045569_200011292268 [1,1,0,0,0,0|2,0,0]=4 7356 B13R1.555 Nc1ncccc1SCCCC=O 62a_200011292268_100000045569 [1,1,0,0,0,0|2,0,0]=4 7357 B13R1.555 O=CCCCOc1cccc[n+]1[O-] 7a_100000211761_200011292268 [1,1,0,0,0,0|2,0,0]=4 7358 B13R1.555 O=CCCCOc1ccccc1Br 7a_100000181306_200011292268 [1,1,0,0,0,0|1,0,0]=3 7359 B13R1.555 O=CCCCOc1ccccc1Cl 7a_100000210172_200011292268 [1,1,0,0,0,0|1,0,0]=3 7360 B13R1.555 O=CCCCOc1ccccc1F 7a_100000210171_200011292268 [1,1,0,0,0,0|1,0,0]=3 7361 B13R1.555 O=CCCCOc1ccccc1I 7a_100000739446_200011292268 [1,1,0,0,0,0|1,0,0]=3 7362 B13R1.555 O=CCCCOc1cccnc1Br 7a_100000744436_200011292268 [1,1,0,0,0,0|2,0,0]=4 7363 B13R1.555 O=CCCCOc1cccnc1Cl 7a_100000757616_200011292268 [1,1,0,0,0,0|2,0,0]=4 7364 B13R1.555 O=CCCCOc1cccnc1F 7a_100000061740_200011292268 [1,1,0,0,0,0|2,0,0]=4 7365 B13R1.555 O=CCCCOc1cccnc1I 7a_100000034122_200011292268 [1,1,0,0,0,0|2,0,0]=4 7366 B13R1.555 O=CCCCOc1cccoc1=O 7a_100000077404_200011292268 [1,1,0,0,0,0|2,0,0]=4 7367 B13R1.555 O=CCCCSc1c[nH]ccc1=O 62a_100009998708_200011292268 [1,1,0,0,0,0|2,0,0]=4 7368 B13R1.555 O=CCCCSc1c[nH]ccc1=O 62a_200011292268_100009998708 [1,1,0,0,0,0|2,0,0]=4 7369 B13R1.555 O=CCCCSc1c[nH]ccc1=S 62a_200011292268_200012280681 [1,1,0,0,0,0|2,0,0]=4 7370 B13R1.555 O=CCCCSc1c[nH]ccc1=S 62a_200012280681_200011292268 [1,1,0,0,0,0|2,0,0]=4 7371 B13R1.555 O=CCCCSc1cccc[n+]1[O-] 62a_200011292268_200000042595 [1,1,0,0,0,0|2,0,0]=4 7372 B13R1.555 O=CCCCSc1ccccc1Br 62a_100000695589_200011292268 [1,1,0,0,0,0|1,0,0]=3 7373 B13R1.555 O=CCCCSc1ccccc1Br 62a_200011292268_100000695589 [1,1,0,0,0,0|1,0,0]=3 7374 B13R1.555 O=CCCCSc1ccccc1Cl 62a_100000764095_200011292268 [1,1,0,0,0,0|1,0,0]=3 7375 B13R1.555 O=CCCCSc1ccccc1Cl 62a_200011292268_100000764095 [1,1,0,0,0,0|1,0,0]=3 7376 B13R1.555 O=CCCCSc1ccccc1F 62a_100011215700_200011292268 [1,1,0,0,0,0|1,0,0]=3 7377 B13R1.555 O=CCCCSc1ccccc1F 62a_200011292268_100011215700 [1,1,0,0,0,0|1,0,0]=3 7378 B13R1.555 O=CCCCSc1ccccc1O 62a_100000739446_200011292268 [1,1,0,0,0,0|1,0,0]=3 7379 B13R1.555 O=CCCCSc1ccccc1O 62a_200011292268_100000739446 [1,1,0,0,0,0|1,0,0]=3 7380 B13R1.555 O=CCCCSc1cccnc1Br 62a_100010202626_200011292268 [1,1,0,0,0,0|2,0,0]=4 7381 B13R1.555 O=CCCCSc1cccnc1Br 62a_200011292268_100010202626 [1,1,0,0,0,0|2,0,0]=4 7382 B13R1.555 O=CCCCSc1cccnc1Cl 62a_100000036424_200011292268 [1,1,0,0,0,0|2,0,0]=4 7383 B13R1.555 O=CCCCSc1cccnc1Cl 62a_200011292268_100000036424 [1,1,0,0,0,0|2,0,0]=4 7384 B13R1.555 O=CCCCSc1cccnc1F 62a_100009816115_200011292268 [1,1,0,0,0,0|2,0,0]=4 7385 B13R1.555 O=CCCCSc1cccnc1F 62a_200011292268_100009816115 [1,1,0,0,0,0|2,0,0]=4 7386 B13R1.555 O=CCCCSc1cccnc1O 62a_100000760158_200011292268 [1,1,0,0,0,0|2,0,0]=4 7387 B13R1.555 O=CCCCSc1cccnc1O 62a_200011292268_100000760158 [1,1,0,0,0,0|2,0,0]=4 7388 B13R1.555 O=CCCCSc1ccncc1Br 62a_100000726257_200011292268 [1,1,0,0,0,0|2,0,0]=4 7389 B13R1.555 O=CCCCSc1ccncc1Br 62a_200011292268_100000726257 [1,1,0,0,0,0|2,0,0]=4 7390 B13R1.555 O=CCCCSc1ccncc1Cl 62a_100000708259_200011292268 [1,1,0,0,0,0|2,0,0]=4 7391 B13R1.555 O=CCCCSc1ccncc1Cl 62a_200011292268_100000708259 [1,1,0,0,0,0|2,0,0]=4 7392 B13R1.555 O=CCCCSc1ccncc1F 62a_100000047030_200011292268 [1,1,0,0,0,0|2,0,0]=4 7393 B13R1.555 O=CCCCSc1ccncc1F 62a_200011292268_100000047030 [1,1,0,0,0,0|2,0,0]=4 7394 B13R1.555 O=CCCCSc1ccncc1O 62a_100009817591_200011292268 [1,1,0,0,0,0|2,0,0]=4 7395 B13R1.555 O=CCCCSc1ccncc1O 62a_200011292268_100009817591 [1,1,0,0,0,0|2,0,0]=4 7396 B13R1.555 O=CCCCSc1cnccc1Br 62a_100010138639_200011292268 [1,1,0,0,0,0|2,0,0]=4 7397 B13R1.555 O=CCCCSc1cnccc1Br 62a_200011292268_100010138639 [1,1,0,0,0,0|2,0,0]=4 7398 B13R1.555 O=CCCCSc1cnccc1Cl 62a_100009995489_200011292268 [1,1,0,0,0,0|2,0,0]=4 7399 B13R1.555 O=CCCCSc1cnccc1Cl 62a_200011292268_100009995489 [1,1,0,0,0,0|2,0,0]=4 7400 B13R1.555 O=CCCCSc1cnccc1F 62a_100009820683_200011292268 [1,1,0,0,0,0|2,0,0]=4 7401 B13R1.555 O=CCCCSc1cnccc1F 62a_200011292268_100009820683 [1,1,0,0,0,0|2,0,0]=4 7402 B13R1.555 O=CCCCSc1ncccc1Br 62a_100000696092_200011292268 [1,1,0,0,0,0|2,0,0]=4 7403 B13R1.555 O=CCCCSc1ncccc1Br 62a_200011292268_100000696092 [1,1,0,0,0,0|2,0,0]=4 7404 B13R1.555 O=CCCCSc1ncccc1Cl 62a_100011356963_200011292268 [1,1,0,0,0,0|2,0,0]=4 7405 B13R1.555 O=CCCCSc1ncccc1Cl 62a_200011292268_100011356963 [1,1,0,0,0,0|2,0,0]=4 7406 B13R1.555 O=CCCCSc1ncccc1F 62a_100000685392_200011292268 [1,1,0,0,0,0|2,0,0]=4 7407 B13R1.555 O=CCCCSc1ncccc1F 62a_200011292268_100000685392 [1,1,0,0,0,0|2,0,0]=4 7408 B13R1.555 O=CCCCSc1ncccc1O 62a_100000034122_200011292268 [1,1,0,0,0,0|2,0,0]=4 7409 B13R1.555 O=CCCCSc1ncccc1O 62a_200011292268_100000034122 [1,1,0,0,0,0|2,0,0]=4 7410 B13R1.555 O=CCNCCc1ccccc1Br 2230a_100000747383_200015260668 [1,1,0,0,0,0|1,0,0]=3 7411 B13R1.555 O=CCNCCc1ccccc1Br 34a_100000747383_200009817547 [1,1,0,0,0,0|1,0,0]=3 7412 B13R1.555 O=CCNCCc1ccccc1Cl 2230a_100011207228_200015260668 [1,1,0,0,0,0|1,0,0]=3 7413 B13R1.555 O=CCNCCc1ccccc1Cl 34a_100011207228_200009817547 [1,1,0,0,0,0|1,0,0]=3 7414 B13R1.555 O=CCNCCc1ccccc1F 2230a_100000185272_200015260668 [1,1,0,0,0,0|1,0,0]=3 7415 B13R1.555 O=CCNCCc1ccccc1F 34a_100000185272_200009817547 [1,1,0,0,0,0|1,0,0]=3 7416 B13R1.555 O=CCNCCc1ccccc1O 34a_100011207237_200009817547 [1,1,0,0,0,0|1,0,0]=3 7417 B13R1.555 O=CCNCCn1ccccc1=O 2230a_100000687133_200015260668 [1,1,0,0,0,0|2,0,0]=4 7418 B13R1.555 O=CCOCCc1ccccc1Br 34a_100000731337_200009817547 [1,1,0,0,0,0|1,0,0]=3 7419 B13R1.555 O=CCOCCc1ccccc1Br 7a_100000731337_200015260668 [1,1,0,0,0,0|1,0,0]=3 7420 B13R1.555 O=CCOCCc1ccccc1Cl 34a_100011215284_200009817547 [1,1,0,0,0,0|1,0,0]=3 7421 B13R1.555 O=CCOCCc1ccccc1Cl 7a_100011215284_200015260668 [1,1,0,0,0,0|1,0,0]=3 7422 B13R1.555 O=CCOCCc1ccccc1F 34a_100000753711_200009817547 [1,1,0,0,0,0|1,0,0]=3 7423 B13R1.555 O=CCOCCc1ccccc1F 7a_100000753711_200015260668 [1,1,0,0,0,0|1,0,0]=3 7424 B13R1.555 O=CCOCCc1ccccc1I 34a_100010255290_200009817547 [1,1,0,0,0,0|1,0,0]=3 7425 B13R1.555 O=CCOCCc1ccccc1I 7a_100010255290_200015260668 [1,1,0,0,0,0|1,0,0]=3 7426 B13R1.555 O=CCSCCc1ccccc1Br 62a_100012161201_200015260668 [1,1,0,0,0,0|1,0,0]=3 7427 B13R1.555 O=CCSCCc1ccccc1Br 62a_200015260668_100012161201 [1,1,0,0,0,0|1,0,0]=3 7428 B13R1.555 O=CCSCCc1ccccc1Cl 62a_100011713703_200015260668 [1,1,0,0,0,0|1,0,0]=3 7429 B13R1.555 O=CCSCCc1ccccc1Cl 62a_200015260668_100011713703 [1,1,0,0,0,0|1,0,0]=3 7430 B13R1.555 O=CCSCCc1ccccc1F 62a_100011713696_200015260668 [1,1,0,0,0,0|1,0,0]=3 7431 B13R1.555 O=CCSCCc1ccccc1F 62a_200015260668_100011713696 [1,1,0,0,0,0|1,0,0]=3 7432 B13R1.555 O=CCSCCc1ccccc1O 62a_100000722297_200015260668 [1,1,0,0,0,0|1,0,0]=3 7433 B13R1.555 O=CCSCCc1ccccc1O 62a_200015260668_100000722297 [1,1,0,0,0,0|1,0,0]=3 7434 B13R1.555 OCCCCNc1ccccc1Br 34a_100000210017_100011216708 [1,1,0,0,0,0|1,0,1]=4 7435 B13R1.555 OCCCCNc1ccccc1Cl 34a_100000185783_100011216708 [1,1,0,0,0,0|1,0,1]=4 7436 B13R1.555 OCCCCNc1ccccc1F 34a_100000210422_100011216708 [1,1,0,0,0,0|1,0,1]=4 7437 B13R1.555 OCCCCNc1ccccc1I 34a_100000210053_100011216708 [1,1,0,0,0,0|1,0,1]=4 7438 B13R1.555 OCCCCNc1ccccc1O 34a_100000185747_100011216708 [1,1,0,0,0,0|1,0,1]=4 7439 B13R1.555 OCCCCOc1ccccc1Br 34a_100000181306_100011216708 [1,1,0,0,0,0|1,0,1]=4 7440 B13R1.555 OCCCCOc1ccccc1Br 7a_100000181306_100000210776 [1,1,0,0,0,0|1,0,1]=4 7441 B13R1.555 OCCCCOc1ccccc1Cl 34a_100000210172_100011216708 [1,1,0,0,0,0|1,0,1]=4 7442 B13R1.555 OCCCCOc1ccccc1Cl 7a_100000210172_100000210776 [1,1,0,0,0,0|1,0,1]=4 7443 B13R1.555 OCCCCOc1ccccc1F 34a_100000210171_100011216708 [1,1,0,0,0,0|1,0,1]=4 7444 B13R1.555 OCCCCOc1ccccc1F 7a_100000210171_100000210776 [1,1,0,0,0,0|1,0,1]=4 7445 B13R1.555 OCCCCOc1ccccc1I 34a_100000739446_100011216708 [1,1,0,0,0,0|1,0,1]=4 7446 B13R1.555 OCCCCOc1ccccc1I 7a_100000739446_100000210776 [1,1,0,0,0,0|1,0,1]=4 7447 B13R1.555 OCCCCSc1ccccc1Br 62a_100000210776_100000695589 [1,1,0,0,0,0|1,0,1]=4 7448 B13R1.555 OCCCCSc1ccccc1Br 62a_100000695589_100000210776 [1,1,0,0,0,0|1,0,1]=4 7449 B13R1.555 OCCCCSc1ccccc1Cl 62a_100000210776_100000764095 [1,1,0,0,0,0|1,0,1]=4 7450 B13R1.555 OCCCCSc1ccccc1Cl 62a_100000764095_100000210776 [1,1,0,0,0,0|1,0,1]=4 7451 B13R1.555 OCCCCSc1ccccc1F 62a_100000210776_100011215700 [1,1,0,0,0,0|1,0,1]=4 7452 B13R1.555 OCCCCSc1ccccc1F 62a_100011215700_100000210776 [1,1,0,0,0,0|1,0,1]=4 7453 B13R1.555 OCCCCSc1ccccc1O 62a_100000210776_100000739446 [1,1,0,0,0,0|1,0,1]=4 7454 B13R1.555 OCCCCSc1ccccc1O 62a_100000739446_100000210776 [1,1,0,0,0,0|1,0,1]=4 7455 B13R1.555 OCCCNCc1ccccc1Br 207a_100000182051_100000211189 [1,1,0,0,0,0|1,0,1]=4 7456 B13R1.555 OCCCNCc1ccccc1Br 2230a_100000689332_100000230001 [1,1,0,0,0,0|1,0,1]=4 7457 B13R1.555 OCCCNCc1ccccc1Br 270004a_100000182051_100000211189 [1,1,0,0,0,0|1,0,1]=4 7458 B13R1.555 OCCCNCc1ccccc1Br 34a_100000689332_100000230001 [1,1,0,0,0,0|1,0,1]=4 7459 B13R1.555 OCCCNCc1ccccc1Cl 207a_100000182051_100000210073 [1,1,0,0,0,0|1,0,1]=4 7460 B13R1.555 OCCCNCc1ccccc1Cl 2230a_100000174879_100000230001 [1,1,0,0,0,0|1,0,1]=4 7461 B13R1.555 OCCCNCc1ccccc1Cl 270004a_100000182051_100000210073 [1,1,0,0,0,0|1,0,1]=4 7462 B13R1.555 OCCCNCc1ccccc1Cl 34a_100000174879_100000230001 [1,1,0,0,0,0|1,0,1]=4 7463 B13R1.555 OCCCNCc1ccccc1F 207a_100000182051_100000210811 [1,1,0,0,0,0|1,0,1]=4 7464 B13R1.555 OCCCNCc1ccccc1F 270004a_100000182051_100000210811 [1,1,0,0,0,0|1,0,1]=4 7465 B13R1.555 OCCCNCc1ccccc1F 34a_100000174869_100000230001 [1,1,0,0,0,0|1,0,1]=4 7466 B13R1.555 OCCCNCc1ccccc1I 207a_100000182051_100000010305 [1,1,0,0,0,0|1,0,1]=4 7467 B13R1.555 OCCCNCc1ccccc1I 270004a_100000182051_100000010305 [1,1,0,0,0,0|1,0,1]=4 7468 B13R1.555 OCCCNCc1ccccc1O 34a_100000185550_100000230001 [1,1,0,0,0,0|1,0,1]=4 7469 B13R1.555 OCCCOCc1ccccc1Br 34a_100000756307_100000230001 [1,1,0,0,0,0|1,0,1]=4 7470 B13R1.555 OCCCOCc1ccccc1Br 7a_100000756307_100011215043 [1,1,0,0,0,0|1,0,1]=4 7471 B13R1.555 OCCCOCc1ccccc1Cl 34a_100000210847_100000230001 [1,1,0,0,0,0|1,0,1]=4 7472 B13R1.555 OCCCOCc1ccccc1Cl 7a_100000210847_100011215043 [1,1,0,0,0,0|1,0,1]=4 7473 B13R1.555 OCCCOCc1ccccc1F 34a_100000211962_100000230001 [1,1,0,0,0,0|1,0,1]=4 7474 B13R1.555 OCCCOCc1ccccc1F 7a_100000211962_100011215043 [1,1,0,0,0,0|1,0,1]=4 7475 B13R1.555 OCCCOCc1ccccc1I 34a_100000187465_100000230001 [1,1,0,0,0,0|1,0,1]=4 7476 B13R1.555 OCCCOCc1ccccc1I 7a_100000187465_100011215043 [1,1,0,0,0,0|1,0,1]=4 7477 B13R1.555 OCCCSCc1ccccc1Br 62a_100000184730_100011215043 [1,1,0,0,0,0|1,0,1]=4 7478 B13R1.555 OCCCSCc1ccccc1Br 62a_100011215043_100000184730 [1,1,0,0,0,0|1,0,1]=4 7479 B13R1.555 OCCCSCc1ccccc1Cl 62a_100000187162_100011215043 [1,1,0,0,0,0|1,0,1]=4 7480 B13R1.555 OCCCSCc1ccccc1Cl 62a_100011215043_100000187162 [1,1,0,0,0,0|1,0,1]=4 7481 B13R1.555 OCCCSCc1ccccc1F 62a_100000211605_100011215043 [1,1,0,0,0,0|1,0,1]=4 7482 B13R1.555 OCCCSCc1ccccc1F 62a_100011215043_100000211605 [1,1,0,0,0,0|1,0,1]=4 7483 B13R1.555 OCCCSCc1ccccc1I 62a_100011215043_100011216222 [1,1,0,0,0,0|1,0,1]=4 7484 B13R1.555 OCCCSCc1ccccc1I 62a_100011216222_100011215043 [1,1,0,0,0,0|1,0,1]=4 7485 B13R1.555 OCCNCCc1ccccc1Br 2230a_100000747383_100000211926 [1,1,0,0,0,0|1,0,1]=4 7486 B13R1.555 OCCNCCc1ccccc1Br 2230a_100016997473_100012161201 [1,1,0,0,0,0|1,0,1]=4 7487 B13R1.555 OCCNCCc1ccccc1Br 34a_100000747383_100000211926 [1,1,0,0,0,0|1,0,1]=4 7488 B13R1.555 OCCNCCc1ccccc1Br 34a_100016990907_100012161201 [1,1,0,0,0,0|1,0,1]=4 7489 B13R1.555 OCCNCCc1ccccc1Cl 2230a_100011207228_100000211926 [1,1,0,0,0,0|1,0,1]=4 7490 B13R1.555 OCCNCCc1ccccc1Cl 2230a_100016997473_100011713703 [1,1,0,0,0,0|1,0,1]=4 7491 B13R1.555 OCCNCCc1ccccc1Cl 270004a_100000210304_200011713468 [1,1,0,0,0,0|1,0,1]=4 7492 B13R1.555 OCCNCCc1ccccc1Cl 34a_100011207228_100000211926 [1,1,0,0,0,0|1,0,1]=4 7493 B13R1.555 OCCNCCc1ccccc1Cl 34a_100016990907_100011713703 [1,1,0,0,0,0|1,0,1]=4 7494 B13R1.555 OCCNCCc1ccccc1F 2230a_100000185272_100000211926 [1,1,0,0,0,0|1,0,1]=4 7495 B13R1.555 OCCNCCc1ccccc1F 2230a_100016997473_100011713696 [1,1,0,0,0,0|1,0,1]=4 7496 B13R1.555 OCCNCCc1ccccc1F 34a_100000185272_100000211926 [1,1,0,0,0,0|1,0,1]=4 7497 B13R1.555 OCCNCCc1ccccc1F 34a_100016990907_100000720011 [1,1,0,0,0,0|1,0,1]=4 7498 B13R1.555 OCCNCCc1ccccc1O 34a_100011207237_100000211926 [1,1,0,0,0,0|1,0,1]=4 7499 B13R1.555 OCCNCCc1ccccc1O 34a_100016990907_100000722297 [1,1,0,0,0,0|1,0,1]=4 7500 B13R1.555 OCCOCCc1ccccc1Br 34a_100000731337_100000211926 [1,1,0,0,0,0|1,0,1]=4 7501 B13R1.555 OCCOCCc1ccccc1Br 7a_100000731337_100000211926 [1,1,0,0,0,0|1,0,1]=4 7502 B13R1.555 OCCOCCc1ccccc1Cl 34a_100011215284_100000211926 [1,1,0,0,0,0|1,0,1]=4 7503 B13R1.555 OCCOCCc1ccccc1Cl 7a_100011215284_100000211926 [1,1,0,0,0,0|1,0,1]=4 7504 B13R1.555 OCCOCCc1ccccc1F 34a_100000753711_100000211926 [1,1,0,0,0,0|1,0,1]=4 7505 B13R1.555 OCCOCCc1ccccc1F 7a_100000753711_100000211926 [1,1,0,0,0,0|1,0,1]=4 7506 B13R1.555 OCCOCCc1ccccc1I 34a_100010255290_100000211926 [1,1,0,0,0,0|1,0,1]=4 7507 B13R1.555 OCCOCCc1ccccc1I 7a_100010255290_100000211926 [1,1,0,0,0,0|1,0,1]=4 7508 B13R1.555 OCCSCCc1ccccc1Br 62a_100000211926_100012161201 [1,1,0,0,0,0|1,0,1]=4 7509 B13R1.555 OCCSCCc1ccccc1Br 62a_100012161201_100000211926 [1,1,0,0,0,0|1,0,1]=4 7510 B13R1.555 OCCSCCc1ccccc1Cl 62a_100000211926_100011713703 [1,1,0,0,0,0|1,0,1]=4 7511 B13R1.555 OCCSCCc1ccccc1Cl 62a_100011713703_100000211926 [1,1,0,0,0,0|1,0,1]=4 7512 B13R1.555 OCCSCCc1ccccc1F 62a_100000211926_100011713696 [1,1,0,0,0,0|1,0,1]=4 7513 B13R1.555 OCCSCCc1ccccc1F 62a_100011713696_100000211926 [1,1,0,0,0,0|1,0,1]=4 7514 B13R1.555 OCCSCCc1ccccc1O 62a_100000211926_100000722297 [1,1,0,0,0,0|1,0,1]=4 7515 B13R1.555 OCCSCCc1ccccc1O 62a_100000722297_100000211926 [1,1,0,0,0,0|1,0,1]=4 7516 B13R1.555 [13CH3]OCCCCc1ccccc1Br 34a_100012092669_200025704644 [1,1,0,0,0,0|2,0,0]=4 7517 B13R1.555 [13CH3]OCCCCc1ccccc1Br 7a_100012092669_200025704644 [1,1,0,0,0,0|2,0,0]=4 7518 B13R1.718 C=CC(=O)CCCc1ccccc1 1458a_100000185746_100000211621 [1,1,0,0,0,0|1,0,1]=4 7519 B13R1.718 C=CC(C)COCc1ccccc1 34a_100011215527_100015291786 [1,1,0,0,0,0|2,0,0]=4 7520 B13R1.718 C=CC(C)COCc1ccccc1 7a_100011215527_100000211182 [1,1,0,0,0,0|2,0,0]=4 7521 B13R1.718 C=CC(C)OCCc1ccccc1 34a_100000695699_100000765856 [1,1,0,0,0,0|2,0,0]=4 7522 B13R1.718 C=CC(C)SCCc1ccccc1 62a_100011215867_100011218657 [1,1,0,0,0,0|2,0,0]=4 7523 B13R1.718 C=CC(O)CNCc1ccccc1 2230a_100015324214_100000730141 [1,1,0,0,0,0|2,0,0]=4 7524 B13R1.718 C=CC(O)CNCc1ccccc1 34a_100015324214_100000730141 [1,1,0,0,0,0|2,0,0]=4 7525 B13R1.718 C=CC(O)COCc1ccccc1 34a_100000210790_100000730141 [1,1,0,0,0,0|2,0,0]=4 7526 B13R1.718 C=CC(O)COCc1ccccc1 7a_100000210790_100000730141 [1,1,0,0,0,0|2,0,0]=4 7527 B13R1.718 C=CC(O)CSCc1ccccc1 62a_100000211182_100000730141 [1,1,0,0,0,0|2,0,0]=4 7528 B13R1.718 C=CC(O)CSCc1ccccc1 62a_100000730141_100015291786 [1,1,0,0,0,0|2,0,0]=4 7529 B13R1.718 C=C[C@H](N)COCc1ccccc1 34a_100016989147_100015291786 [1,1,0,0,0,0|2,0,0]=4 7530 B13R1.718 CC(CCCc1ccccc1)S[13CH3] 62a_200010759516_200025704644 [1,1,0,0,0,0|2,0,0]=4 7531 B13R1.718 CC(CCCc1ccccc1)S[13CH3] 62a_200025704644_200010759516 [1,1,0,0,0,0|2,0,0]=4 7532 B13R1.718 CC(CO)CNCc1ccccc1 207a_100000744482_100015611070 [1,1,0,0,0,0|1,0,1]=4 7533 B13R1.718 CC(CO)CNCc1ccccc1 34a_100000744482_100015291786 [1,1,0,0,0,0|1,0,1]=4 7534 B13R1.718 CC(CO)NCCc1ccccc1 2230a_100000106460_100012180447 [1,1,0,0,0,0|1,0,1]=4 7535 B13R1.718 CC(CO)NCCc1ccccc1 34a_100000106460_100012180447 [1,1,0,0,0,0|1,0,1]=4 7536 B13R1.718 CC(CO)OCCc1ccccc1 34a_100000210268_100012180447 [1,1,0,0,0,0|1,0,1]=4 7537 B13R1.718 CC(CO)OCCc1ccccc1 7a_100000210268_100012180447 [1,1,0,0,0,0|1,0,1]=4 7538 B13R1.718 CC(CO)SCCc1ccccc1 62a_100012180447_100011218657 [1,1,0,0,0,0|1,0,1]=4 7539 B13R1.718 CNC(C)CCCc1ccccc1 2230a_106832991635_200010759516 [1,1,0,0,0,0|2,0,0]=4 7540 B13R1.718 CNC(C)CCCc1ccccc1 34a_100102657272_200010759516 [1,1,0,0,0,0|2,0,0]=4 7541 B13R1.718 CNC(C)CCCc1ccccc1 7a_106832991635_200010759516 [1,1,0,0,0,0|2,0,0]=4 7542 B13R1.718 COC(C)CCCc1ccccc1 34a_100138415774_200010759516 [1,1,0,0,0,0|2,0,0]=4 7543 B13R1.718 CSC(C)CCCc1ccccc1 62a_200000210301_200010759516 [1,1,0,0,0,0|2,0,0]=4 7544 B13R1.718 CSC(C)CCCc1ccccc1 62a_200010759516_200000210301 [1,1,0,0,0,0|2,0,0]=4 7545 B13R1.718 C[C@@H](CO)CNCc1ccccc1 2230a_100015324214_100000059175 [1,1,0,0,0,0|1,0,1]=4 7546 B13R1.718 C[C@@H](CO)CNCc1ccccc1 34a_100015324214_100000059175 [1,1,0,0,0,0|1,0,1]=4 7547 B13R1.718 C[C@@H](CO)COCc1ccccc1 34a_100000210790_100000059175 [1,1,0,0,0,0|1,0,1]=4 7548 B13R1.718 C[C@@H](CO)COCc1ccccc1 7a_100000210790_100000059175 [1,1,0,0,0,0|1,0,1]=4 7549 B13R1.718 C[C@@H](CO)CSCc1ccccc1 62a_100000059175_100015291786 [1,1,0,0,0,0|1,0,1]=4 7550 B13R1.718 C[C@@H](CO)CSCc1ccccc1 62a_100000211182_100000059175 [1,1,0,0,0,0|1,0,1]=4 7551 B13R1.718 C[C@H](CO)NCCc1ccccc1 2230a_100000737577_100000765856 [1,1,0,0,0,0|1,0,1]=4 7552 B13R1.718 C[C@H](CO)SCCc1ccccc1 62a_100000765856_100016084084 [1,1,0,0,0,0|1,0,1]=4 7553 B13R1.718 C[C@H](CO)SCCc1ccccc1 62a_100016084084_100011218657 [1,1,0,0,0,0|1,0,1]=4 7554 B13R1.718 O=C(CO)CCCc1ccccc1 1458a_100000210174_100000211621 [1,1,0,0,0,0|0,0,2]=4 7555 B13R1.718 OCC(O)CNCc1ccccc1 2230a_100015324214_100011219619 [1,1,0,0,0,0|1,0,1]=4 7556 B13R1.718 OCC(O)CNCc1ccccc1 34a_100015324214_100011219619 [1,1,0,0,0,0|1,0,1]=4 7557 B13R1.718 OCC(O)COCc1ccccc1 34a_100000210790_100011219619 [1,1,0,0,0,0|1,0,1]=4 7558 B13R1.718 OCC(O)COCc1ccccc1 7a_100000210790_100011219619 [1,1,0,0,0,0|1,0,1]=4 7559 B13R1.718 OCC(O)CSCc1ccccc1 62a_100000211182_100011219619 [1,1,0,0,0,0|1,0,1]=4 7560 B13R1.718 OCC(O)CSCc1ccccc1 62a_100011219619_100015291786 [1,1,0,0,0,0|1,0,1]=4 7561 B13R1.718 OC[C@@H](O)CNCc1ccccc1 207a_100020644852_100015611070 [1,1,0,0,0,0|1,0,1]=4 7562 B13R1.718 OC[C@@H](O)CNCc1ccccc1 2230a_100020644852_100015291786 [1,1,0,0,0,0|1,0,1]=4 7563 B13R1.718 OC[C@H](F)CNCc1ccccc1 207a_100015665980_100015611070 [1,1,0,0,0,0|1,0,1]=4 7564 B13R1.718 OC[C@H](F)CNCc1ccccc1 270004a_100015665980_100015611070 [1,1,0,0,0,0|1,0,1]=4 7565 B13R1.718 OC[C@H](F)CNCc1ccccc1 34a_100015665980_100015291786 [1,1,0,0,0,0|1,0,1]=4 7566 B13R1.718 OC[C@H](O)CNCc1ccccc1 2230a_100015324214_100009815848 [1,1,0,0,0,0|1,0,1]=4 7567 B13R1.718 OC[C@H](O)CNCc1ccccc1 34a_100015324214_100009815848 [1,1,0,0,0,0|1,0,1]=4 7568 B13R1.718 OC[C@H](O)COCc1ccccc1 34a_100000210790_100009815848 [1,1,0,0,0,0|1,0,1]=4 7569 B13R1.718 OC[C@H](O)COCc1ccccc1 7a_100000210790_100009815848 [1,1,0,0,0,0|1,0,1]=4 7570 B13R1.718 OC[C@H](O)CSCc1ccccc1 62a_100000211182_100009815848 [1,1,0,0,0,0|1,0,1]=4 7571 B13R1.718 OC[C@H](O)CSCc1ccccc1 62a_100009815848_100015291786 [1,1,0,0,0,0|1,0,1]=4 7572 B13R1.45 CC(=O)CCC(=O)c1ccccc1 1458a_100000070787_100000750707 [0,1,0,0,1,0|1,0,1]=4 7573 B13R1.45 CC(=O)CCN(C)c1ccccc1 269982a_100000210012_100000053229 [0,1,0,0,1,0|2,0,0]=4 7574 B13R1.45 CC(=O)CC[C@@H](O)c1ccccc1 1458a_100000070787_100000729684 [0,1,0,0,1,0|1,0,0]=3 7575 B13R1.45 CC(=O)COC(C)c1ccccc1 34a_100000211253_100000211855 [0,1,0,0,1,0|2,0,0]=4 7576 B13R1.45 CC(=O)NCC(C)c1ccccc1 11a_100000701038_100015343762 [0,1,0,0,1,0|2,0,0]=4 7577 B13R1.45 CC(=O)NCC(C)c1ccccc1 1626a_100000701038_100015343762 [0,1,0,0,1,0|2,0,0]=4 7578 B13R1.45 CC(=O)NCC(C)c1ccccc1 240690a_100000701038_100015343762 [0,1,0,0,1,0|2,0,0]=4 7579 B13R1.45 CC(=O)NCC(C)c1ccccc1 527a_100000701038_100103153847 [0,1,0,0,1,0|2,0,0]=4 7580 B13R1.45 CC(=O)NCC(O)c1ccccc1 240690a_100000210709_100015343762 [0,1,0,0,1,0|2,0,0]=4 7581 B13R1.45 CC(=O)NCC(O)c1ccccc1 527a_100000210709_100103153847 [0,1,0,0,1,0|2,0,0]=4 7582 B13R1.45 CC(NCC(=O)N)c1ccccc1 2230a_100000711301_100000230085 [0,1,0,0,1,0|2,0,0]=4 7583 B13R1.45 CC(NCC(=O)O)c1ccccc1 269956a_100016091260_100000211855 [0,1,0,0,1,0|1,0,0]=3 7584 B13R1.45 CC(SCC(=O)N)c1ccccc1 62a_100000230085_100000747473 [0,1,0,0,1,0|2,0,0]=4 7585 B13R1.45 CC(SCC(=O)N)c1ccccc1 62a_100000747473_100000230085 [0,1,0,0,1,0|2,0,0]=4 7586 B13R1.45 CC(SCC(=O)[O-])c1ccccc1 62a_100000230085_100020667443 [0,1,0,0,1,0|1,0,1]=4 7587 B13R1.45 CC(SCC(=O)[O-])c1ccccc1 62a_100020667443_100000230085 [0,1,0,0,1,0|1,0,1]=4 7588 B13R1.45 CN(CCC(=O)N)c1ccccc1 2230a_100000210012_100000744528 [0,1,0,0,1,0|2,0,0]=4 7589 B13R1.45 CN(CCC(=O)N)c1ccccc1 269982a_100000210012_100000744528 [0,1,0,0,1,0|2,0,0]=4 7590 B13R1.45 CN(CCC(=O)N)c1ccccc1 34a_100000210012_100000731001 [0,1,0,0,1,0|2,0,0]=4 7591 B13R1.45 C[C@@H](NCC(=O)N)c1ccccc1 2230a_100000751104_100000747473 [0,1,0,0,1,0|2,0,0]=4 7592 B13R1.45 C[C@@H](OCC(=O)N)c1ccccc1 34a_100000761318_100000187820 [0,1,0,0,1,0|2,0,0]=4 7593 B13R1.45 C[C@@H](OCC(=O)N)c1ccccc1 7a_100000761318_100000187820 [0,1,0,0,1,0|2,0,0]=4 7594 B13R1.45 C[C@@H](OCC(=O)[O-])c1ccccc1 34a_100000761318_100020667443 [0,1,0,0,1,0|1,0,1]=4 7595 B13R1.149 CC(=O)CCCc1cccc(c1)Br 1458a_100000070787_100011713683 [0,1,0,0,1,0|1,0,0]=3 7596 B13R1.149 CC(=O)CCCc1cccc(c1)Br 1458a_100000685939_200000210301 [0,1,0,0,1,0|1,0,0]=3 7597 B13R1.149 CC(=O)CCCc1cccc(c1)F 1458a_100000070787_200000698031 [0,1,0,0,1,0|1,0,0]=3 7598 B13R1.149 CC(=O)CCOc1cccc(c1)Br 1458a_100000070787_100000183150 [0,1,0,0,1,0|2,0,0]=4 7599 B13R1.149 CC(=O)CCOc1cccc(c1)Br 1458a_100000183437_200000210301 [0,1,0,0,1,0|2,0,0]=4 7600 B13R1.149 CC(=O)CCOc1cccc(c1)Br 7a_100000210342_100000053229 [0,1,0,0,1,0|2,0,0]=4 7601 B13R1.149 CC(=O)CCOc1cccc(c1)C 1458a_100000182325_200000210301 [0,1,0,0,1,0|2,0,0]=4 7602 B13R1.149 CC(=O)CCOc1cccc(c1)C 7a_100000210337_100000053229 [0,1,0,0,1,0|2,0,0]=4 7603 B13R1.149 CC(=O)CCOc1cccc(c1)Cl 1458a_100000070787_100000181161 [0,1,0,0,1,0|2,0,0]=4 7604 B13R1.149 CC(=O)CCOc1cccc(c1)Cl 1458a_100000738917_200000210301 [0,1,0,0,1,0|2,0,0]=4 7605 B13R1.149 CC(=O)CCOc1cccc(c1)Cl 7a_100000210295_100000053229 [0,1,0,0,1,0|2,0,0]=4 7606 B13R1.149 CC(=O)CCOc1cccc(c1)F 1458a_100000070787_100000739188 [0,1,0,0,1,0|2,0,0]=4 7607 B13R1.149 CC(=O)CCOc1cccc(c1)F 1458a_100000737089_200000210301 [0,1,0,0,1,0|2,0,0]=4 7608 B13R1.149 CC(=O)CCOc1cccc(c1)F 7a_100000210426_100000053229 [0,1,0,0,1,0|2,0,0]=4 7609 B13R1.149 CC(=O)CCOc1cccc(c1)I 7a_100000211634_100000053229 [0,1,0,0,1,0|2,0,0]=4 7610 B13R1.149 CC(=O)CCSc1cccc(c1)Br 62a_100000053229_100000691529 [0,1,0,0,1,0|2,0,0]=4 7611 B13R1.149 CC(=O)CCSc1cccc(c1)Br 62a_100000691529_100000053229 [0,1,0,0,1,0|2,0,0]=4 7612 B13R1.149 CC(=O)CCSc1cccc(c1)C 62a_100000053229_100011215228 [0,1,0,0,1,0|2,0,0]=4 7613 B13R1.149 CC(=O)CCSc1cccc(c1)C 62a_100011215228_100000053229 [0,1,0,0,1,0|2,0,0]=4 7614 B13R1.149 CC(=O)CCSc1cccc(c1)Cl 62a_100000053229_100000699651 [0,1,0,0,1,0|2,0,0]=4 7615 B13R1.149 CC(=O)CCSc1cccc(c1)Cl 62a_100000699651_100000053229 [0,1,0,0,1,0|2,0,0]=4 7616 B13R1.149 CC(=O)CCSc1cccc(c1)F 62a_100000053229_100000685547 [0,1,0,0,1,0|2,0,0]=4 7617 B13R1.149 CC(=O)CCSc1cccc(c1)F 62a_100000685547_100000053229 [0,1,0,0,1,0|2,0,0]=4 7618 B13R1.149 CC(=O)CCSc1cccc(c1)N 62a_100000053229_100000210019 [0,1,0,0,1,0|2,0,0]=4 7619 B13R1.149 CC(=O)CCSc1cccc(c1)N 62a_100000210019_100000053229 [0,1,0,0,1,0|2,0,0]=4 7620 B13R1.149 CC(=O)CCSc1cccc(c1)O 62a_100000053229_100000211634 [0,1,0,0,1,0|2,0,0]=4 7621 B13R1.149 CC(=O)CCSc1cccc(c1)[S] 62a_100000053229_114929384022 [0,1,0,0,1,0|2,0,0]=4 7622 B13R1.149 CC(=O)CCSc1cccc(c1)[S] 62a_114929384022_100000053229 [0,1,0,0,1,0|2,0,0]=4 7623 B13R1.149 CC(=O)COCc1cccc(c1)Br 34a_100000211253_100000698116 [0,1,0,0,1,0|2,0,0]=4 7624 B13R1.149 CC(=O)COCc1cccc(c1)C 34a_100000211253_100000211840 [0,1,0,0,1,0|2,0,0]=4 7625 B13R1.149 CC(=O)COCc1cccc(c1)Cl 34a_100000211253_100000187163 [0,1,0,0,1,0|2,0,0]=4 7626 B13R1.149 CC(=O)COCc1cccc(c1)F 34a_100000211253_100000187166 [0,1,0,0,1,0|2,0,0]=4 7627 B13R1.149 CC(=O)COCc1cccc(c1)I 34a_100000211253_100011218688 [0,1,0,0,1,0|2,0,0]=4 7628 B13R1.149 CC(=O)COCc1cccc(c1)O 34a_100000211253_100011660834 [0,1,0,0,1,0|2,0,0]=4 7629 B13R1.149 CC(=O)CSCc1cccc(c1)Cl 1458a_100000150269_200000210301 [0,1,0,0,1,0|2,0,0]=4 7630 B13R1.149 CC(=O)NCCc1cccc(c1)Br 11a_100011207229_100015343762 [0,1,0,0,1,0|2,0,0]=4 7631 B13R1.149 CC(=O)NCCc1cccc(c1)Br 1626a_100011207229_100015343762 [0,1,0,0,1,0|2,0,0]=4 7632 B13R1.149 CC(=O)NCCc1cccc(c1)Br 240690a_100011207229_100015343762 [0,1,0,0,1,0|2,0,0]=4 7633 B13R1.149 CC(=O)NCCc1cccc(c1)Br 527a_100011207229_100103153847 [0,1,0,0,1,0|2,0,0]=4 7634 B13R1.149 CC(=O)NCCc1cccc(c1)C 11a_100000749837_100015343762 [0,1,0,0,1,0|2,0,0]=4 7635 B13R1.149 CC(=O)NCCc1cccc(c1)C 1626a_100000749837_100015343762 [0,1,0,0,1,0|2,0,0]=4 7636 B13R1.149 CC(=O)NCCc1cccc(c1)C 240690a_100000749837_100015343762 [0,1,0,0,1,0|2,0,0]=4 7637 B13R1.149 CC(=O)NCCc1cccc(c1)C 527a_100000749837_100103153847 [0,1,0,0,1,0|2,0,0]=4 7638 B13R1.149 CC(=O)NCCc1cccc(c1)Cl 11a_100000185263_100015343762 [0,1,0,0,1,0|2,0,0]=4 7639 B13R1.149 CC(=O)NCCc1cccc(c1)Cl 1626a_100000185263_100015343762 [0,1,0,0,1,0|2,0,0]=4 7640 B13R1.149 CC(=O)NCCc1cccc(c1)Cl 240690a_100000185263_100015343762 [0,1,0,0,1,0|2,0,0]=4 7641 B13R1.149 CC(=O)NCCc1cccc(c1)Cl 527a_100000185263_100103153847 [0,1,0,0,1,0|2,0,0]=4 7642 B13R1.149 CC(=O)NCCc1cccc(c1)F 11a_100000205154_100015343762 [0,1,0,0,1,0|2,0,0]=4 7643 B13R1.149 CC(=O)NCCc1cccc(c1)F 1626a_100000205154_100015343762 [0,1,0,0,1,0|2,0,0]=4 7644 B13R1.149 CC(=O)NCCc1cccc(c1)F 240690a_100000205154_100015343762 [0,1,0,0,1,0|2,0,0]=4 7645 B13R1.149 CC(=O)NCCc1cccc(c1)F 527a_100000205154_100103153847 [0,1,0,0,1,0|2,0,0]=4 7646 B13R1.149 CC(=O)NCCc1cccc(c1)O 240690a_100000747277_100015343762 [0,1,0,0,1,0|2,0,0]=4 7647 B13R1.149 CC(=O)NCCc1cccc(c1)O 527a_100000747277_100103153847 [0,1,0,0,1,0|2,0,0]=4 7648 B13R1.149 Cc1cc(ccn1)CNCC(=O)O 269956a_100016091260_200020672517 [0,1,0,0,1,0|2,0,0]=4 7649 B13R1.149 Cc1cccc(c1)CNCC(=O)N 2230a_100000185548_100000747473 [0,1,0,0,1,0|2,0,0]=4 7650 B13R1.149 Cc1cccc(c1)CNCC(=O)N 2230a_100000711301_100000211840 [0,1,0,0,1,0|2,0,0]=4 7651 B13R1.149 Cc1cccc(c1)CNCC(=O)N 34a_100000185548_100000187820 [0,1,0,0,1,0|2,0,0]=4 7652 B13R1.149 Cc1cccc(c1)CNCC(=O)O 269956a_100016091260_100000005736 [0,1,0,0,1,0|1,0,0]=3 7653 B13R1.149 Cc1cccc(c1)CNCC(=O)[O-] 34a_100000185548_100020667443 [0,1,0,0,1,0|1,0,1]=4 7654 B13R1.149 Cc1cccc(c1)COCC(=O)N 34a_100011217746_100000187820 [0,1,0,0,1,0|2,0,0]=4 7655 B13R1.149 Cc1cccc(c1)COCC(=O)N 7a_100011217746_100000187820 [0,1,0,0,1,0|2,0,0]=4 7656 B13R1.149 Cc1cccc(c1)COCC(=O)[O-] 34a_100011217746_100020667443 [0,1,0,0,1,0|1,0,1]=4 7657 B13R1.149 Cc1cccc(c1)CSCC(=O)N 62a_100000211840_100000747473 [0,1,0,0,1,0|2,0,0]=4 7658 B13R1.149 Cc1cccc(c1)CSCC(=O)N 62a_100000747473_100000211840 [0,1,0,0,1,0|2,0,0]=4 7659 B13R1.149 Cc1cccc(c1)CSCC(=O)[O-] 62a_100000211840_100020667443 [0,1,0,0,1,0|1,0,1]=4 7660 B13R1.149 Cc1cccc(c1)CSCC(=O)[O-] 62a_100020667443_100000211840 [0,1,0,0,1,0|1,0,1]=4 7661 B13R1.149 Cc1cccc(c1)NCCC(=O)N 2230a_100000188690_100000744528 [0,1,0,0,1,0|2,0,0]=4 7662 B13R1.149 Cc1cccc(c1)NCCC(=O)N 34a_100000188690_100000731001 [0,1,0,0,1,0|2,0,0]=4 7663 B13R1.149 Cc1cccc(c1)OCCC(=O)N 34a_100000210337_100000731001 [0,1,0,0,1,0|2,0,0]=4 7664 B13R1.149 Cc1cccc(c1)OCCC(=O)N 7a_100000210337_100000744528 [0,1,0,0,1,0|2,0,0]=4 7665 B13R1.149 Cc1cccc(c1)OCCC(=O)[13CH3] 1458a_100000182325_200025704644 [0,1,0,0,1,0|2,0,0]=4 7666 B13R1.149 Cc1cccc(c1)SCCC(=O)N 62a_100000744528_100011215228 [0,1,0,0,1,0|2,0,0]=4 7667 B13R1.149 Cc1cccc(c1)SCCC(=O)N 62a_100011215228_100000744528 [0,1,0,0,1,0|2,0,0]=4 7668 B13R1.149 Cc1cccc(n1)CNCC(=O)O 269956a_100016091260_100000757606 [0,1,0,0,1,0|2,0,0]=4 7669 B13R1.149 Cc1ccnc(c1)CNCC(=O)O 269956a_100016091260_100000718516 [0,1,0,0,1,0|2,0,0]=4 7670 B13R1.149 Cc1cncc(c1)CNCC(=O)O 269956a_100016091260_100016988603 [0,1,0,0,1,0|2,0,0]=4 7671 B13R1.149 NC(=O)CCNc1cccc(c1)Br 34a_100000210019_100000731001 [0,1,0,0,1,0|2,0,0]=4 7672 B13R1.149 NC(=O)CCNc1cccc(c1)Cl 34a_100000185859_100000731001 [0,1,0,0,1,0|2,0,0]=4 7673 B13R1.149 NC(=O)CCNc1cccc(c1)F 34a_100000210047_100000731001 [0,1,0,0,1,0|2,0,0]=4 7674 B13R1.149 NC(=O)CCNc1cccc(c1)I 34a_100000211102_100000731001 [0,1,0,0,1,0|2,0,0]=4 7675 B13R1.149 NC(=O)CCNc1cccc(c1)O 34a_100000210217_100000731001 [0,1,0,0,1,0|2,0,0]=4 7676 B13R1.149 NC(=O)CCOc1cccc(c1)Br 34a_100000210342_100000731001 [0,1,0,0,1,0|2,0,0]=4 7677 B13R1.149 NC(=O)CCOc1cccc(c1)Br 7a_100000210342_100000744528 [0,1,0,0,1,0|2,0,0]=4 7678 B13R1.149 NC(=O)CCOc1cccc(c1)Cl 34a_100000210295_100000731001 [0,1,0,0,1,0|2,0,0]=4 7679 B13R1.149 NC(=O)CCOc1cccc(c1)Cl 7a_100000210295_100000744528 [0,1,0,0,1,0|2,0,0]=4 7680 B13R1.149 NC(=O)CCOc1cccc(c1)F 34a_100000210426_100000731001 [0,1,0,0,1,0|2,0,0]=4 7681 B13R1.149 NC(=O)CCOc1cccc(c1)F 7a_100000210426_100000744528 [0,1,0,0,1,0|2,0,0]=4 7682 B13R1.149 NC(=O)CCOc1cccc(c1)I 34a_100000211634_100000731001 [0,1,0,0,1,0|2,0,0]=4 7683 B13R1.149 NC(=O)CCOc1cccc(c1)I 7a_100000211634_100000744528 [0,1,0,0,1,0|2,0,0]=4 7684 B13R1.149 NC(=O)CCOc1cccc(c1)N 34a_100000210217_100000731001 [0,1,0,0,1,0|2,0,0]=4 7685 B13R1.149 NC(=O)CCSc1cccc(c1)Br 62a_100000691529_100000744528 [0,1,0,0,1,0|2,0,0]=4 7686 B13R1.149 NC(=O)CCSc1cccc(c1)Br 62a_100000744528_100000691529 [0,1,0,0,1,0|2,0,0]=4 7687 B13R1.149 NC(=O)CCSc1cccc(c1)Cl 62a_100000699651_100000744528 [0,1,0,0,1,0|2,0,0]=4 7688 B13R1.149 NC(=O)CCSc1cccc(c1)Cl 62a_100000744528_100000699651 [0,1,0,0,1,0|2,0,0]=4 7689 B13R1.149 NC(=O)CCSc1cccc(c1)F 62a_100000685547_100000744528 [0,1,0,0,1,0|2,0,0]=4 7690 B13R1.149 NC(=O)CCSc1cccc(c1)F 62a_100000744528_100000685547 [0,1,0,0,1,0|2,0,0]=4 7691 B13R1.149 NC(=O)CCSc1cccc(c1)N 62a_100000210019_100000744528 [0,1,0,0,1,0|2,0,0]=4 7692 B13R1.149 NC(=O)CCSc1cccc(c1)N 62a_100000744528_100000210019 [0,1,0,0,1,0|2,0,0]=4 7693 B13R1.149 NC(=O)CCSc1cccc(c1)O 62a_100000744528_100000211634 [0,1,0,0,1,0|2,0,0]=4 7694 B13R1.149 NC(=O)CCSc1cccc(c1)[S] 62a_100000744528_114929384022 [0,1,0,0,1,0|2,0,0]=4 7695 B13R1.149 NC(=O)CCSc1cccc(c1)[S] 62a_114929384022_100000744528 [0,1,0,0,1,0|2,0,0]=4 7696 B13R1.149 NC(=O)CNCc1cccc(c1)Br 2230a_100000174977_100000747473 [0,1,0,0,1,0|2,0,0]=4 7697 B13R1.149 NC(=O)CNCc1cccc(c1)Br 2230a_100000711301_100000698116 [0,1,0,0,1,0|2,0,0]=4 7698 B13R1.149 NC(=O)CNCc1cccc(c1)Br 34a_100000174977_100000187820 [0,1,0,0,1,0|2,0,0]=4 7699 B13R1.149 NC(=O)CNCc1cccc(c1)Cl 2230a_100000174878_100000747473 [0,1,0,0,1,0|2,0,0]=4 7700 B13R1.149 NC(=O)CNCc1cccc(c1)Cl 2230a_100000711301_100000181238 [0,1,0,0,1,0|2,0,0]=4 7701 B13R1.149 NC(=O)CNCc1cccc(c1)Cl 34a_100000174878_100000187820 [0,1,0,0,1,0|2,0,0]=4 7702 B13R1.149 NC(=O)CNCc1cccc(c1)F 2230a_100000174948_100000747473 [0,1,0,0,1,0|2,0,0]=4 7703 B13R1.149 NC(=O)CNCc1cccc(c1)F 2230a_100000711301_100000230114 [0,1,0,0,1,0|2,0,0]=4 7704 B13R1.149 NC(=O)CNCc1cccc(c1)F 34a_100000174948_100000187820 [0,1,0,0,1,0|2,0,0]=4 7705 B13R1.149 NC(=O)CNCc1cccc(c1)I 2230a_100000106179_100000747473 [0,1,0,0,1,0|2,0,0]=4 7706 B13R1.149 NC(=O)CNCc1cccc(c1)I 2230a_100000711301_100011218688 [0,1,0,0,1,0|2,0,0]=4 7707 B13R1.149 NC(=O)CNCc1cccc(c1)I 34a_100000106179_100000187820 [0,1,0,0,1,0|2,0,0]=4 7708 B13R1.149 NC(=O)CNCc1cccc(c1)O 2230a_100000711301_100011660834 [0,1,0,0,1,0|2,0,0]=4 7709 B13R1.149 NC(=O)CNCc1cccc(c1)O 2230a_100000743036_100000747473 [0,1,0,0,1,0|2,0,0]=4 7710 B13R1.149 NC(=O)CNCc1cccc(c1)O 34a_100000743036_100000187820 [0,1,0,0,1,0|2,0,0]=4 7711 B13R1.149 NC(=O)COCc1cccc(c1)Br 34a_100000687537_100000187820 [0,1,0,0,1,0|2,0,0]=4 7712 B13R1.149 NC(=O)COCc1cccc(c1)Br 7a_100000687537_100000187820 [0,1,0,0,1,0|2,0,0]=4 7713 B13R1.149 NC(=O)COCc1cccc(c1)Cl 34a_100000241301_100000187820 [0,1,0,0,1,0|2,0,0]=4 7714 B13R1.149 NC(=O)COCc1cccc(c1)Cl 7a_100000241301_100000187820 [0,1,0,0,1,0|2,0,0]=4 7715 B13R1.149 NC(=O)COCc1cccc(c1)F 34a_100000210976_100000187820 [0,1,0,0,1,0|2,0,0]=4 7716 B13R1.149 NC(=O)COCc1cccc(c1)F 7a_100000210976_100000187820 [0,1,0,0,1,0|2,0,0]=4 7717 B13R1.149 NC(=O)COCc1cccc(c1)I 34a_100011215336_100000187820 [0,1,0,0,1,0|2,0,0]=4 7718 B13R1.149 NC(=O)COCc1cccc(c1)I 7a_100011215336_100000187820 [0,1,0,0,1,0|2,0,0]=4 7719 B13R1.149 NC(=O)COCc1cccc(c1)N 34a_100000211919_100000187820 [0,1,0,0,1,0|2,0,0]=4 7720 B13R1.149 NC(=O)CSCc1cccc(c1)Br 62a_100000211773_100000747473 [0,1,0,0,1,0|2,0,0]=4 7721 B13R1.149 NC(=O)CSCc1cccc(c1)Br 62a_100000747473_100000211773 [0,1,0,0,1,0|2,0,0]=4 7722 B13R1.149 NC(=O)CSCc1cccc(c1)Cl 62a_100000187163_100000747473 [0,1,0,0,1,0|2,0,0]=4 7723 B13R1.149 NC(=O)CSCc1cccc(c1)Cl 62a_100000747473_100000187163 [0,1,0,0,1,0|2,0,0]=4 7724 B13R1.149 NC(=O)CSCc1cccc(c1)F 62a_100000230114_100000747473 [0,1,0,0,1,0|2,0,0]=4 7725 B13R1.149 NC(=O)CSCc1cccc(c1)F 62a_100000747473_100000230114 [0,1,0,0,1,0|2,0,0]=4 7726 B13R1.149 NC(=O)CSCc1cccc(c1)I 62a_100000747473_100011218688 [0,1,0,0,1,0|2,0,0]=4 7727 B13R1.149 NC(=O)CSCc1cccc(c1)I 62a_100011218688_100000747473 [0,1,0,0,1,0|2,0,0]=4 7728 B13R1.149 NC(=O)CSCc1cccc(c1)O 62a_100000747473_100011660834 [0,1,0,0,1,0|2,0,0]=4 7729 B13R1.149 NC(=O)CSCc1cccc(c1)O 62a_100011660834_100000747473 [0,1,0,0,1,0|2,0,0]=4 7730 B13R1.149 Nc1cccc(c1)COCC(=O)[O-] 34a_100000211919_100020667443 [0,1,0,0,1,0|1,0,1]=4 7731 B13R1.149 O=C(O)CNCc1cc(ccn1)Br 269956a_100016091260_100010173614 [0,1,0,0,1,0|2,0,0]=4 7732 B13R1.149 O=C(O)CNCc1cc(ccn1)Cl 269956a_100016091260_100016988179 [0,1,0,0,1,0|2,0,0]=4 7733 B13R1.149 O=C(O)CNCc1cccc(c1)Br 269956a_100016091260_100000211773 [0,1,0,0,1,0|1,0,0]=3 7734 B13R1.149 O=C(O)CNCc1cccc(c1)Cl 269956a_100016091260_100000187163 [0,1,0,0,1,0|1,0,0]=3 7735 B13R1.149 O=C(O)CNCc1cccc(c1)F 269956a_100016091260_100000230114 [0,1,0,0,1,0|1,0,0]=3 7736 B13R1.149 O=C(O)CNCc1cccc(c1)I 269956a_100016091260_100011218688 [0,1,0,0,1,0|1,0,0]=3 7737 B13R1.149 O=C(O)CNCc1cccc(c1)O 269956a_100016091260_100011660834 [0,1,0,0,1,0|1,0,0]=3 7738 B13R1.149 O=C(O)CNCc1cccc(n1)Br 269956a_100016091260_100009889011 [0,1,0,0,1,0|2,0,0]=4 7739 B13R1.149 O=C(O)CNCc1cccc(n1)Cl 269956a_100016091260_100000086093 [0,1,0,0,1,0|2,0,0]=4 7740 B13R1.149 O=C(O)CNCc1cccc(n1)F 269956a_100016091260_100009819644 [0,1,0,0,1,0|2,0,0]=4 7741 B13R1.149 O=C(O)CNCc1ccnc(c1)Br 269956a_100016091260_100010254460 [0,1,0,0,1,0|2,0,0]=4 7742 B13R1.149 O=C(O)CNCc1ccnc(c1)Cl 269956a_100016091260_100000764220 [0,1,0,0,1,0|2,0,0]=4 7743 B13R1.149 O=C(O)CNCc1cncc(c1)Br 269956a_100016091260_100000738771 [0,1,0,0,1,0|2,0,0]=4 7744 B13R1.149 O=C(O)CNCc1cncc(c1)Cl 269956a_100016091260_100016992070 [0,1,0,0,1,0|2,0,0]=4 7745 B13R1.149 O=C(O)CNCc1cncc(c1)F 269956a_100016091260_100000725299 [0,1,0,0,1,0|2,0,0]=4 7746 B13R1.149 O=C([O-])CNCc1cccc(c1)Br 34a_100000174977_100020667443 [0,1,0,0,1,0|1,0,1]=4 7747 B13R1.149 O=C([O-])CNCc1cccc(c1)Cl 34a_100000174878_100020667443 [0,1,0,0,1,0|1,0,1]=4 7748 B13R1.149 O=C([O-])CNCc1cccc(c1)F 34a_100000174948_100020667443 [0,1,0,0,1,0|1,0,1]=4 7749 B13R1.149 O=C([O-])CNCc1cccc(c1)I 34a_100000106179_100020667443 [0,1,0,0,1,0|1,0,1]=4 7750 B13R1.149 O=C([O-])CNCc1cccc(c1)O 34a_100000743036_100020667443 [0,1,0,0,1,0|1,0,1]=4 7751 B13R1.149 O=C([O-])COCc1cccc(c1)Br 34a_100000687537_100020667443 [0,1,0,0,1,0|1,0,1]=4 7752 B13R1.149 O=C([O-])COCc1cccc(c1)Cl 34a_100000241301_100020667443 [0,1,0,0,1,0|1,0,1]=4 7753 B13R1.149 O=C([O-])COCc1cccc(c1)F 34a_100000210976_100020667443 [0,1,0,0,1,0|1,0,1]=4 7754 B13R1.149 O=C([O-])COCc1cccc(c1)I 34a_100011215336_100020667443 [0,1,0,0,1,0|1,0,1]=4 7755 B13R1.149 O=C([O-])CSCc1cccc(c1)Br 62a_100000211773_100020667443 [0,1,0,0,1,0|1,0,1]=4 7756 B13R1.149 O=C([O-])CSCc1cccc(c1)Br 62a_100020667443_100000211773 [0,1,0,0,1,0|1,0,1]=4 7757 B13R1.149 O=C([O-])CSCc1cccc(c1)Cl 62a_100000187163_100020667443 [0,1,0,0,1,0|1,0,1]=4 7758 B13R1.149 O=C([O-])CSCc1cccc(c1)Cl 62a_100020667443_100000187163 [0,1,0,0,1,0|1,0,1]=4 7759 B13R1.149 O=C([O-])CSCc1cccc(c1)F 62a_100000230114_100020667443 [0,1,0,0,1,0|1,0,1]=4 7760 B13R1.149 O=C([O-])CSCc1cccc(c1)F 62a_100020667443_100000230114 [0,1,0,0,1,0|1,0,1]=4 7761 B13R1.149 O=C([O-])CSCc1cccc(c1)I 62a_100011218688_100020667443 [0,1,0,0,1,0|1,0,1]=4 7762 B13R1.149 O=C([O-])CSCc1cccc(c1)I 62a_100020667443_100011218688 [0,1,0,0,1,0|1,0,1]=4 7763 B13R1.149 O=C([O-])CSCc1cccc(c1)O 62a_100011660834_100020667443 [0,1,0,0,1,0|1,0,1]=4 7764 B13R1.149 O=C([O-])CSCc1cccc(c1)O 62a_100020667443_100011660834 [0,1,0,0,1,0|1,0,1]=4 7765 B13R1.149 [13CH3]C(=O)CCCc1cccc(c1)Br 1458a_100000685939_200025704644 [0,1,0,0,1,0|1,0,0]=3 7766 B13R1.149 [13CH3]C(=O)CCOc1cccc(c1)Br 1458a_100000183437_200025704644 [0,1,0,0,1,0|2,0,0]=4 7767 B13R1.149 [13CH3]C(=O)CCOc1cccc(c1)Cl 1458a_100000738917_200025704644 [0,1,0,0,1,0|2,0,0]=4 7768 B13R1.149 [13CH3]C(=O)CCOc1cccc(c1)F 1458a_100000737089_200025704644 [0,1,0,0,1,0|2,0,0]=4 7769 B13R1.149 [13CH3]C(=O)CSCc1cccc(c1)Cl 1458a_100000150269_200025704644 [0,1,0,0,1,0|2,0,0]=4 7770 B13R1.158 CC(=O)CCCc1ccccc1Br 1458a_100000070787_200011713681 [0,1,0,0,1,0|1,0,0]=3 7771 B13R1.158 CC(=O)CCCc1ccccc1Cl 1458a_100000700343_200000210301 [0,1,0,0,1,0|1,0,0]=3 7772 B13R1.158 CC(=O)CCCc1ccccc1O 1458a_100009859317_200000210301 [0,1,0,0,1,0|1,0,0]=3 7773 B13R1.158 CC(=O)CCOc1ccccc1Br 1458a_100000070787_100000695877 [0,1,0,0,1,0|2,0,0]=4 7774 B13R1.158 CC(=O)CCOc1ccccc1Br 1458a_100000740817_200000210301 [0,1,0,0,1,0|2,0,0]=4 7775 B13R1.158 CC(=O)CCOc1ccccc1Br 7a_100000181306_100000053229 [0,1,0,0,1,0|2,0,0]=4 7776 B13R1.158 CC(=O)CCOc1ccccc1C 1458a_100000070787_100000184434 [0,1,0,0,1,0|2,0,0]=4 7777 B13R1.158 CC(=O)CCOc1ccccc1C 1458a_100000182324_200000210301 [0,1,0,0,1,0|2,0,0]=4 7778 B13R1.158 CC(=O)CCOc1ccccc1C 7a_100000210338_100000053229 [0,1,0,0,1,0|2,0,0]=4 7779 B13R1.158 CC(=O)CCOc1ccccc1Cl 1458a_100000240438_200000210301 [0,1,0,0,1,0|2,0,0]=4 7780 B13R1.158 CC(=O)CCOc1ccccc1Cl 7a_100000210172_100000053229 [0,1,0,0,1,0|2,0,0]=4 7781 B13R1.158 CC(=O)CCOc1ccccc1F 1458a_100000070787_100000183290 [0,1,0,0,1,0|2,0,0]=4 7782 B13R1.158 CC(=O)CCOc1ccccc1F 1458a_100000184057_200000210301 [0,1,0,0,1,0|2,0,0]=4 7783 B13R1.158 CC(=O)CCOc1ccccc1F 7a_100000210171_100000053229 [0,1,0,0,1,0|2,0,0]=4 7784 B13R1.158 CC(=O)CCOc1ccccc1I 7a_100000739446_100000053229 [0,1,0,0,1,0|2,0,0]=4 7785 B13R1.158 CC(=O)CCOc1ccccc1N 7a_100000185747_100000053229 [0,1,0,0,1,0|2,0,0]=4 7786 B13R1.158 CC(=O)CCSc1ccccc1Br 62a_100000053229_100000695589 [0,1,0,0,1,0|2,0,0]=4 7787 B13R1.158 CC(=O)CCSc1ccccc1Br 62a_100000695589_100000053229 [0,1,0,0,1,0|2,0,0]=4 7788 B13R1.158 CC(=O)CCSc1ccccc1C 62a_100000053229_100000210755 [0,1,0,0,1,0|2,0,0]=4 7789 B13R1.158 CC(=O)CCSc1ccccc1C 62a_100000210755_100000053229 [0,1,0,0,1,0|2,0,0]=4 7790 B13R1.158 CC(=O)CCSc1ccccc1Cl 62a_100000053229_100000764095 [0,1,0,0,1,0|2,0,0]=4 7791 B13R1.158 CC(=O)CCSc1ccccc1Cl 62a_100000764095_100000053229 [0,1,0,0,1,0|2,0,0]=4 7792 B13R1.158 CC(=O)CCSc1ccccc1F 1458a_100000208832_200000210301 [0,1,0,0,1,0|2,0,0]=4 7793 B13R1.158 CC(=O)CCSc1ccccc1F 62a_100000053229_100011215700 [0,1,0,0,1,0|2,0,0]=4 7794 B13R1.158 CC(=O)CCSc1ccccc1F 62a_100011215700_100000053229 [0,1,0,0,1,0|2,0,0]=4 7795 B13R1.158 CC(=O)CCSc1ccccc1N 62a_100000053229_100000210017 [0,1,0,0,1,0|2,0,0]=4 7796 B13R1.158 CC(=O)CCSc1ccccc1N 62a_100000210017_100000053229 [0,1,0,0,1,0|2,0,0]=4 7797 B13R1.158 CC(=O)CCSc1ccccc1O 62a_100000053229_100000739446 [0,1,0,0,1,0|2,0,0]=4 7798 B13R1.158 CC(=O)CCSc1ccccc1O 62a_100000739446_100000053229 [0,1,0,0,1,0|2,0,0]=4 7799 B13R1.158 CC(=O)COCc1ccccc1Br 34a_100000211253_100000184730 [0,1,0,0,1,0|2,0,0]=4 7800 B13R1.158 CC(=O)COCc1ccccc1C 34a_100000211253_100000211839 [0,1,0,0,1,0|2,0,0]=4 7801 B13R1.158 CC(=O)COCc1ccccc1Cl 34a_100000211253_100000187162 [0,1,0,0,1,0|2,0,0]=4 7802 B13R1.158 CC(=O)COCc1ccccc1F 34a_100000211253_100000211605 [0,1,0,0,1,0|2,0,0]=4 7803 B13R1.158 CC(=O)COCc1ccccc1I 34a_100000211253_100011215278 [0,1,0,0,1,0|2,0,0]=4 7804 B13R1.158 CC(=O)CSCc1ccccc1C 1458a_100000150258_200000210301 [0,1,0,0,1,0|2,0,0]=4 7805 B13R1.158 CC(=O)CSCc1ccccc1Cl 1458a_100000150270_200000210301 [0,1,0,0,1,0|2,0,0]=4 7806 B13R1.158 CC(=O)CSCc1ccccc1F 1458a_100000150260_200000210301 [0,1,0,0,1,0|2,0,0]=4 7807 B13R1.158 CC(=O)NCCc1ccccc1Br 11a_100000747383_100015343762 [0,1,0,0,1,0|2,0,0]=4 7808 B13R1.158 CC(=O)NCCc1ccccc1Br 1626a_100000747383_100015343762 [0,1,0,0,1,0|2,0,0]=4 7809 B13R1.158 CC(=O)NCCc1ccccc1Br 240690a_100000747383_100015343762 [0,1,0,0,1,0|2,0,0]=4 7810 B13R1.158 CC(=O)NCCc1ccccc1Br 527a_100000747383_100103153847 [0,1,0,0,1,0|2,0,0]=4 7811 B13R1.158 CC(=O)NCCc1ccccc1C 11a_100000685071_100015343762 [0,1,0,0,1,0|2,0,0]=4 7812 B13R1.158 CC(=O)NCCc1ccccc1C 1626a_100000685071_100015343762 [0,1,0,0,1,0|2,0,0]=4 7813 B13R1.158 CC(=O)NCCc1ccccc1C 240690a_100000685071_100015343762 [0,1,0,0,1,0|2,0,0]=4 7814 B13R1.158 CC(=O)NCCc1ccccc1C 527a_100000685071_100103153847 [0,1,0,0,1,0|2,0,0]=4 7815 B13R1.158 CC(=O)NCCc1ccccc1Cl 11a_100011207228_100015343762 [0,1,0,0,1,0|2,0,0]=4 7816 B13R1.158 CC(=O)NCCc1ccccc1Cl 1626a_100011207228_100015343762 [0,1,0,0,1,0|2,0,0]=4 7817 B13R1.158 CC(=O)NCCc1ccccc1Cl 240690a_100011207228_100015343762 [0,1,0,0,1,0|2,0,0]=4 7818 B13R1.158 CC(=O)NCCc1ccccc1Cl 527a_100011207228_100103153847 [0,1,0,0,1,0|2,0,0]=4 7819 B13R1.158 CC(=O)NCCc1ccccc1F 11a_100000185272_100015343762 [0,1,0,0,1,0|2,0,0]=4 7820 B13R1.158 CC(=O)NCCc1ccccc1F 1626a_100000185272_100015343762 [0,1,0,0,1,0|2,0,0]=4 7821 B13R1.158 CC(=O)NCCc1ccccc1F 240690a_100000185272_100015343762 [0,1,0,0,1,0|2,0,0]=4 7822 B13R1.158 CC(=O)NCCc1ccccc1F 527a_100000185272_100103153847 [0,1,0,0,1,0|2,0,0]=4 7823 B13R1.158 CC(=O)NCCc1ccccc1O 240690a_100011207237_100015343762 [0,1,0,0,1,0|2,0,0]=4 7824 B13R1.158 CC(=O)NCCc1ccccc1O 527a_100011207237_100103153847 [0,1,0,0,1,0|2,0,0]=4 7825 B13R1.158 Cc1ccccc1CNCC(=O)N 2230a_100000711301_100000211839 [0,1,0,0,1,0|2,0,0]=4 7826 B13R1.158 Cc1ccccc1CNCC(=O)N 34a_100000174972_100000187820 [0,1,0,0,1,0|2,0,0]=4 7827 B13R1.158 Cc1ccccc1CNCC(=O)O 269956a_100016091260_100000211750 [0,1,0,0,1,0|1,0,0]=3 7828 B13R1.158 Cc1ccccc1CNCC(=O)[O-] 34a_100000174972_100020667443 [0,1,0,0,1,0|1,0,1]=4 7829 B13R1.158 Cc1ccccc1COCC(=O)N 34a_100000698903_100000187820 [0,1,0,0,1,0|2,0,0]=4 7830 B13R1.158 Cc1ccccc1COCC(=O)N 7a_100000698903_100000187820 [0,1,0,0,1,0|2,0,0]=4 7831 B13R1.158 Cc1ccccc1COCC(=O)[O-] 34a_100000698903_100020667443 [0,1,0,0,1,0|1,0,1]=4 7832 B13R1.158 Cc1ccccc1CSCC(=O)N 62a_100000211839_100000747473 [0,1,0,0,1,0|2,0,0]=4 7833 B13R1.158 Cc1ccccc1CSCC(=O)N 62a_100000747473_100000211839 [0,1,0,0,1,0|2,0,0]=4 7834 B13R1.158 Cc1ccccc1CSCC(=O)[13CH3] 1458a_100000150258_200025704644 [0,1,0,0,1,0|2,0,0]=4 7835 B13R1.158 Cc1ccccc1CSCC(=O)[O-] 62a_100000211839_100020667443 [0,1,0,0,1,0|1,0,1]=4 7836 B13R1.158 Cc1ccccc1CSCC(=O)[O-] 62a_100020667443_100000211839 [0,1,0,0,1,0|1,0,1]=4 7837 B13R1.158 Cc1ccccc1NCCC(=O)N 34a_100015192222_100000731001 [0,1,0,0,1,0|2,0,0]=4 7838 B13R1.158 Cc1ccccc1OCCC(=O)N 34a_100000210338_100000731001 [0,1,0,0,1,0|2,0,0]=4 7839 B13R1.158 Cc1ccccc1OCCC(=O)N 7a_100000210338_100000744528 [0,1,0,0,1,0|2,0,0]=4 7840 B13R1.158 Cc1ccccc1OCCC(=O)[13CH3] 1458a_100000182324_200025704644 [0,1,0,0,1,0|2,0,0]=4 7841 B13R1.158 Cc1ccccc1SCCC(=O)N 62a_100000210755_100000744528 [0,1,0,0,1,0|2,0,0]=4 7842 B13R1.158 Cc1ccccc1SCCC(=O)N 62a_100000744528_100000210755 [0,1,0,0,1,0|2,0,0]=4 7843 B13R1.158 Cc1cccnc1CNCC(=O)O 269956a_100016091260_100000696600 [0,1,0,0,1,0|2,0,0]=4 7844 B13R1.158 Cc1ccncc1CNCC(=O)O 269956a_100016091260_100000690890 [0,1,0,0,1,0|2,0,0]=4 7845 B13R1.158 Cc1cnccc1CNCC(=O)O 269956a_100016091260_100020672808 [0,1,0,0,1,0|2,0,0]=4 7846 B13R1.158 Cc1ncccc1CNCC(=O)O 269956a_100016091260_100000732876 [0,1,0,0,1,0|2,0,0]=4 7847 B13R1.158 NC(=O)CCNc1ccccc1Br 34a_100000210017_100000731001 [0,1,0,0,1,0|2,0,0]=4 7848 B13R1.158 NC(=O)CCNc1ccccc1Cl 34a_100000185783_100000731001 [0,1,0,0,1,0|2,0,0]=4 7849 B13R1.158 NC(=O)CCNc1ccccc1F 34a_100000210422_100000731001 [0,1,0,0,1,0|2,0,0]=4 7850 B13R1.158 NC(=O)CCNc1ccccc1I 34a_100000210053_100000731001 [0,1,0,0,1,0|2,0,0]=4 7851 B13R1.158 NC(=O)CCNc1ccccc1O 34a_100000185747_100000731001 [0,1,0,0,1,0|2,0,0]=4 7852 B13R1.158 NC(=O)CCOc1ccccc1Br 34a_100000181306_100000731001 [0,1,0,0,1,0|2,0,0]=4 7853 B13R1.158 NC(=O)CCOc1ccccc1Br 7a_100000181306_100000744528 [0,1,0,0,1,0|2,0,0]=4 7854 B13R1.158 NC(=O)CCOc1ccccc1Cl 34a_100000210172_100000731001 [0,1,0,0,1,0|2,0,0]=4 7855 B13R1.158 NC(=O)CCOc1ccccc1Cl 7a_100000210172_100000744528 [0,1,0,0,1,0|2,0,0]=4 7856 B13R1.158 NC(=O)CCOc1ccccc1F 34a_100000210171_100000731001 [0,1,0,0,1,0|2,0,0]=4 7857 B13R1.158 NC(=O)CCOc1ccccc1F 7a_100000210171_100000744528 [0,1,0,0,1,0|2,0,0]=4 7858 B13R1.158 NC(=O)CCOc1ccccc1I 34a_100000739446_100000731001 [0,1,0,0,1,0|2,0,0]=4 7859 B13R1.158 NC(=O)CCOc1ccccc1I 7a_100000739446_100000744528 [0,1,0,0,1,0|2,0,0]=4 7860 B13R1.158 NC(=O)CCOc1ccccc1N 34a_100000185747_100000731001 [0,1,0,0,1,0|2,0,0]=4 7861 B13R1.158 NC(=O)CCOc1ccccc1N 7a_100000185747_100000744528 [0,1,0,0,1,0|2,0,0]=4 7862 B13R1.158 NC(=O)CCSc1ccccc1Br 62a_100000695589_100000744528 [0,1,0,0,1,0|2,0,0]=4 7863 B13R1.158 NC(=O)CCSc1ccccc1Br 62a_100000744528_100000695589 [0,1,0,0,1,0|2,0,0]=4 7864 B13R1.158 NC(=O)CCSc1ccccc1Cl 62a_100000744528_100000764095 [0,1,0,0,1,0|2,0,0]=4 7865 B13R1.158 NC(=O)CCSc1ccccc1Cl 62a_100000764095_100000744528 [0,1,0,0,1,0|2,0,0]=4 7866 B13R1.158 NC(=O)CCSc1ccccc1F 62a_100000744528_100011215700 [0,1,0,0,1,0|2,0,0]=4 7867 B13R1.158 NC(=O)CCSc1ccccc1F 62a_100011215700_100000744528 [0,1,0,0,1,0|2,0,0]=4 7868 B13R1.158 NC(=O)CCSc1ccccc1N 62a_100000210017_100000744528 [0,1,0,0,1,0|2,0,0]=4 7869 B13R1.158 NC(=O)CCSc1ccccc1N 62a_100000744528_100000210017 [0,1,0,0,1,0|2,0,0]=4 7870 B13R1.158 NC(=O)CCSc1ccccc1O 62a_100000739446_100000744528 [0,1,0,0,1,0|2,0,0]=4 7871 B13R1.158 NC(=O)CCSc1ccccc1O 62a_100000744528_100000739446 [0,1,0,0,1,0|2,0,0]=4 7872 B13R1.158 NC(=O)CNCc1ccccc1Br 2230a_100000689332_100000747473 [0,1,0,0,1,0|2,0,0]=4 7873 B13R1.158 NC(=O)CNCc1ccccc1Br 2230a_100000711301_100000184730 [0,1,0,0,1,0|2,0,0]=4 7874 B13R1.158 NC(=O)CNCc1ccccc1Br 34a_100000689332_100000187820 [0,1,0,0,1,0|2,0,0]=4 7875 B13R1.158 NC(=O)CNCc1ccccc1Cl 2230a_100000174879_100000747473 [0,1,0,0,1,0|2,0,0]=4 7876 B13R1.158 NC(=O)CNCc1ccccc1Cl 2230a_100000711301_100000187162 [0,1,0,0,1,0|2,0,0]=4 7877 B13R1.158 NC(=O)CNCc1ccccc1Cl 34a_100000174879_100000187820 [0,1,0,0,1,0|2,0,0]=4 7878 B13R1.158 NC(=O)CNCc1ccccc1F 2230a_100000711301_100000211605 [0,1,0,0,1,0|2,0,0]=4 7879 B13R1.158 NC(=O)CNCc1ccccc1F 34a_100000174869_100000187820 [0,1,0,0,1,0|2,0,0]=4 7880 B13R1.158 NC(=O)CNCc1ccccc1I 2230a_100000711301_100011215278 [0,1,0,0,1,0|2,0,0]=4 7881 B13R1.158 NC(=O)CNCc1ccccc1O 34a_100000185550_100000187820 [0,1,0,0,1,0|2,0,0]=4 7882 B13R1.158 NC(=O)COCc1ccccc1Br 34a_100000756307_100000187820 [0,1,0,0,1,0|2,0,0]=4 7883 B13R1.158 NC(=O)COCc1ccccc1Br 7a_100000756307_100000187820 [0,1,0,0,1,0|2,0,0]=4 7884 B13R1.158 NC(=O)COCc1ccccc1Cl 34a_100000210847_100000187820 [0,1,0,0,1,0|2,0,0]=4 7885 B13R1.158 NC(=O)COCc1ccccc1Cl 7a_100000210847_100000187820 [0,1,0,0,1,0|2,0,0]=4 7886 B13R1.158 NC(=O)COCc1ccccc1F 34a_100000211962_100000187820 [0,1,0,0,1,0|2,0,0]=4 7887 B13R1.158 NC(=O)COCc1ccccc1F 7a_100000211962_100000187820 [0,1,0,0,1,0|2,0,0]=4 7888 B13R1.158 NC(=O)COCc1ccccc1I 34a_100000187465_100000187820 [0,1,0,0,1,0|2,0,0]=4 7889 B13R1.158 NC(=O)COCc1ccccc1I 7a_100000187465_100000187820 [0,1,0,0,1,0|2,0,0]=4 7890 B13R1.158 NC(=O)COCc1ccccc1N 34a_100000212039_100000187820 [0,1,0,0,1,0|2,0,0]=4 7891 B13R1.158 NC(=O)CSCc1ccccc1Br 62a_100000184730_100000747473 [0,1,0,0,1,0|2,0,0]=4 7892 B13R1.158 NC(=O)CSCc1ccccc1Br 62a_100000747473_100000184730 [0,1,0,0,1,0|2,0,0]=4 7893 B13R1.158 NC(=O)CSCc1ccccc1Cl 62a_100000187162_100000747473 [0,1,0,0,1,0|2,0,0]=4 7894 B13R1.158 NC(=O)CSCc1ccccc1Cl 62a_100000747473_100000187162 [0,1,0,0,1,0|2,0,0]=4 7895 B13R1.158 NC(=O)CSCc1ccccc1F 62a_100000211605_100000747473 [0,1,0,0,1,0|2,0,0]=4 7896 B13R1.158 NC(=O)CSCc1ccccc1F 62a_100000747473_100000211605 [0,1,0,0,1,0|2,0,0]=4 7897 B13R1.158 NC(=O)CSCc1ccccc1I 62a_100000747473_100011216222 [0,1,0,0,1,0|2,0,0]=4 7898 B13R1.158 NC(=O)CSCc1ccccc1I 62a_100011216222_100000747473 [0,1,0,0,1,0|2,0,0]=4 7899 B13R1.158 Nc1ccccc1COCC(=O)[O-] 34a_100000212039_100020667443 [0,1,0,0,1,0|1,0,1]=4 7900 B13R1.158 O=C(O)CNCc1ccccc1Br 269956a_100016091260_100000184730 [0,1,0,0,1,0|1,0,0]=3 7901 B13R1.158 O=C(O)CNCc1ccccc1Cl 269956a_100016091260_100000187162 [0,1,0,0,1,0|1,0,0]=3 7902 B13R1.158 O=C(O)CNCc1ccccc1F 269956a_100016091260_100000187165 [0,1,0,0,1,0|1,0,0]=3 7903 B13R1.158 O=C(O)CNCc1ccccc1I 269956a_100016091260_100011216222 [0,1,0,0,1,0|1,0,0]=3 7904 B13R1.158 O=C(O)CNCc1cccnc1Br 269956a_100016091260_100010140945 [0,1,0,0,1,0|2,0,0]=4 7905 B13R1.158 O=C(O)CNCc1cccnc1Cl 269956a_100016091260_100000045678 [0,1,0,0,1,0|2,0,0]=4 7906 B13R1.158 O=C(O)CNCc1cccnc1F 269956a_100016091260_100000099810 [0,1,0,0,1,0|2,0,0]=4 7907 B13R1.158 O=C(O)CNCc1ccncc1Cl 269956a_100016091260_100000763264 [0,1,0,0,1,0|2,0,0]=4 7908 B13R1.158 O=C(O)CNCc1ncccc1Br 269956a_100016091260_100025702911 [0,1,0,0,1,0|2,0,0]=4 7909 B13R1.158 O=C(O)CNCc1ncccc1Cl 269956a_100016091260_100000099807 [0,1,0,0,1,0|2,0,0]=4 7910 B13R1.158 O=C(O)CNCc1ncccc1F 269956a_100016091260_100000104219 [0,1,0,0,1,0|2,0,0]=4 7911 B13R1.158 O=C(O)CNCc1ncccc1O 269956a_100016091260_200020655725 [0,1,0,0,1,0|2,0,0]=4 7912 B13R1.158 O=C([O-])CNCc1ccccc1Br 34a_100000689332_100020667443 [0,1,0,0,1,0|1,0,1]=4 7913 B13R1.158 O=C([O-])CNCc1ccccc1Cl 34a_100000174879_100020667443 [0,1,0,0,1,0|1,0,1]=4 7914 B13R1.158 O=C([O-])CNCc1ccccc1F 34a_100000174869_100020667443 [0,1,0,0,1,0|1,0,1]=4 7915 B13R1.158 O=C([O-])CNCc1ccccc1O 34a_100000185550_100020667443 [0,1,0,0,1,0|1,0,1]=4 7916 B13R1.158 O=C([O-])COCc1ccccc1Br 34a_100000756307_100020667443 [0,1,0,0,1,0|1,0,1]=4 7917 B13R1.158 O=C([O-])COCc1ccccc1Cl 34a_100000210847_100020667443 [0,1,0,0,1,0|1,0,1]=4 7918 B13R1.158 O=C([O-])COCc1ccccc1F 34a_100000211962_100020667443 [0,1,0,0,1,0|1,0,1]=4 7919 B13R1.158 O=C([O-])COCc1ccccc1I 34a_100000187465_100020667443 [0,1,0,0,1,0|1,0,1]=4 7920 B13R1.158 O=C([O-])CSCc1ccccc1Br 62a_100000184730_100020667443 [0,1,0,0,1,0|1,0,1]=4 7921 B13R1.158 O=C([O-])CSCc1ccccc1Br 62a_100020667443_100000184730 [0,1,0,0,1,0|1,0,1]=4 7922 B13R1.158 O=C([O-])CSCc1ccccc1Cl 62a_100000187162_100020667443 [0,1,0,0,1,0|1,0,1]=4 7923 B13R1.158 O=C([O-])CSCc1ccccc1Cl 62a_100020667443_100000187162 [0,1,0,0,1,0|1,0,1]=4 7924 B13R1.158 O=C([O-])CSCc1ccccc1F 62a_100000211605_100020667443 [0,1,0,0,1,0|1,0,1]=4 7925 B13R1.158 O=C([O-])CSCc1ccccc1F 62a_100020667443_100000211605 [0,1,0,0,1,0|1,0,1]=4 7926 B13R1.158 O=C([O-])CSCc1ccccc1I 62a_100011216222_100020667443 [0,1,0,0,1,0|1,0,1]=4 7927 B13R1.158 O=C([O-])CSCc1ccccc1I 62a_100020667443_100011216222 [0,1,0,0,1,0|1,0,1]=4 7928 B13R1.158 [13CH3]C(=O)CCCc1ccccc1Cl 1458a_100000700343_200025704644 [0,1,0,0,1,0|1,0,0]=3 7929 B13R1.158 [13CH3]C(=O)CCCc1ccccc1O 1458a_100009859317_200025704644 [0,1,0,0,1,0|1,0,0]=3 7930 B13R1.158 [13CH3]C(=O)CCOc1ccccc1Br 1458a_100000740817_200025704644 [0,1,0,0,1,0|2,0,0]=4 7931 B13R1.158 [13CH3]C(=O)CCOc1ccccc1Cl 1458a_100000240438_200025704644 [0,1,0,0,1,0|2,0,0]=4 7932 B13R1.158 [13CH3]C(=O)CCOc1ccccc1F 1458a_100000184057_200025704644 [0,1,0,0,1,0|2,0,0]=4 7933 B13R1.158 [13CH3]C(=O)CCSc1ccccc1F 1458a_100000208832_200025704644 [0,1,0,0,1,0|2,0,0]=4 7934 B13R1.158 [13CH3]C(=O)CSCc1ccccc1Cl 1458a_100000150270_200025704644 [0,1,0,0,1,0|2,0,0]=4 7935 B13R1.158 [13CH3]C(=O)CSCc1ccccc1F 1458a_100000150260_200025704644 [0,1,0,0,1,0|2,0,0]=4 7936 B13R1.348 CC(=O)CC(=O)Cc1ccccc1 1458a_100000070787_100000233483 [0,1,0,0,1,0|1,0,1]=4 7937 B13R1.348 CC(=O)CN(C)Cc1ccccc1 1458a_100000745601_200000210301 [0,1,0,0,1,0|2,0,0]=4 7938 B13R1.348 CN(CC(=O)N)Cc1ccccc1 2230a_100000186898_100000747473 [0,1,0,0,1,0|2,0,0]=4 7939 B13R1.348 CN(CC(=O)N)Cc1ccccc1 2230a_100000739694_100015291786 [0,1,0,0,1,0|2,0,0]=4 7940 B13R1.348 CN(CC(=O)N)Cc1ccccc1 269982a_100000186898_100000187820 [0,1,0,0,1,0|2,0,0]=4 7941 B13R1.348 CN(CC(=O)N)Cc1ccccc1 270004a_100000739694_100015611070 [0,1,0,0,1,0|2,0,0]=4 7942 B13R1.348 CN(CC(=O)O)Cc1ccccc1 269956a_100000745947_200000210301 [0,1,0,0,1,0|1,0,0]=3 7943 B13R1.348 CN(CC(=O)O)Cc1ccccc1 269956a_100000746989_100015291786 [0,1,0,0,1,0|1,0,0]=3 7944 B13R1.348 CN(CC(=O)O)Cc1ccccn1 269956a_100000746989_100000721315 [0,1,0,0,1,0|2,0,0]=4 7945 B13R1.348 CN(CC(=O)O)Cc1cccnc1 269956a_100000746989_100000733263 [0,1,0,0,1,0|2,0,0]=4 7946 B13R1.348 CN(CC(=O)O)Cc1ccncc1 269956a_100000746989_100015193705 [0,1,0,0,1,0|2,0,0]=4 7947 B13R1.348 CN(CC(=O)[13CH3])Cc1ccccc1 1458a_100000745601_200025704644 [0,1,0,0,1,0|2,0,0]=4 7948 B13R1.348 CN(CC(=O)[O-])Cc1ccccc1 269982a_100000186898_100020667443 [0,1,0,0,1,0|1,0,1]=4 7949 B13R1.348 NC(=O)CC(=O)Cc1ccccc1 1458a_100134613110_100015291786 [0,1,0,0,1,0|1,0,1]=4 7950 B13R1.348 [13CH3]N(CC(=O)O)Cc1ccccc1 269956a_100000745947_200025704644 [0,1,0,0,1,0|1,0,0]=3 7951 B13R1.351 CC(=O)C(C)CCc1ccccc1 1458a_100011435293_200000210301 [0,1,0,0,1,0|1,0,0]=3 7952 B13R1.351 CC(=O)C(C)NCc1ccccc1 2230a_100015324214_100009814033 [0,1,0,0,1,0|2,0,0]=4 7953 B13R1.351 CC(=O)C(C)OCc1ccccc1 34a_100000212229_100015291786 [0,1,0,0,1,0|2,0,0]=4 7954 B13R1.351 CC(=O)C(C)OCc1ccccc1 7a_100000210790_100000179758 [0,1,0,0,1,0|2,0,0]=4 7955 B13R1.351 CC(=O)C(C)SCc1ccccc1 1458a_100000149570_200000210301 [0,1,0,0,1,0|2,0,0]=4 7956 B13R1.351 CC(=O)C(C)SCc1ccccc1 62a_100000211182_100009814033 [0,1,0,0,1,0|2,0,0]=4 7957 B13R1.351 CC(=O)C(C)SCc1ccccc1 62a_100009814033_100015291786 [0,1,0,0,1,0|2,0,0]=4 7958 B13R1.351 CC(=O)C(O)CCc1ccccc1 1458a_100000242596_200000210301 [0,1,0,0,1,0|1,0,0]=3 7959 B13R1.351 CC(=O)N(C)CCc1ccccc1 11a_100000207497_100015343762 [0,1,0,0,1,0|2,0,0]=4 7960 B13R1.351 CC(=O)N(C)CCc1ccccc1 1626a_100000207497_100015343762 [0,1,0,0,1,0|2,0,0]=4 7961 B13R1.351 CC(=O)N(C)CCc1ccccc1 240690a_100000207497_100015343762 [0,1,0,0,1,0|2,0,0]=4 7962 B13R1.351 CC(=O)N(C)CCc1ccccc1 527a_100000207497_100103153847 [0,1,0,0,1,0|2,0,0]=4 7963 B13R1.351 CC(=O)[C@H](C)OCc1ccccc1 1458a_100000703211_200000210301 [0,1,0,0,1,0|2,0,0]=4 7964 B13R1.351 CC(CCc1ccccc1)C(=O)[13CH3] 1458a_100011435293_200025704644 [0,1,0,0,1,0|1,0,0]=3 7965 B13R1.351 CC(NCc1ccccc1)C(=O)N 2230a_100015324214_100000702099 [0,1,0,0,1,0|2,0,0]=4 7966 B13R1.351 CC(NCc1ccccc1)C(=O)N 34a_100015324214_100000702099 [0,1,0,0,1,0|2,0,0]=4 7967 B13R1.351 CC(OCc1ccccc1)C(=O)N 34a_100000210790_100000702099 [0,1,0,0,1,0|2,0,0]=4 7968 B13R1.351 CC(OCc1ccccc1)C(=O)N 7a_100000210790_100000702099 [0,1,0,0,1,0|2,0,0]=4 7969 B13R1.351 CC(SCc1ccccc1)C(=O)N 62a_100000211182_100000702099 [0,1,0,0,1,0|2,0,0]=4 7970 B13R1.351 CC(SCc1ccccc1)C(=O)N 62a_100000702099_100015291786 [0,1,0,0,1,0|2,0,0]=4 7971 B13R1.351 CC(SCc1ccccc1)C(=O)[13CH3] 1458a_100000149570_200025704644 [0,1,0,0,1,0|2,0,0]=4 7972 B13R1.351 C[C@@H](NCc1ccccc1)C(=O)N 2230a_100000119354_100015291786 [0,1,0,0,1,0|2,0,0]=4 7973 B13R1.351 C[C@@H](NCc1ccccc1)C(=O)N 270004a_100000119354_100015611070 [0,1,0,0,1,0|2,0,0]=4 7974 B13R1.351 C[C@@H](NCc1ccccc1)C(=O)N 34a_100000119354_100015291786 [0,1,0,0,1,0|2,0,0]=4 7975 B13R1.351 C[C@@H](OCc1ccccc1)C(=O)N 34a_100000731257_100015291786 [0,1,0,0,1,0|2,0,0]=4 7976 B13R1.351 C[C@@H](OCc1ccccc1)C(=O)N 7a_100000731257_100000211182 [0,1,0,0,1,0|2,0,0]=4 7977 B13R1.351 C[C@H](NCc1ccccc1)C(=O)O 269956a_100000743915_100015291786 [0,1,0,0,1,0|1,0,0]=3 7978 B13R1.351 C[C@H](NCc1ccccn1)C(=O)O 269956a_100000743915_100000721315 [0,1,0,0,1,0|2,0,0]=4 7979 B13R1.351 C[C@H](NCc1cccnc1)C(=O)O 269956a_100000743915_100000733263 [0,1,0,0,1,0|2,0,0]=4 7980 B13R1.351 C[C@H](NCc1ccncc1)C(=O)O 269956a_100000743915_100015193705 [0,1,0,0,1,0|2,0,0]=4 7981 B13R1.351 C[C@H](OCc1ccccc1)C(=O)[13CH3] 1458a_100000703211_200025704644 [0,1,0,0,1,0|2,0,0]=4 7982 B13R1.351 C[C@H](OCc1ccccc1)C(=O)[O-] 7a_217856618621_100000211182 [0,1,0,0,1,0|1,0,1]=4 7983 B13R1.351 NC(=O)C(F)NCc1ccccc1 2230a_100015324214_100009813875 [0,1,0,0,1,0|2,0,0]=4 7984 B13R1.351 NC(=O)C(F)NCc1ccccc1 34a_100015324214_100009813875 [0,1,0,0,1,0|2,0,0]=4 7985 B13R1.351 NC(=O)C(F)OCc1ccccc1 34a_100000210790_100009813875 [0,1,0,0,1,0|2,0,0]=4 7986 B13R1.351 NC(=O)C(F)OCc1ccccc1 7a_100000210790_100009813875 [0,1,0,0,1,0|2,0,0]=4 7987 B13R1.351 NC(=O)C(F)SCc1ccccc1 62a_100000211182_100009813875 [0,1,0,0,1,0|2,0,0]=4 7988 B13R1.351 NC(=O)C(F)SCc1ccccc1 62a_100009813875_100015291786 [0,1,0,0,1,0|2,0,0]=4 7989 B13R1.351 O=C([O-])C(F)NCc1ccccc1 34a_100015324214_100020610796 [0,1,0,0,1,0|1,0,1]=4 7990 B13R1.351 O=C([O-])C(F)OCc1ccccc1 34a_100000210790_100020610796 [0,1,0,0,1,0|1,0,1]=4 7991 B13R1.351 O=C([O-])C(F)SCc1ccccc1 62a_100000211182_100020610796 [0,1,0,0,1,0|1,0,1]=4 7992 B13R1.351 O=C([O-])C(F)SCc1ccccc1 62a_100020610796_100015291786 [0,1,0,0,1,0|1,0,1]=4 7993 B13R1.351 [13CH3]C(=O)C(O)CCc1ccccc1 1458a_100000242596_200025704644 [0,1,0,0,1,0|1,0,0]=3 7994 B13R1.513 CC(=O)CCCc1ccc(cc1)Br 1458a_100000070787_100011713682 [0,1,0,0,1,0|1,0,0]=3 7995 B13R1.513 CC(=O)CCCc1ccc(cc1)Br 1458a_100011236545_200000210301 [0,1,0,0,1,0|1,0,0]=3 7996 B13R1.513 CC(=O)CCCc1ccc(cc1)C 1458a_100000741418_200000210301 [0,1,0,0,1,0|1,0,0]=3 7997 B13R1.513 CC(=O)CCCc1ccc(cc1)Cl 1458a_100000070787_100000759440 [0,1,0,0,1,0|1,0,0]=3 7998 B13R1.513 CC(=O)CCCc1ccc(cc1)Cl 1458a_100000741339_200000210301 [0,1,0,0,1,0|1,0,0]=3 7999 B13R1.513 CC(=O)CCCc1ccc(cc1)F 1458a_100000070787_200011713563 [0,1,0,0,1,0|1,0,0]=3 8000 B13R1.513 CC(=O)CCCc1ccc(cc1)F 1458a_100011219804_200000210301 [0,1,0,0,1,0|1,0,0]=3 8001 B13R1.513 CC(=O)CCCc1ccc(cc1)I 1458a_100011236544_200000210301 [0,1,0,0,1,0|1,0,0]=3 8002 B13R1.513 CC(=O)CCCc1ccc(cc1)O 1458a_100000116853_200000210301 [0,1,0,0,1,0|1,0,0]=3 8003 B13R1.513 CC(=O)CCOc1ccc(cc1)Br 1458a_100000070787_100000183278 [0,1,0,0,1,0|2,0,0]=4 8004 B13R1.513 CC(=O)CCOc1ccc(cc1)Br 1458a_100000738328_200000210301 [0,1,0,0,1,0|2,0,0]=4 8005 B13R1.513 CC(=O)CCOc1ccc(cc1)Br 7a_100000185759_100000053229 [0,1,0,0,1,0|2,0,0]=4 8006 B13R1.513 CC(=O)CCOc1ccc(cc1)C 1458a_100000070787_100000183172 [0,1,0,0,1,0|2,0,0]=4 8007 B13R1.513 CC(=O)CCOc1ccc(cc1)C 1458a_100000182323_200000210301 [0,1,0,0,1,0|2,0,0]=4 8008 B13R1.513 CC(=O)CCOc1ccc(cc1)C 7a_100000210336_100000053229 [0,1,0,0,1,0|2,0,0]=4 8009 B13R1.513 CC(=O)CCOc1ccc(cc1)Cl 1458a_100000070787_100000184122 [0,1,0,0,1,0|2,0,0]=4 8010 B13R1.513 CC(=O)CCOc1ccc(cc1)Cl 1458a_100000186438_200000210301 [0,1,0,0,1,0|2,0,0]=4 8011 B13R1.513 CC(=O)CCOc1ccc(cc1)Cl 7a_100000210216_100000053229 [0,1,0,0,1,0|2,0,0]=4 8012 B13R1.513 CC(=O)CCOc1ccc(cc1)F 1458a_100000070787_100000184936 [0,1,0,0,1,0|2,0,0]=4 8013 B13R1.513 CC(=O)CCOc1ccc(cc1)F 1458a_100000737396_200000210301 [0,1,0,0,1,0|2,0,0]=4 8014 B13R1.513 CC(=O)CCOc1ccc(cc1)I 7a_100000212066_100000053229 [0,1,0,0,1,0|2,0,0]=4 8015 B13R1.513 CC(=O)CCSc1ccc(cc1)Br 1458a_100000208627_200000210301 [0,1,0,0,1,0|2,0,0]=4 8016 B13R1.513 CC(=O)CCSc1ccc(cc1)Br 62a_100000053229_100000752885 [0,1,0,0,1,0|2,0,0]=4 8017 B13R1.513 CC(=O)CCSc1ccc(cc1)Br 62a_100000752885_100000053229 [0,1,0,0,1,0|2,0,0]=4 8018 B13R1.513 CC(=O)CCSc1ccc(cc1)C 1458a_100000182377_200000210301 [0,1,0,0,1,0|2,0,0]=4 8019 B13R1.513 CC(=O)CCSc1ccc(cc1)C 62a_100000053229_100000186775 [0,1,0,0,1,0|2,0,0]=4 8020 B13R1.513 CC(=O)CCSc1ccc(cc1)C 62a_100000186775_100000053229 [0,1,0,0,1,0|2,0,0]=4 8021 B13R1.513 CC(=O)CCSc1ccc(cc1)Cl 1458a_100000182369_200000210301 [0,1,0,0,1,0|2,0,0]=4 8022 B13R1.513 CC(=O)CCSc1ccc(cc1)Cl 62a_100000053229_100000755918 [0,1,0,0,1,0|2,0,0]=4 8023 B13R1.513 CC(=O)CCSc1ccc(cc1)Cl 62a_100000755918_100000053229 [0,1,0,0,1,0|2,0,0]=4 8024 B13R1.513 CC(=O)CCSc1ccc(cc1)F 1458a_100000199091_200000210301 [0,1,0,0,1,0|2,0,0]=4 8025 B13R1.513 CC(=O)CCSc1ccc(cc1)F 62a_100000053229_100000211213 [0,1,0,0,1,0|2,0,0]=4 8026 B13R1.513 CC(=O)CCSc1ccc(cc1)F 62a_100000211213_100000053229 [0,1,0,0,1,0|2,0,0]=4 8027 B13R1.513 CC(=O)CCSc1ccc(cc1)N 62a_100000053229_100000185761 [0,1,0,0,1,0|2,0,0]=4 8028 B13R1.513 CC(=O)CCSc1ccc(cc1)N 62a_100000185761_100000053229 [0,1,0,0,1,0|2,0,0]=4 8029 B13R1.513 CC(=O)CCSc1ccc(cc1)O 62a_100000053229_100000185759 [0,1,0,0,1,0|2,0,0]=4 8030 B13R1.513 CC(=O)COCc1ccc(cc1)Br 1458a_200012349173_200000210301 [0,1,0,0,1,0|2,0,0]=4 8031 B13R1.513 CC(=O)COCc1ccc(cc1)Br 34a_100000211253_100000189115 [0,1,0,0,1,0|2,0,0]=4 8032 B13R1.513 CC(=O)COCc1ccc(cc1)C 34a_100000211253_100000210814 [0,1,0,0,1,0|2,0,0]=4 8033 B13R1.513 CC(=O)COCc1ccc(cc1)Cl 34a_100000211253_100000694040 [0,1,0,0,1,0|2,0,0]=4 8034 B13R1.513 CC(=O)COCc1ccc(cc1)F 34a_100000211253_100000198546 [0,1,0,0,1,0|2,0,0]=4 8035 B13R1.513 CC(=O)COCc1ccc(cc1)I 34a_100000211253_100000189116 [0,1,0,0,1,0|2,0,0]=4 8036 B13R1.513 CC(=O)CSCc1ccc(cc1)Br 1458a_100000150267_200000210301 [0,1,0,0,1,0|2,0,0]=4 8037 B13R1.513 CC(=O)CSCc1ccc(cc1)Cl 1458a_100000150262_200000210301 [0,1,0,0,1,0|2,0,0]=4 8038 B13R1.513 CC(=O)CSCc1ccc(cc1)F 1458a_100000150272_200000210301 [0,1,0,0,1,0|2,0,0]=4 8039 B13R1.513 CC(=O)NCCc1ccc(cc1)Br 11a_100000755846_100015343762 [0,1,0,0,1,0|2,0,0]=4 8040 B13R1.513 CC(=O)NCCc1ccc(cc1)Br 1626a_100000755846_100015343762 [0,1,0,0,1,0|2,0,0]=4 8041 B13R1.513 CC(=O)NCCc1ccc(cc1)Br 240690a_100000755846_100015343762 [0,1,0,0,1,0|2,0,0]=4 8042 B13R1.513 CC(=O)NCCc1ccc(cc1)Br 527a_100000755846_100103153847 [0,1,0,0,1,0|2,0,0]=4 8043 B13R1.513 CC(=O)NCCc1ccc(cc1)C 11a_100000705350_100015343762 [0,1,0,0,1,0|2,0,0]=4 8044 B13R1.513 CC(=O)NCCc1ccc(cc1)C 1626a_100000705350_100015343762 [0,1,0,0,1,0|2,0,0]=4 8045 B13R1.513 CC(=O)NCCc1ccc(cc1)C 240690a_100000705350_100015343762 [0,1,0,0,1,0|2,0,0]=4 8046 B13R1.513 CC(=O)NCCc1ccc(cc1)C 527a_100000705350_100103153847 [0,1,0,0,1,0|2,0,0]=4 8047 B13R1.513 CC(=O)NCCc1ccc(cc1)Cl 11a_100000185265_100015343762 [0,1,0,0,1,0|2,0,0]=4 8048 B13R1.513 CC(=O)NCCc1ccc(cc1)Cl 1626a_100000185265_100015343762 [0,1,0,0,1,0|2,0,0]=4 8049 B13R1.513 CC(=O)NCCc1ccc(cc1)Cl 240690a_100000185265_100015343762 [0,1,0,0,1,0|2,0,0]=4 8050 B13R1.513 CC(=O)NCCc1ccc(cc1)Cl 527a_100000185265_100103153847 [0,1,0,0,1,0|2,0,0]=4 8051 B13R1.513 CC(=O)NCCc1ccc(cc1)F 11a_100000199005_100015343762 [0,1,0,0,1,0|2,0,0]=4 8052 B13R1.513 CC(=O)NCCc1ccc(cc1)F 1626a_100000199005_100015343762 [0,1,0,0,1,0|2,0,0]=4 8053 B13R1.513 CC(=O)NCCc1ccc(cc1)F 240690a_100000199005_100015343762 [0,1,0,0,1,0|2,0,0]=4 8054 B13R1.513 CC(=O)NCCc1ccc(cc1)F 527a_100000199005_100103153847 [0,1,0,0,1,0|2,0,0]=4 8055 B13R1.513 CC(=O)NCCc1ccc(cc1)O 240690a_100000743037_100015343762 [0,1,0,0,1,0|2,0,0]=4 8056 B13R1.513 CC(=O)NCCc1ccc(cc1)O 527a_100000743037_100103153847 [0,1,0,0,1,0|2,0,0]=4 8057 B13R1.513 CC(=O)OCCc1ccc(cc1)O 271570a_203496583355_200016374084 [0,1,0,0,1,0|2,0,0]=4 8058 B13R1.513 Cc1ccc(cc1)CCCC(=O)[13CH3] 1458a_100000741418_200025704644 [0,1,0,0,1,0|1,0,0]=3 8059 B13R1.513 Cc1ccc(cc1)CNCC(=O)N 2230a_100000174908_100000747473 [0,1,0,0,1,0|2,0,0]=4 8060 B13R1.513 Cc1ccc(cc1)CNCC(=O)N 2230a_100000711301_100000210814 [0,1,0,0,1,0|2,0,0]=4 8061 B13R1.513 Cc1ccc(cc1)CNCC(=O)N 34a_100000174908_100000187820 [0,1,0,0,1,0|2,0,0]=4 8062 B13R1.513 Cc1ccc(cc1)CNCC(=O)O 269956a_100016091260_100000210814 [0,1,0,0,1,0|1,0,0]=3 8063 B13R1.513 Cc1ccc(cc1)CNCC(=O)[O-] 34a_100000174908_100020667443 [0,1,0,0,1,0|1,0,1]=4 8064 B13R1.513 Cc1ccc(cc1)COCC(=O)N 34a_100011215236_100000187820 [0,1,0,0,1,0|2,0,0]=4 8065 B13R1.513 Cc1ccc(cc1)COCC(=O)N 7a_100011215236_100000187820 [0,1,0,0,1,0|2,0,0]=4 8066 B13R1.513 Cc1ccc(cc1)COCC(=O)[O-] 34a_100011215236_100020667443 [0,1,0,0,1,0|1,0,1]=4 8067 B13R1.513 Cc1ccc(cc1)CSCC(=O)N 62a_100000210814_100000747473 [0,1,0,0,1,0|2,0,0]=4 8068 B13R1.513 Cc1ccc(cc1)CSCC(=O)N 62a_100000747473_100000210814 [0,1,0,0,1,0|2,0,0]=4 8069 B13R1.513 Cc1ccc(cc1)CSCC(=O)[O-] 62a_100000210814_100020667443 [0,1,0,0,1,0|1,0,1]=4 8070 B13R1.513 Cc1ccc(cc1)CSCC(=O)[O-] 62a_100020667443_100000210814 [0,1,0,0,1,0|1,0,1]=4 8071 B13R1.513 Cc1ccc(cc1)NCCC(=O)N 34a_100000124888_100000731001 [0,1,0,0,1,0|2,0,0]=4 8072 B13R1.513 Cc1ccc(cc1)OCCC(=O)N 34a_100000210336_100000731001 [0,1,0,0,1,0|2,0,0]=4 8073 B13R1.513 Cc1ccc(cc1)OCCC(=O)N 7a_100000210336_100000744528 [0,1,0,0,1,0|2,0,0]=4 8074 B13R1.513 Cc1ccc(cc1)OCCC(=O)[13CH3] 1458a_100000182323_200025704644 [0,1,0,0,1,0|2,0,0]=4 8075 B13R1.513 Cc1ccc(cc1)SCCC(=O)N 62a_100000186775_100000744528 [0,1,0,0,1,0|2,0,0]=4 8076 B13R1.513 Cc1ccc(cc1)SCCC(=O)N 62a_100000744528_100000186775 [0,1,0,0,1,0|2,0,0]=4 8077 B13R1.513 Cc1ccc(cc1)SCCC(=O)[13CH3] 1458a_100000182377_200025704644 [0,1,0,0,1,0|2,0,0]=4 8078 B13R1.513 Cc1ccc(cn1)CNCC(=O)O 269956a_100016091260_100016987292 [0,1,0,0,1,0|2,0,0]=4 8079 B13R1.513 Cc1ccc(nc1)CNCC(=O)O 269956a_100016091260_100000691093 [0,1,0,0,1,0|2,0,0]=4 8080 B13R1.513 NC(=O)CCNc1ccc(cc1)Br 2230a_100000210018_100000744528 [0,1,0,0,1,0|2,0,0]=4 8081 B13R1.513 NC(=O)CCNc1ccc(cc1)Br 34a_100000210018_100000731001 [0,1,0,0,1,0|2,0,0]=4 8082 B13R1.513 NC(=O)CCNc1ccc(cc1)Cl 2230a_100000210052_100000744528 [0,1,0,0,1,0|2,0,0]=4 8083 B13R1.513 NC(=O)CCNc1ccc(cc1)Cl 34a_100000210052_100000731001 [0,1,0,0,1,0|2,0,0]=4 8084 B13R1.513 NC(=O)CCNc1ccc(cc1)F 34a_100000185862_100000731001 [0,1,0,0,1,0|2,0,0]=4 8085 B13R1.513 NC(=O)CCNc1ccc(cc1)I 34a_100000185761_100000731001 [0,1,0,0,1,0|2,0,0]=4 8086 B13R1.513 NC(=O)CCNc1ccc(cc1)O 34a_100000185829_100000731001 [0,1,0,0,1,0|2,0,0]=4 8087 B13R1.513 NC(=O)CCOc1ccc(cc1)Br 34a_100000185759_100000731001 [0,1,0,0,1,0|2,0,0]=4 8088 B13R1.513 NC(=O)CCOc1ccc(cc1)Br 7a_100000185759_100000744528 [0,1,0,0,1,0|2,0,0]=4 8089 B13R1.513 NC(=O)CCOc1ccc(cc1)Cl 34a_100000210216_100000731001 [0,1,0,0,1,0|2,0,0]=4 8090 B13R1.513 NC(=O)CCOc1ccc(cc1)Cl 7a_100000210216_100000744528 [0,1,0,0,1,0|2,0,0]=4 8091 B13R1.513 NC(=O)CCOc1ccc(cc1)F 34a_100000210339_100000731001 [0,1,0,0,1,0|2,0,0]=4 8092 B13R1.513 NC(=O)CCOc1ccc(cc1)I 34a_100000212066_100000731001 [0,1,0,0,1,0|2,0,0]=4 8093 B13R1.513 NC(=O)CCOc1ccc(cc1)I 7a_100000212066_100000744528 [0,1,0,0,1,0|2,0,0]=4 8094 B13R1.513 NC(=O)CCOc1ccc(cc1)N 34a_100000185829_100000731001 [0,1,0,0,1,0|2,0,0]=4 8095 B13R1.513 NC(=O)CCSc1ccc(cc1)Br 62a_100000744528_100000752885 [0,1,0,0,1,0|2,0,0]=4 8096 B13R1.513 NC(=O)CCSc1ccc(cc1)Br 62a_100000752885_100000744528 [0,1,0,0,1,0|2,0,0]=4 8097 B13R1.513 NC(=O)CCSc1ccc(cc1)Cl 62a_100000744528_100000755918 [0,1,0,0,1,0|2,0,0]=4 8098 B13R1.513 NC(=O)CCSc1ccc(cc1)Cl 62a_100000755918_100000744528 [0,1,0,0,1,0|2,0,0]=4 8099 B13R1.513 NC(=O)CCSc1ccc(cc1)F 62a_100000211213_100000744528 [0,1,0,0,1,0|2,0,0]=4 8100 B13R1.513 NC(=O)CCSc1ccc(cc1)F 62a_100000744528_100000211213 [0,1,0,0,1,0|2,0,0]=4 8101 B13R1.513 NC(=O)CCSc1ccc(cc1)N 62a_100000185761_100000744528 [0,1,0,0,1,0|2,0,0]=4 8102 B13R1.513 NC(=O)CCSc1ccc(cc1)N 62a_100000744528_100000185761 [0,1,0,0,1,0|2,0,0]=4 8103 B13R1.513 NC(=O)CCSc1ccc(cc1)O 62a_100000744528_100000185759 [0,1,0,0,1,0|2,0,0]=4 8104 B13R1.513 NC(=O)CNCc1ccc(cc1)Br 2230a_100000174875_100000747473 [0,1,0,0,1,0|2,0,0]=4 8105 B13R1.513 NC(=O)CNCc1ccc(cc1)Br 2230a_100000711301_100011217064 [0,1,0,0,1,0|2,0,0]=4 8106 B13R1.513 NC(=O)CNCc1ccc(cc1)Br 34a_100000174875_100000187820 [0,1,0,0,1,0|2,0,0]=4 8107 B13R1.513 NC(=O)CNCc1ccc(cc1)Cl 2230a_100000174871_100000747473 [0,1,0,0,1,0|2,0,0]=4 8108 B13R1.513 NC(=O)CNCc1ccc(cc1)Cl 2230a_100000711301_100000694040 [0,1,0,0,1,0|2,0,0]=4 8109 B13R1.513 NC(=O)CNCc1ccc(cc1)Cl 34a_100000174871_100000187820 [0,1,0,0,1,0|2,0,0]=4 8110 B13R1.513 NC(=O)CNCc1ccc(cc1)F 2230a_100000174882_100000747473 [0,1,0,0,1,0|2,0,0]=4 8111 B13R1.513 NC(=O)CNCc1ccc(cc1)F 2230a_100000711301_100000198546 [0,1,0,0,1,0|2,0,0]=4 8112 B13R1.513 NC(=O)CNCc1ccc(cc1)F 34a_100000174882_100000187820 [0,1,0,0,1,0|2,0,0]=4 8113 B13R1.513 NC(=O)CNCc1ccc(cc1)I 2230a_100000711301_100000189116 [0,1,0,0,1,0|2,0,0]=4 8114 B13R1.513 NC(=O)CNCc1ccc(cc1)I 2230a_100016989417_100000747473 [0,1,0,0,1,0|2,0,0]=4 8115 B13R1.513 NC(=O)CNCc1ccc(cc1)I 34a_100016989417_100000187820 [0,1,0,0,1,0|2,0,0]=4 8116 B13R1.513 NC(=O)CNCc1ccc(cc1)O 34a_100000185549_100000187820 [0,1,0,0,1,0|2,0,0]=4 8117 B13R1.513 NC(=O)COCc1ccc(cc1)Br 34a_100000695286_100000187820 [0,1,0,0,1,0|2,0,0]=4 8118 B13R1.513 NC(=O)COCc1ccc(cc1)Cl 34a_100000211118_100000187820 [0,1,0,0,1,0|2,0,0]=4 8119 B13R1.513 NC(=O)COCc1ccc(cc1)Cl 7a_100000211118_100000187820 [0,1,0,0,1,0|2,0,0]=4 8120 B13R1.513 NC(=O)COCc1ccc(cc1)F 34a_100000210977_100000187820 [0,1,0,0,1,0|2,0,0]=4 8121 B13R1.513 NC(=O)COCc1ccc(cc1)F 7a_100000210977_100000187820 [0,1,0,0,1,0|2,0,0]=4 8122 B13R1.513 NC(=O)COCc1ccc(cc1)I 34a_100000690907_100000187820 [0,1,0,0,1,0|2,0,0]=4 8123 B13R1.513 NC(=O)COCc1ccc(cc1)I 7a_100000690907_100000187820 [0,1,0,0,1,0|2,0,0]=4 8124 B13R1.513 NC(=O)COCc1ccc(cc1)N 34a_100011215238_100000187820 [0,1,0,0,1,0|2,0,0]=4 8125 B13R1.513 NC(=O)CSCc1ccc(cc1)Br 62a_100000189115_100000747473 [0,1,0,0,1,0|2,0,0]=4 8126 B13R1.513 NC(=O)CSCc1ccc(cc1)Br 62a_100000747473_100000189115 [0,1,0,0,1,0|2,0,0]=4 8127 B13R1.513 NC(=O)CSCc1ccc(cc1)Cl 62a_100000187161_100000747473 [0,1,0,0,1,0|2,0,0]=4 8128 B13R1.513 NC(=O)CSCc1ccc(cc1)Cl 62a_100000747473_100000187161 [0,1,0,0,1,0|2,0,0]=4 8129 B13R1.513 NC(=O)CSCc1ccc(cc1)F 62a_100000198546_100000747473 [0,1,0,0,1,0|2,0,0]=4 8130 B13R1.513 NC(=O)CSCc1ccc(cc1)F 62a_100000747473_100000187164 [0,1,0,0,1,0|2,0,0]=4 8131 B13R1.513 NC(=O)CSCc1ccc(cc1)I 62a_100000189116_100000747473 [0,1,0,0,1,0|2,0,0]=4 8132 B13R1.513 NC(=O)CSCc1ccc(cc1)I 62a_100000747473_100000189116 [0,1,0,0,1,0|2,0,0]=4 8133 B13R1.513 Nc1ccc(cc1)COCC(=O)[O-] 34a_100011215238_100020667443 [0,1,0,0,1,0|1,0,1]=4 8134 B13R1.513 O=C(O)CNCc1ccc(cc1)Br 269956a_100016091260_100011217064 [0,1,0,0,1,0|1,0,0]=3 8135 B13R1.513 O=C(O)CNCc1ccc(cc1)Cl 269956a_100016091260_100000187161 [0,1,0,0,1,0|1,0,0]=3 8136 B13R1.513 O=C(O)CNCc1ccc(cc1)F 269956a_100016091260_100000198546 [0,1,0,0,1,0|1,0,0]=3 8137 B13R1.513 O=C(O)CNCc1ccc(cc1)I 269956a_100016091260_100000189116 [0,1,0,0,1,0|1,0,0]=3 8138 B13R1.513 O=C(O)CNCc1ccc(cn1)Br 269956a_100016091260_100000702658 [0,1,0,0,1,0|2,0,0]=4 8139 B13R1.513 O=C(O)CNCc1ccc(cn1)Cl 269956a_100016091260_100012066911 [0,1,0,0,1,0|2,0,0]=4 8140 B13R1.513 O=C(O)CNCc1ccc(cn1)F 269956a_100016091260_100000703193 [0,1,0,0,1,0|2,0,0]=4 8141 B13R1.513 O=C(O)CNCc1ccc(nc1)Br 269956a_100016091260_100009831999 [0,1,0,0,1,0|2,0,0]=4 8142 B13R1.513 O=C(O)CNCc1ccc(nc1)Cl 269956a_100016091260_100000735431 [0,1,0,0,1,0|2,0,0]=4 8143 B13R1.513 O=C(O)CNCc1ccc(nc1)F 269956a_100016091260_100009820150 [0,1,0,0,1,0|2,0,0]=4 8144 B13R1.513 O=C([O-])CNCc1ccc(cc1)Br 34a_100000174875_100020667443 [0,1,0,0,1,0|1,0,1]=4 8145 B13R1.513 O=C([O-])CNCc1ccc(cc1)Cl 34a_100000174871_100020667443 [0,1,0,0,1,0|1,0,1]=4 8146 B13R1.513 O=C([O-])CNCc1ccc(cc1)F 34a_100000174882_100020667443 [0,1,0,0,1,0|1,0,1]=4 8147 B13R1.513 O=C([O-])CNCc1ccc(cc1)I 34a_100016989417_100020667443 [0,1,0,0,1,0|1,0,1]=4 8148 B13R1.513 O=C([O-])CNCc1ccc(cc1)O 34a_100000185549_100020667443 [0,1,0,0,1,0|1,0,1]=4 8149 B13R1.513 O=C([O-])COCc1ccc(cc1)Br 34a_100000695286_100020667443 [0,1,0,0,1,0|1,0,1]=4 8150 B13R1.513 O=C([O-])COCc1ccc(cc1)Cl 34a_100000211118_100020667443 [0,1,0,0,1,0|1,0,1]=4 8151 B13R1.513 O=C([O-])COCc1ccc(cc1)F 34a_100000210977_100020667443 [0,1,0,0,1,0|1,0,1]=4 8152 B13R1.513 O=C([O-])COCc1ccc(cc1)I 34a_100000690907_100020667443 [0,1,0,0,1,0|1,0,1]=4 8153 B13R1.513 O=C([O-])CSCc1ccc(cc1)Br 62a_100000189115_100020667443 [0,1,0,0,1,0|1,0,1]=4 8154 B13R1.513 O=C([O-])CSCc1ccc(cc1)Br 62a_100020667443_100000189115 [0,1,0,0,1,0|1,0,1]=4 8155 B13R1.513 O=C([O-])CSCc1ccc(cc1)Cl 62a_100000187161_100020667443 [0,1,0,0,1,0|1,0,1]=4 8156 B13R1.513 O=C([O-])CSCc1ccc(cc1)Cl 62a_100020667443_100000187161 [0,1,0,0,1,0|1,0,1]=4 8157 B13R1.513 O=C([O-])CSCc1ccc(cc1)F 62a_100000198546_100020667443 [0,1,0,0,1,0|1,0,1]=4 8158 B13R1.513 O=C([O-])CSCc1ccc(cc1)F 62a_100020667443_100000187164 [0,1,0,0,1,0|1,0,1]=4 8159 B13R1.513 O=C([O-])CSCc1ccc(cc1)I 62a_100000189116_100020667443 [0,1,0,0,1,0|1,0,1]=4 8160 B13R1.513 O=C([O-])CSCc1ccc(cc1)I 62a_100020667443_100000189116 [0,1,0,0,1,0|1,0,1]=4 8161 B13R1.513 [13CH3]C(=O)CCCc1ccc(cc1)Br 1458a_100011236545_200025704644 [0,1,0,0,1,0|1,0,0]=3 8162 B13R1.513 [13CH3]C(=O)CCCc1ccc(cc1)Cl 1458a_100000741339_200025704644 [0,1,0,0,1,0|1,0,0]=3 8163 B13R1.513 [13CH3]C(=O)CCCc1ccc(cc1)F 1458a_100011219804_200025704644 [0,1,0,0,1,0|1,0,0]=3 8164 B13R1.513 [13CH3]C(=O)CCCc1ccc(cc1)I 1458a_100011236544_200025704644 [0,1,0,0,1,0|1,0,0]=3 8165 B13R1.513 [13CH3]C(=O)CCCc1ccc(cc1)O 1458a_100000116853_200025704644 [0,1,0,0,1,0|1,0,0]=3 8166 B13R1.513 [13CH3]C(=O)CCOc1ccc(cc1)Br 1458a_100000738328_200025704644 [0,1,0,0,1,0|2,0,0]=4 8167 B13R1.513 [13CH3]C(=O)CCOc1ccc(cc1)Cl 1458a_100000186438_200025704644 [0,1,0,0,1,0|2,0,0]=4 8168 B13R1.513 [13CH3]C(=O)CCOc1ccc(cc1)F 1458a_100000737396_200025704644 [0,1,0,0,1,0|2,0,0]=4 8169 B13R1.513 [13CH3]C(=O)CCSc1ccc(cc1)Br 1458a_100000208627_200025704644 [0,1,0,0,1,0|2,0,0]=4 8170 B13R1.513 [13CH3]C(=O)CCSc1ccc(cc1)Cl 1458a_100000182369_200025704644 [0,1,0,0,1,0|2,0,0]=4 8171 B13R1.513 [13CH3]C(=O)CCSc1ccc(cc1)F 1458a_100000199091_200025704644 [0,1,0,0,1,0|2,0,0]=4 8172 B13R1.513 [13CH3]C(=O)COCc1ccc(cc1)Br 1458a_200012349173_200025704644 [0,1,0,0,1,0|2,0,0]=4 8173 B13R1.513 [13CH3]C(=O)CSCc1ccc(cc1)Br 1458a_100000150267_200025704644 [0,1,0,0,1,0|2,0,0]=4 8174 B13R1.513 [13CH3]C(=O)CSCc1ccc(cc1)Cl 1458a_100000150262_200025704644 [0,1,0,0,1,0|2,0,0]=4 8175 B13R1.513 [13CH3]C(=O)CSCc1ccc(cc1)F 1458a_100000150272_200025704644 [0,1,0,0,1,0|2,0,0]=4 8176 B13R1.342 CC(=C1C=CC=C1)CCCC(=O)[13CH3] 1458a_100009924236_200025704644 [0,1,0,0,1,0|1,0,1]=4 8177 B13R1.342 CC(=O)CCCC(=C1C=CC=C1)C 1458a_100009924236_200000210301 [0,1,0,0,1,0|1,0,1]=4 8178 B13R1.536 CCC(=O)CCCCc1cccs1 1458a_100011216592_100000210202 [0,1,0,0,1,0|2,0,0]=4 8179 B13R1.536 CNC(=O)CCCCc1cccs1 11a_106832991635_100011216592 [0,1,0,0,1,0|2,0,0]=4 8180 B13R1.536 CNC(=O)CCCCc1cccs1 1626a_100102657272_100011216592 [0,1,0,0,1,0|2,0,0]=4 8181 B13R1.536 CNC(=O)CCCCc1cccs1 240690a_100102657272_100011216592 [0,1,0,0,1,0|2,0,0]=4 8182 B13R1.536 CNC(=O)CCCCc1cccs1 527a_100102657272_100011216592 [0,1,0,0,1,0|2,0,0]=4 8183 B13R1.536 COC(=O)CCCOc1ccsc1 34a_100000106738_100000742333 [0,1,0,0,1,0|2,0,0]=4 8184 B13R1.536 COC(=O)CCCOc1ccsc1 7a_100000106738_100011218270 [0,1,0,0,1,0|2,0,0]=4 8185 B13R1.536 COC(=O)CCCSc1ccco1 62a_100009814098_100011218270 [0,1,0,0,1,0|2,0,0]=4 8186 B13R1.536 COC(=O)CCCSc1ccco1 62a_100011218270_100009814098 [0,1,0,0,1,0|2,0,0]=4 8187 B13R1.536 COC(=O)CCCSc1cccs1 62a_100011215356_100011218270 [0,1,0,0,1,0|2,0,0]=4 8188 B13R1.536 COC(=O)CCCSc1cccs1 62a_100011218270_100011215356 [0,1,0,0,1,0|2,0,0]=4 8189 B13R1.536 COC(=O)CCCSc1ccoc1 62a_100011215275_100011218270 [0,1,0,0,1,0|2,0,0]=4 8190 B13R1.536 COC(=O)CCCSc1ccoc1 62a_100011218270_100011215275 [0,1,0,0,1,0|2,0,0]=4 8191 B13R1.536 COC(=O)CCCSc1ccsc1 62a_100000738268_100011218270 [0,1,0,0,1,0|2,0,0]=4 8192 B13R1.536 COC(=O)CCCSc1ccsc1 62a_100011218270_100000738268 [0,1,0,0,1,0|2,0,0]=4 8193 B13R1.536 COC(=O)CCNCc1ccco1 2230a_100000185738_100000204255 [0,1,0,0,1,0|2,0,0]=4 8194 B13R1.536 COC(=O)CCNCc1ccco1 34a_100000185738_100000742370 [0,1,0,0,1,0|2,0,0]=4 8195 B13R1.536 COC(=O)CCNCc1cccs1 2230a_100000211653_100000204255 [0,1,0,0,1,0|2,0,0]=4 8196 B13R1.536 COC(=O)CCNCc1ccoc1 2230a_100015206860_100000204255 [0,1,0,0,1,0|2,0,0]=4 8197 B13R1.536 COC(=O)CCNCc1ccoc1 34a_100015206860_100000742370 [0,1,0,0,1,0|2,0,0]=4 8198 B13R1.536 COC(=O)CCNCc1ccsc1 2230a_100000186416_100000204255 [0,1,0,0,1,0|2,0,0]=4 8199 B13R1.536 COC(=O)CCNCc1ccsc1 34a_100000186416_100000742370 [0,1,0,0,1,0|2,0,0]=4 8200 B13R1.536 COC(=O)CCOCc1ccco1 34a_100000210059_100000742370 [0,1,0,0,1,0|2,0,0]=4 8201 B13R1.536 COC(=O)CCOCc1cccs1 34a_100000211240_100000742370 [0,1,0,0,1,0|2,0,0]=4 8202 B13R1.536 COC(=O)CCOCc1ccoc1 34a_100011215357_100000742370 [0,1,0,0,1,0|2,0,0]=4 8203 B13R1.536 COC(=O)CCOCc1ccsc1 34a_100011215551_100000742370 [0,1,0,0,1,0|2,0,0]=4 8204 B13R1.536 COC(=O)CCSCc1ccsc1 62a_100000204255_100011233845 [0,1,0,0,1,0|2,0,0]=4 8205 B13R1.536 COC(=O)CCSCc1ccsc1 62a_100011261437_100000204255 [0,1,0,0,1,0|2,0,0]=4 8206 B13R1.536 COC(=O)CNCCc1ccco1 2230a_100000694680_100000747449 [0,1,0,0,1,0|2,0,0]=4 8207 B13R1.536 COC(=O)CNCCc1ccco1 34a_100000694680_100000747449 [0,1,0,0,1,0|2,0,0]=4 8208 B13R1.536 COC(=O)CNCCc1cccs1 2230a_100000203755_100000747449 [0,1,0,0,1,0|2,0,0]=4 8209 B13R1.536 COC(=O)CNCCc1cccs1 34a_100000203755_100000747449 [0,1,0,0,1,0|2,0,0]=4 8210 B13R1.536 COC(=O)CNCCc1ccsc1 2230a_100000692642_100000747449 [0,1,0,0,1,0|2,0,0]=4 8211 B13R1.536 COC(=O)CNCCc1ccsc1 34a_100000692642_100000747449 [0,1,0,0,1,0|2,0,0]=4 8212 B13R1.536 COC(=O)CNCCn1cccc1 34a_100011368172_100000747449 [0,1,0,0,1,0|2,0,0]=4 8213 B13R1.536 COC(=O)COCCc1cccs1 34a_100011216825_100000747449 [0,1,0,0,1,0|2,0,0]=4 8214 B13R1.536 COC(=O)COCCc1cccs1 7a_100011216825_100000747449 [0,1,0,0,1,0|2,0,0]=4 8215 B13R1.536 COC(=O)COCCc1ccsc1 34a_100000748821_100000747449 [0,1,0,0,1,0|2,0,0]=4 8216 B13R1.536 COC(=O)COCCn1cccc1 34a_100000179382_100000747449 [0,1,0,0,1,0|2,0,0]=4 8217 B13R1.536 COC(=O)CSCCc1cccs1 62a_100000747449_100000748579 [0,1,0,0,1,0|2,0,0]=4 8218 B13R1.536 COC(=O)CSCCc1cccs1 62a_100000748579_100000747449 [0,1,0,0,1,0|2,0,0]=4 8219 B13R1.536 COC(=O)CSCCn1cccc1 62a_100000747449_200000035178 [0,1,0,0,1,0|2,0,0]=4 8220 B13R1.536 COC(=O)CSCCn1cccc1 62a_200009811947_100000747449 [0,1,0,0,1,0|2,0,0]=4 8221 B13R1.536 O=C(CF)CCCCc1cccs1 1458a_100011216592_100015361967 [0,1,0,0,1,0|2,0,0]=4 8222 B13R1.593 CN(CCc1cccs1)CC(=O)O 269956a_100000746989_100000748579 [0,1,0,0,1,0|2,0,0]=4 8223 B13R1.593 CN(CCn1cccc1)CC(=O)O 269956a_100000746989_200000035178 [0,1,0,0,1,0|2,0,0]=4 8224 B13R1.1110 CC(CNCc1ccsc1)C(=O)O 269956a_100000749485_100011261437 [0,1,0,0,1,0|2,0,0]=4 8225 B13R1.1110 C[C@H](NCCc1cccs1)C(=O)O 269956a_100000743915_100000748579 [0,1,0,0,1,0|2,0,0]=4 8226 B13R1.1110 C[C@H](NCCn1cccc1)C(=O)O 269956a_100000743915_200000035178 [0,1,0,0,1,0|2,0,0]=4 8227 B13R1.1110 O=C(O)C(F)CNCc1ccsc1 269956a_100000084737_100011261437 [0,1,0,0,1,0|2,0,0]=4 8228 B15R1.119 C=C(Br)CCOCCc1cccc(c1)Br 34a_100009813270_100011740638 [0,1,0,0,0,1|2,0,0]=4 8229 B15R1.119 C=C(Br)CCOCCc1cccc(c1)C 34a_100009813270_100011713685 [0,1,0,0,0,1|2,0,0]=4 8230 B15R1.119 C=C(Br)CCOCCc1cccc(c1)Cl 34a_100009813270_100011713710 [0,1,0,0,0,1|2,0,0]=4 8231 B15R1.119 C=C(Br)CCOCCc1cccc(c1)F 34a_100009813270_100011217235 [0,1,0,0,0,1|2,0,0]=4 8232 B15R1.119 C=C(C)CCNCCc1cccc(c1)Br 2230a_100011207229_100000730704 [0,1,0,0,0,1|2,0,0]=4 8233 B15R1.119 C=C(C)CCNCCc1cccc(c1)Br 34a_100011207229_100000730704 [0,1,0,0,0,1|2,0,0]=4 8234 B15R1.119 C=C(C)CCNCCc1cccc(c1)C 2230a_100000749837_100000730704 [0,1,0,0,0,1|2,0,0]=4 8235 B15R1.119 C=C(C)CCNCCc1cccc(c1)C 34a_100000749837_100000730704 [0,1,0,0,0,1|2,0,0]=4 8236 B15R1.119 C=C(C)CCNCCc1cccc(c1)Cl 2230a_100000185263_100000730704 [0,1,0,0,0,1|2,0,0]=4 8237 B15R1.119 C=C(C)CCNCCc1cccc(c1)Cl 34a_100000185263_100000730704 [0,1,0,0,0,1|2,0,0]=4 8238 B15R1.119 C=C(C)CCNCCc1cccc(c1)F 2230a_100000205154_100000730704 [0,1,0,0,0,1|2,0,0]=4 8239 B15R1.119 C=C(C)CCNCCc1cccc(c1)F 34a_100000205154_100000730704 [0,1,0,0,0,1|2,0,0]=4 8240 B15R1.119 C=C(C)CCNCCc1cccc(c1)O 2230a_100000747277_100000730704 [0,1,0,0,0,1|2,0,0]=4 8241 B15R1.119 C=C(C)CCNCCc1cccc(c1)O 34a_100000747277_100000730704 [0,1,0,0,0,1|2,0,0]=4 8242 B15R1.119 C=C(C)CCOCCc1cccc(c1)Br 34a_100000764851_100011740638 [0,1,0,0,0,1|2,0,0]=4 8243 B15R1.119 C=C(C)CCOCCc1cccc(c1)Br 34a_100011217444_100000730704 [0,1,0,0,0,1|2,0,0]=4 8244 B15R1.119 C=C(C)CCOCCc1cccc(c1)Br 7a_100011217444_100000730704 [0,1,0,0,0,1|2,0,0]=4 8245 B15R1.119 C=C(C)CCOCCc1cccc(c1)C 34a_100000764851_100011713685 [0,1,0,0,0,1|2,0,0]=4 8246 B15R1.119 C=C(C)CCOCCc1cccc(c1)C 34a_100011217157_100000730704 [0,1,0,0,0,1|2,0,0]=4 8247 B15R1.119 C=C(C)CCOCCc1cccc(c1)C 7a_100011217157_100000730704 [0,1,0,0,0,1|2,0,0]=4 8248 B15R1.119 C=C(C)CCOCCc1cccc(c1)Cl 34a_100000754733_100000730704 [0,1,0,0,0,1|2,0,0]=4 8249 B15R1.119 C=C(C)CCOCCc1cccc(c1)Cl 34a_100000764851_100011713710 [0,1,0,0,0,1|2,0,0]=4 8250 B15R1.119 C=C(C)CCOCCc1cccc(c1)Cl 7a_100000754733_100000730704 [0,1,0,0,0,1|2,0,0]=4 8251 B15R1.119 C=C(C)CCOCCc1cccc(c1)F 34a_100000763591_100000730704 [0,1,0,0,0,1|2,0,0]=4 8252 B15R1.119 C=C(C)CCOCCc1cccc(c1)F 34a_100000764851_100011217235 [0,1,0,0,0,1|2,0,0]=4 8253 B15R1.119 C=C(C)CCOCCc1cccc(c1)F 7a_100000763591_100000730704 [0,1,0,0,0,1|2,0,0]=4 8254 B15R1.119 C=C(C)CCOCCc1cccc(c1)N 34a_100011996697_100000730704 [0,1,0,0,0,1|2,0,0]=4 8255 B15R1.119 C=C(C)CCSCCc1cccc(c1)Br 62a_100000730704_100011740638 [0,1,0,0,0,1|2,0,0]=4 8256 B15R1.119 C=C(C)CCSCCc1cccc(c1)Br 62a_100011740638_100000730704 [0,1,0,0,0,1|2,0,0]=4 8257 B15R1.119 C=C(C)CCSCCc1cccc(c1)C 62a_100000730704_100011713685 [0,1,0,0,0,1|2,0,0]=4 8258 B15R1.119 C=C(C)CCSCCc1cccc(c1)C 62a_100011713685_100000730704 [0,1,0,0,0,1|2,0,0]=4 8259 B15R1.119 C=C(C)CCSCCc1cccc(c1)Cl 62a_100000730704_100011713710 [0,1,0,0,0,1|2,0,0]=4 8260 B15R1.119 C=C(C)CCSCCc1cccc(c1)Cl 62a_100011713710_100000730704 [0,1,0,0,0,1|2,0,0]=4 8261 B15R1.119 C=C(C)CCSCCc1cccc(c1)F 62a_100000730704_100011217235 [0,1,0,0,0,1|2,0,0]=4 8262 B15R1.119 C=C(C)CCSCCc1cccc(c1)F 62a_100011217235_100000730704 [0,1,0,0,0,1|2,0,0]=4 8263 B15R1.119 C=C(C)CNCCCc1cccc(c1)Br 2230a_100000753791_100000748629 [0,1,0,0,0,1|2,0,0]=4 8264 B15R1.119 C=C(C)CNCCCc1cccc(c1)Br 34a_100000753791_100000748629 [0,1,0,0,0,1|2,0,0]=4 8265 B15R1.119 C=C(C)CNCCCc1cccc(c1)C 2230a_103496528808_100000748629 [0,1,0,0,0,1|2,0,0]=4 8266 B15R1.119 C=C(C)CNCCCc1cccc(c1)C 34a_103496528808_100000748629 [0,1,0,0,0,1|2,0,0]=4 8267 B15R1.119 C=C(C)CNCCCc1cccc(c1)Cl 2230a_100000704586_100000748629 [0,1,0,0,0,1|2,0,0]=4 8268 B15R1.119 C=C(C)CNCCCc1cccc(c1)Cl 34a_100000704586_100000748629 [0,1,0,0,0,1|2,0,0]=4 8269 B15R1.119 C=C(C)CNCCCc1cccc(c1)F 2230a_100000754185_100000748629 [0,1,0,0,0,1|2,0,0]=4 8270 B15R1.119 C=C(C)CNCCCc1cccc(c1)F 34a_100000754185_100000748629 [0,1,0,0,0,1|2,0,0]=4 8271 B15R1.119 C=C(C)COCCCc1cccc(c1)Br 34a_100000210245_100011713683 [0,1,0,0,0,1|2,0,0]=4 8272 B15R1.119 C=C(C)COCCCc1cccc(c1)Br 34a_100011709248_100000748629 [0,1,0,0,0,1|2,0,0]=4 8273 B15R1.119 C=C(C)COCCCc1cccc(c1)Br 7a_100011709248_100000748629 [0,1,0,0,0,1|2,0,0]=4 8274 B15R1.119 C=C(C)COCCCc1cccc(c1)Cl 34a_100011709246_100000748629 [0,1,0,0,0,1|2,0,0]=4 8275 B15R1.119 C=C(C)COCCCc1cccc(c1)Cl 7a_100011709246_100000748629 [0,1,0,0,0,1|2,0,0]=4 8276 B15R1.119 C=C(C)COCCCc1cccc(c1)F 34a_100000210245_200000698031 [0,1,0,0,0,1|2,0,0]=4 8277 B15R1.119 C=C(C)COCCCc1cccc(c1)N 34a_200000698965_100000748629 [0,1,0,0,0,1|2,0,0]=4 8278 B15R1.119 C=C(C)COCCCc1cccc(c1)N 7a_200000698965_100000748629 [0,1,0,0,0,1|2,0,0]=4 8279 B15R1.119 C=C(C)CSCCCc1cccc(c1)Br 62a_100000748629_100011713683 [0,1,0,0,0,1|2,0,0]=4 8280 B15R1.119 C=C(C)CSCCCc1cccc(c1)Br 62a_100011713683_100000211660 [0,1,0,0,0,1|2,0,0]=4 8281 B15R1.119 C=C(C)CSCCCc1cccc(c1)F 62a_100000748629_200000698031 [0,1,0,0,0,1|2,0,0]=4 8282 B15R1.119 C=C(C)CSCCCc1cccc(c1)F 62a_200000698031_100000211660 [0,1,0,0,0,1|2,0,0]=4 8283 B15R1.119 C=C(F)CNCCCc1cccc(c1)Br 2230a_100000753791_100009893438 [0,1,0,0,0,1|2,0,0]=4 8284 B15R1.119 C=C(F)CNCCCc1cccc(c1)Br 34a_100000753791_100009893438 [0,1,0,0,0,1|2,0,0]=4 8285 B15R1.119 C=C(F)CNCCCc1cccc(c1)C 2230a_103496528808_100009893438 [0,1,0,0,0,1|2,0,0]=4 8286 B15R1.119 C=C(F)CNCCCc1cccc(c1)C 34a_103496528808_100009893438 [0,1,0,0,0,1|2,0,0]=4 8287 B15R1.119 C=C(F)CNCCCc1cccc(c1)Cl 2230a_100000704586_100009893438 [0,1,0,0,0,1|2,0,0]=4 8288 B15R1.119 C=C(F)CNCCCc1cccc(c1)Cl 34a_100000704586_100009893438 [0,1,0,0,0,1|2,0,0]=4 8289 B15R1.119 C=C(F)CNCCCc1cccc(c1)F 2230a_100000754185_100009893438 [0,1,0,0,0,1|2,0,0]=4 8290 B15R1.119 C=C(F)CNCCCc1cccc(c1)F 34a_100000754185_100009893438 [0,1,0,0,0,1|2,0,0]=4 8291 B15R1.119 C=C(F)COCCCc1cccc(c1)Br 34a_100011709248_100009893438 [0,1,0,0,0,1|2,0,0]=4 8292 B15R1.119 C=C(F)COCCCc1cccc(c1)Br 34a_200010262243_100011713683 [0,1,0,0,0,1|2,0,0]=4 8293 B15R1.119 C=C(F)COCCCc1cccc(c1)Br 7a_100011709248_100000042424 [0,1,0,0,0,1|2,0,0]=4 8294 B15R1.119 C=C(F)COCCCc1cccc(c1)Cl 34a_100011709246_100009893438 [0,1,0,0,0,1|2,0,0]=4 8295 B15R1.119 C=C(F)COCCCc1cccc(c1)Cl 7a_100011709246_100000042424 [0,1,0,0,0,1|2,0,0]=4 8296 B15R1.119 C=C(F)COCCCc1cccc(c1)F 34a_200010262243_200000698031 [0,1,0,0,0,1|2,0,0]=4 8297 B15R1.119 C=C(F)COCCCc1cccc(c1)N 34a_200000698965_100009893438 [0,1,0,0,0,1|2,0,0]=4 8298 B15R1.119 C=C(F)COCCCc1cccc(c1)N 7a_200000698965_100000042424 [0,1,0,0,0,1|2,0,0]=4 8299 B15R1.119 C=C(F)CSCCCc1cccc(c1)Br 62a_100000042424_100011713683 [0,1,0,0,0,1|2,0,0]=4 8300 B15R1.119 C=C(F)CSCCCc1cccc(c1)Br 62a_100011713683_100000042424 [0,1,0,0,0,1|2,0,0]=4 8301 B15R1.119 C=C(F)CSCCCc1cccc(c1)F 62a_100000042424_200000698031 [0,1,0,0,0,1|2,0,0]=4 8302 B15R1.119 C=C(F)CSCCCc1cccc(c1)F 62a_200000698031_100000042424 [0,1,0,0,0,1|2,0,0]=4 8303 B15R1.119 CC(=O)CCCCNc1cccc(c1)Br 34a_100000210019_100009817362 [0,1,0,0,0,1|1,0,0]=3 8304 B15R1.119 CC(=O)CCCCNc1cccc(c1)C 34a_100000188690_100009817362 [0,1,0,0,0,1|1,0,0]=3 8305 B15R1.119 CC(=O)CCCCNc1cccc(c1)Cl 34a_100000185859_100009817362 [0,1,0,0,0,1|1,0,0]=3 8306 B15R1.119 CC(=O)CCCCNc1cccc(c1)F 34a_100000210047_100009817362 [0,1,0,0,0,1|1,0,0]=3 8307 B15R1.119 CC(=O)CCCCNc1cccc(c1)I 34a_100000211102_100009817362 [0,1,0,0,0,1|1,0,0]=3 8308 B15R1.119 CC(=O)CCCCNc1cccc(c1)O 34a_100000210217_100009817362 [0,1,0,0,0,1|1,0,0]=3 8309 B15R1.119 CC(=O)CCCCOc1cc[nH]c(=O)c1 34a_100000032262_100009817362 [0,1,0,0,0,1|2,0,0]=4 8310 B15R1.119 CC(=O)CCCCOc1ccc[n+](c1)[O-] 34a_100000039713_100009817362 [0,1,0,0,0,1|2,0,0]=4 8311 B15R1.119 CC(=O)CCCCOc1ccc[n+](c1)[O-] 7a_100000039713_100000735457 [0,1,0,0,0,1|2,0,0]=4 8312 B15R1.119 CC(=O)CCCCOc1cccc(=O)[nH]1 34a_100000033347_100009817362 [0,1,0,0,0,1|2,0,0]=4 8313 B15R1.119 CC(=O)CCCCOc1cccc(c1)Br 34a_100000210342_100009817362 [0,1,0,0,0,1|1,0,0]=3 8314 B15R1.119 CC(=O)CCCCOc1cccc(c1)Br 7a_100000210342_100000735457 [0,1,0,0,0,1|1,0,0]=3 8315 B15R1.119 CC(=O)CCCCOc1cccc(c1)C 1458a_100000745151_200000210301 [0,1,0,0,0,1|1,0,0]=3 8316 B15R1.119 CC(=O)CCCCOc1cccc(c1)C 34a_100000210337_100009817362 [0,1,0,0,0,1|1,0,0]=3 8317 B15R1.119 CC(=O)CCCCOc1cccc(c1)C 7a_100000210337_100000735457 [0,1,0,0,0,1|1,0,0]=3 8318 B15R1.119 CC(=O)CCCCOc1cccc(c1)Cl 34a_100000210295_100009817362 [0,1,0,0,0,1|1,0,0]=3 8319 B15R1.119 CC(=O)CCCCOc1cccc(c1)Cl 7a_100000210295_100000735457 [0,1,0,0,0,1|1,0,0]=3 8320 B15R1.119 CC(=O)CCCCOc1cccc(c1)F 34a_100000210426_100009817362 [0,1,0,0,0,1|1,0,0]=3 8321 B15R1.119 CC(=O)CCCCOc1cccc(c1)F 7a_100000210426_100000735457 [0,1,0,0,0,1|1,0,0]=3 8322 B15R1.119 CC(=O)CCCCOc1cccc(c1)I 34a_100000211634_100009817362 [0,1,0,0,0,1|1,0,0]=3 8323 B15R1.119 CC(=O)CCCCOc1cccc(c1)I 7a_100000211634_100000735457 [0,1,0,0,0,1|1,0,0]=3 8324 B15R1.119 CC(=O)CCCCOc1cccc(c1)N 34a_100000210217_100009817362 [0,1,0,0,0,1|1,0,0]=3 8325 B15R1.119 CC(=O)CCCCOc1cccc(n1)F 34a_100011432558_100009817362 [0,1,0,0,0,1|2,0,0]=4 8326 B15R1.119 CC(=O)CCCCOc1ccnc(c1)C 34a_100000688365_100009817362 [0,1,0,0,0,1|2,0,0]=4 8327 B15R1.119 CC(=O)CCCCOc1ccnc(c1)Cl 34a_100000762945_100009817362 [0,1,0,0,0,1|2,0,0]=4 8328 B15R1.119 CC(=O)CCCCOc1ccnc(c1)F 34a_100000732698_100009817362 [0,1,0,0,0,1|2,0,0]=4 8329 B15R1.119 CC(=O)CCCCOc1ccnc(c1)N 34a_100011834064_100009817362 [0,1,0,0,0,1|2,0,0]=4 8330 B15R1.119 CC(=O)CCCCOc1cncc(c1)Br 34a_100000754920_100009817362 [0,1,0,0,0,1|2,0,0]=4 8331 B15R1.119 CC(=O)CCCCOc1cncc(c1)Br 7a_100000754920_100000735457 [0,1,0,0,0,1|2,0,0]=4 8332 B15R1.119 CC(=O)CCCCOc1cncc(c1)C 34a_100011830280_100009817362 [0,1,0,0,0,1|2,0,0]=4 8333 B15R1.119 CC(=O)CCCCOc1cncc(c1)C 7a_100011830280_100000735457 [0,1,0,0,0,1|2,0,0]=4 8334 B15R1.119 CC(=O)CCCCOc1cncc(c1)Cl 7a_100000032511_100000735457 [0,1,0,0,0,1|2,0,0]=4 8335 B15R1.119 CC(=O)CCCCOc1cncc(c1)F 34a_100011830296_100009817362 [0,1,0,0,0,1|2,0,0]=4 8336 B15R1.119 CC(=O)CCCCOc1cncc(c1)F 7a_100011830296_100000735457 [0,1,0,0,0,1|2,0,0]=4 8337 B15R1.119 CC(=O)CCCCOc1cncc(c1)N 34a_100011997051_100009817362 [0,1,0,0,0,1|2,0,0]=4 8338 B15R1.119 CC(=O)CCCCSc1cc(=O)cc[nH]1 62a_100009817434_100000735457 [0,1,0,0,0,1|2,0,0]=4 8339 B15R1.119 CC(=O)CCCCSc1cc(ccn1)C 62a_100000735457_100000750283 [0,1,0,0,0,1|2,0,0]=4 8340 B15R1.119 CC(=O)CCCCSc1cc(ccn1)C 62a_100000750283_100000735457 [0,1,0,0,0,1|2,0,0]=4 8341 B15R1.119 CC(=O)CCCCSc1cc(ccn1)Cl 62a_100000735457_100010167805 [0,1,0,0,0,1|2,0,0]=4 8342 B15R1.119 CC(=O)CCCCSc1cc(ccn1)Cl 62a_100010167805_100000735457 [0,1,0,0,0,1|2,0,0]=4 8343 B15R1.119 CC(=O)CCCCSc1cc(ccn1)F 62a_100000735457_100000764206 [0,1,0,0,0,1|2,0,0]=4 8344 B15R1.119 CC(=O)CCCCSc1cc(ccn1)F 62a_100000764206_100000735457 [0,1,0,0,0,1|2,0,0]=4 8345 B15R1.119 CC(=O)CCCCSc1cc(ccn1)N 62a_100000735457_100009814236 [0,1,0,0,0,1|2,0,0]=4 8346 B15R1.119 CC(=O)CCCCSc1cc(ccn1)N 62a_100009814236_100000735457 [0,1,0,0,0,1|2,0,0]=4 8347 B15R1.119 CC(=O)CCCCSc1cc(ccn1)O 62a_100000735457_100000762945 [0,1,0,0,0,1|2,0,0]=4 8348 B15R1.119 CC(=O)CCCCSc1cc[nH]c(=O)c1 62a_100000735457_100009816521 [0,1,0,0,0,1|2,0,0]=4 8349 B15R1.119 CC(=O)CCCCSc1cc[nH]c(=O)c1 62a_100009816521_100000735457 [0,1,0,0,0,1|2,0,0]=4 8350 B15R1.119 CC(=O)CCCCSc1ccc[n+](c1)C 62a_100000735457_100009996589 [0,1,0,0,0,1|2,0,0]=4 8351 B15R1.119 CC(=O)CCCCSc1ccc[n+](c1)C 62a_100009996589_100000735457 [0,1,0,0,0,1|2,0,0]=4 8352 B15R1.119 CC(=O)CCCCSc1ccc[n+](c1)[O-] 62a_100000735457_100009815978 [0,1,0,0,0,1|2,0,0]=4 8353 B15R1.119 CC(=O)CCCCSc1cccc(=O)[nH]1 62a_100000735457_100000752884 [0,1,0,0,0,1|2,0,0]=4 8354 B15R1.119 CC(=O)CCCCSc1cccc(c1)Br 62a_100000691529_100000735457 [0,1,0,0,0,1|1,0,0]=3 8355 B15R1.119 CC(=O)CCCCSc1cccc(c1)Br 62a_100000735457_100000691529 [0,1,0,0,0,1|1,0,0]=3 8356 B15R1.119 CC(=O)CCCCSc1cccc(c1)C 62a_100000735457_100011215228 [0,1,0,0,0,1|1,0,0]=3 8357 B15R1.119 CC(=O)CCCCSc1cccc(c1)C 62a_100011215228_100000735457 [0,1,0,0,0,1|1,0,0]=3 8358 B15R1.119 CC(=O)CCCCSc1cccc(c1)Cl 62a_100000699651_100000735457 [0,1,0,0,0,1|1,0,0]=3 8359 B15R1.119 CC(=O)CCCCSc1cccc(c1)Cl 62a_100000735457_100000699651 [0,1,0,0,0,1|1,0,0]=3 8360 B15R1.119 CC(=O)CCCCSc1cccc(c1)F 62a_100000685547_100000735457 [0,1,0,0,0,1|1,0,0]=3 8361 B15R1.119 CC(=O)CCCCSc1cccc(c1)F 62a_100000735457_100000685547 [0,1,0,0,0,1|1,0,0]=3 8362 B15R1.119 CC(=O)CCCCSc1cccc(c1)N 62a_100000210019_100000735457 [0,1,0,0,0,1|1,0,0]=3 8363 B15R1.119 CC(=O)CCCCSc1cccc(c1)N 62a_100000735457_100000210019 [0,1,0,0,0,1|1,0,0]=3 8364 B15R1.119 CC(=O)CCCCSc1cccc(c1)O 62a_100000735457_100000211634 [0,1,0,0,0,1|1,0,0]=3 8365 B15R1.119 CC(=O)CCCCSc1cccc(c1)[S] 62a_100000735457_114929384022 [0,1,0,0,0,1|1,0,0]=3 8366 B15R1.119 CC(=O)CCCCSc1cccc(c1)[S] 62a_114929384022_100000735457 [0,1,0,0,0,1|1,0,0]=3 8367 B15R1.119 CC(=O)CCCCSc1cccc(n1)Br 62a_100000684672_100000735457 [0,1,0,0,0,1|2,0,0]=4 8368 B15R1.119 CC(=O)CCCCSc1cccc(n1)Br 62a_100000735457_100000684672 [0,1,0,0,0,1|2,0,0]=4 8369 B15R1.119 CC(=O)CCCCSc1cccc(n1)C 62a_100000735457_100000742759 [0,1,0,0,0,1|2,0,0]=4 8370 B15R1.119 CC(=O)CCCCSc1cccc(n1)C 62a_100000742759_100000735457 [0,1,0,0,0,1|2,0,0]=4 8371 B15R1.119 CC(=O)CCCCSc1cccc(n1)Cl 62a_100000051397_100000735457 [0,1,0,0,0,1|2,0,0]=4 8372 B15R1.119 CC(=O)CCCCSc1cccc(n1)Cl 62a_100000735457_100000051397 [0,1,0,0,0,1|2,0,0]=4 8373 B15R1.119 CC(=O)CCCCSc1cccc(n1)F 62a_100000735457_100009815982 [0,1,0,0,0,1|2,0,0]=4 8374 B15R1.119 CC(=O)CCCCSc1cccc(n1)F 62a_100009815982_100000735457 [0,1,0,0,0,1|2,0,0]=4 8375 B15R1.119 CC(=O)CCCCSc1cccc(n1)N 62a_100000735457_100000740741 [0,1,0,0,0,1|2,0,0]=4 8376 B15R1.119 CC(=O)CCCCSc1cccc(n1)N 62a_100000740741_100000735457 [0,1,0,0,0,1|2,0,0]=4 8377 B15R1.119 CC(=O)CCCCSc1ccnc(c1)Br 62a_100000735457_100009814637 [0,1,0,0,0,1|2,0,0]=4 8378 B15R1.119 CC(=O)CCCCSc1ccnc(c1)Br 62a_100009814637_100000735457 [0,1,0,0,0,1|2,0,0]=4 8379 B15R1.119 CC(=O)CCCCSc1ccnc(c1)C 62a_100000735457_100000758586 [0,1,0,0,0,1|2,0,0]=4 8380 B15R1.119 CC(=O)CCCCSc1ccnc(c1)C 62a_100000758586_100000735457 [0,1,0,0,0,1|2,0,0]=4 8381 B15R1.119 CC(=O)CCCCSc1ccnc(c1)Cl 62a_100000035001_100000735457 [0,1,0,0,0,1|2,0,0]=4 8382 B15R1.119 CC(=O)CCCCSc1ccnc(c1)Cl 62a_100000735457_100000035001 [0,1,0,0,0,1|2,0,0]=4 8383 B15R1.119 CC(=O)CCCCSc1ccnc(c1)F 62a_100000735457_100009816116 [0,1,0,0,0,1|2,0,0]=4 8384 B15R1.119 CC(=O)CCCCSc1ccnc(c1)F 62a_100009816116_100000735457 [0,1,0,0,0,1|2,0,0]=4 8385 B15R1.119 CC(=O)CCCCSc1ccnc(c1)N 62a_100000049665_100000735457 [0,1,0,0,0,1|2,0,0]=4 8386 B15R1.119 CC(=O)CCCCSc1ccnc(c1)N 62a_100000735457_100000049665 [0,1,0,0,0,1|2,0,0]=4 8387 B15R1.119 CC(=O)CCCCSc1cncc(c1)Br 62a_100000728054_100000735457 [0,1,0,0,0,1|2,0,0]=4 8388 B15R1.119 CC(=O)CCCCSc1cncc(c1)Br 62a_100000735457_100000728054 [0,1,0,0,0,1|2,0,0]=4 8389 B15R1.119 CC(=O)CCCCSc1cncc(c1)C 62a_100000735457_100000760492 [0,1,0,0,0,1|2,0,0]=4 8390 B15R1.119 CC(=O)CCCCSc1cncc(c1)C 62a_100000760492_100000735457 [0,1,0,0,0,1|2,0,0]=4 8391 B15R1.119 CC(=O)CCCCSc1cncc(c1)Cl 62a_100000049639_100000735457 [0,1,0,0,0,1|2,0,0]=4 8392 B15R1.119 CC(=O)CCCCSc1cncc(c1)Cl 62a_100000735457_100000049639 [0,1,0,0,0,1|2,0,0]=4 8393 B15R1.119 CC(=O)CCCCSc1cncc(c1)F 62a_100000735457_100000744099 [0,1,0,0,0,1|2,0,0]=4 8394 B15R1.119 CC(=O)CCCCSc1cncc(c1)F 62a_100000744099_100000735457 [0,1,0,0,0,1|2,0,0]=4 8395 B15R1.119 CC(=O)CCCCSc1cncc(c1)N 62a_100000687067_100000735457 [0,1,0,0,0,1|2,0,0]=4 8396 B15R1.119 CC(=O)CCCCSc1cncc(c1)N 62a_100000735457_100000687067 [0,1,0,0,0,1|2,0,0]=4 8397 B15R1.119 CC(=O)CCCCSc1cncc(c1)O 62a_100000735457_100000754920 [0,1,0,0,0,1|2,0,0]=4 8398 B15R1.119 CC(=O)CCCCSc1cncc(c1)O 62a_100000754920_100000735457 [0,1,0,0,0,1|2,0,0]=4 8399 B15R1.119 CC(=O)CCCNCc1cccc(c1)Br 34a_100000174977_100000685027 [0,1,0,0,0,1|1,0,0]=3 8400 B15R1.119 CC(=O)CCCNCc1cccc(c1)C 34a_100000185548_100000685027 [0,1,0,0,0,1|1,0,0]=3 8401 B15R1.119 CC(=O)CCCNCc1cccc(c1)Cl 34a_100000174878_100000685027 [0,1,0,0,0,1|1,0,0]=3 8402 B15R1.119 CC(=O)CCCNCc1cccc(c1)F 34a_100000174948_100000685027 [0,1,0,0,0,1|1,0,0]=3 8403 B15R1.119 CC(=O)CCCNCc1cccc(c1)I 34a_100000106179_100000685027 [0,1,0,0,0,1|1,0,0]=3 8404 B15R1.119 CC(=O)CCCNCc1cccc(c1)O 34a_100000743036_100000685027 [0,1,0,0,0,1|1,0,0]=3 8405 B15R1.119 CC(=O)CCCNCc1cccc(n1)C 34a_100000701342_100000685027 [0,1,0,0,0,1|2,0,0]=4 8406 B15R1.119 CC(=O)CCCNCc1cccc(n1)F 34a_100015188798_100000685027 [0,1,0,0,0,1|2,0,0]=4 8407 B15R1.119 CC(=O)CCCNCc1ccnc(c1)Br 34a_100025757509_100000685027 [0,1,0,0,0,1|2,0,0]=4 8408 B15R1.119 CC(=O)CCCNCc1ccnc(c1)C 34a_100011934566_100000685027 [0,1,0,0,0,1|2,0,0]=4 8409 B15R1.119 CC(=O)CCCNCc1ccnc(c1)Cl 34a_100015205668_100000685027 [0,1,0,0,0,1|2,0,0]=4 8410 B15R1.119 CC(=O)CCCNCc1ccnc(c1)F 34a_100015188774_100000685027 [0,1,0,0,0,1|2,0,0]=4 8411 B15R1.119 CC(=O)CCCNCc1cncc(c1)C 34a_100000692839_100000685027 [0,1,0,0,0,1|2,0,0]=4 8412 B15R1.119 CC(=O)CCCNCc1cncc(c1)F 34a_100011962886_100000685027 [0,1,0,0,0,1|2,0,0]=4 8413 B15R1.119 CC(=O)CCCOCc1cc(ccn1)Br 34a_100000759063_100010173614 [0,1,0,0,0,1|2,0,0]=4 8414 B15R1.119 CC(=O)CCCOCc1cc(ccn1)Br 7a_100000759063_100010173614 [0,1,0,0,0,1|2,0,0]=4 8415 B15R1.119 CC(=O)CCCOCc1cc(ccn1)C 34a_100000759063_100000718516 [0,1,0,0,0,1|2,0,0]=4 8416 B15R1.119 CC(=O)CCCOCc1cc(ccn1)C 34a_100011998357_100000685027 [0,1,0,0,0,1|2,0,0]=4 8417 B15R1.119 CC(=O)CCCOCc1cc(ccn1)C 7a_100000759063_100000718516 [0,1,0,0,0,1|2,0,0]=4 8418 B15R1.119 CC(=O)CCCOCc1cc(ccn1)Cl 34a_100000748867_100000685027 [0,1,0,0,0,1|2,0,0]=4 8419 B15R1.119 CC(=O)CCCOCc1cc(ccn1)Cl 34a_100000759063_100016988179 [0,1,0,0,0,1|2,0,0]=4 8420 B15R1.119 CC(=O)CCCOCc1cc(ccn1)Cl 7a_100000759063_100016988179 [0,1,0,0,0,1|2,0,0]=4 8421 B15R1.119 CC(=O)CCCOCc1cc(ccn1)N 34a_100000692640_100000685027 [0,1,0,0,0,1|2,0,0]=4 8422 B15R1.119 CC(=O)CCCOCc1ccc[n+](c1)[O-] 34a_100000037817_100000685027 [0,1,0,0,0,1|2,0,0]=4 8423 B15R1.119 CC(=O)CCCOCc1ccc[n+](c1)[O-] 7a_100000037817_100011215641 [0,1,0,0,0,1|2,0,0]=4 8424 B15R1.119 CC(=O)CCCOCc1cccc(c1)Br 34a_100000687537_100000685027 [0,1,0,0,0,1|1,0,0]=3 8425 B15R1.119 CC(=O)CCCOCc1cccc(c1)Br 34a_100000759063_100000698116 [0,1,0,0,0,1|1,0,0]=3 8426 B15R1.119 CC(=O)CCCOCc1cccc(c1)Br 7a_100000687537_100011215641 [0,1,0,0,0,1|1,0,0]=3 8427 B15R1.119 CC(=O)CCCOCc1cccc(c1)Br 7a_100000759063_100000211773 [0,1,0,0,0,1|1,0,0]=3 8428 B15R1.119 CC(=O)CCCOCc1cccc(c1)C 34a_100000759063_100000211840 [0,1,0,0,0,1|1,0,0]=3 8429 B15R1.119 CC(=O)CCCOCc1cccc(c1)C 34a_100011217746_100000685027 [0,1,0,0,0,1|1,0,0]=3 8430 B15R1.119 CC(=O)CCCOCc1cccc(c1)C 7a_100000759063_100000211840 [0,1,0,0,0,1|1,0,0]=3 8431 B15R1.119 CC(=O)CCCOCc1cccc(c1)C 7a_100011217746_100011215641 [0,1,0,0,0,1|1,0,0]=3 8432 B15R1.119 CC(=O)CCCOCc1cccc(c1)Cl 34a_100000241301_100000685027 [0,1,0,0,0,1|1,0,0]=3 8433 B15R1.119 CC(=O)CCCOCc1cccc(c1)Cl 34a_100000759063_100000187163 [0,1,0,0,0,1|1,0,0]=3 8434 B15R1.119 CC(=O)CCCOCc1cccc(c1)Cl 7a_100000241301_100011215641 [0,1,0,0,0,1|1,0,0]=3 8435 B15R1.119 CC(=O)CCCOCc1cccc(c1)Cl 7a_100000759063_100000187163 [0,1,0,0,0,1|1,0,0]=3 8436 B15R1.119 CC(=O)CCCOCc1cccc(c1)F 34a_100000210976_100000685027 [0,1,0,0,0,1|1,0,0]=3 8437 B15R1.119 CC(=O)CCCOCc1cccc(c1)F 34a_100000759063_100000187166 [0,1,0,0,0,1|1,0,0]=3 8438 B15R1.119 CC(=O)CCCOCc1cccc(c1)F 7a_100000210976_100011215641 [0,1,0,0,0,1|1,0,0]=3 8439 B15R1.119 CC(=O)CCCOCc1cccc(c1)F 7a_100000759063_100000230114 [0,1,0,0,0,1|1,0,0]=3 8440 B15R1.119 CC(=O)CCCOCc1cccc(c1)I 34a_100000759063_100011218688 [0,1,0,0,0,1|1,0,0]=3 8441 B15R1.119 CC(=O)CCCOCc1cccc(c1)I 34a_100011215336_100000685027 [0,1,0,0,0,1|1,0,0]=3 8442 B15R1.119 CC(=O)CCCOCc1cccc(c1)I 7a_100000759063_100011218688 [0,1,0,0,0,1|1,0,0]=3 8443 B15R1.119 CC(=O)CCCOCc1cccc(c1)I 7a_100011215336_100011215641 [0,1,0,0,0,1|1,0,0]=3 8444 B15R1.119 CC(=O)CCCOCc1cccc(c1)N 34a_100000211919_100000685027 [0,1,0,0,0,1|1,0,0]=3 8445 B15R1.119 CC(=O)CCCOCc1cccc(c1)O 34a_100000759063_100011660834 [0,1,0,0,0,1|1,0,0]=3 8446 B15R1.119 CC(=O)CCCOCc1cccc(c1)O 7a_100000759063_100000084143 [0,1,0,0,0,1|1,0,0]=3 8447 B15R1.119 CC(=O)CCCOCc1cccc(n1)Br 34a_100000694195_100000685027 [0,1,0,0,0,1|2,0,0]=4 8448 B15R1.119 CC(=O)CCCOCc1cccc(n1)Br 34a_100000759063_100009889011 [0,1,0,0,0,1|2,0,0]=4 8449 B15R1.119 CC(=O)CCCOCc1cccc(n1)Br 7a_100000759063_100009889011 [0,1,0,0,0,1|2,0,0]=4 8450 B15R1.119 CC(=O)CCCOCc1cccc(n1)C 34a_100000690600_100000685027 [0,1,0,0,0,1|2,0,0]=4 8451 B15R1.119 CC(=O)CCCOCc1cccc(n1)C 34a_100000759063_100000757606 [0,1,0,0,0,1|2,0,0]=4 8452 B15R1.119 CC(=O)CCCOCc1cccc(n1)C 7a_100000759063_100000757606 [0,1,0,0,0,1|2,0,0]=4 8453 B15R1.119 CC(=O)CCCOCc1cccc(n1)Cl 34a_100000759063_100000086093 [0,1,0,0,0,1|2,0,0]=4 8454 B15R1.119 CC(=O)CCCOCc1cccc(n1)Cl 34a_100011998359_100000685027 [0,1,0,0,0,1|2,0,0]=4 8455 B15R1.119 CC(=O)CCCOCc1cccc(n1)Cl 7a_100000759063_100000086093 [0,1,0,0,0,1|2,0,0]=4 8456 B15R1.119 CC(=O)CCCOCc1cccc(n1)F 34a_100000086748_100000685027 [0,1,0,0,0,1|2,0,0]=4 8457 B15R1.119 CC(=O)CCCOCc1cccc(n1)F 34a_100000759063_100009819644 [0,1,0,0,0,1|2,0,0]=4 8458 B15R1.119 CC(=O)CCCOCc1cccc(n1)F 7a_100000759063_100009819644 [0,1,0,0,0,1|2,0,0]=4 8459 B15R1.119 CC(=O)CCCOCc1ccnc(c1)Br 34a_100000759063_100010243470 [0,1,0,0,0,1|2,0,0]=4 8460 B15R1.119 CC(=O)CCCOCc1ccnc(c1)Br 34a_100009814636_100000685027 [0,1,0,0,0,1|2,0,0]=4 8461 B15R1.119 CC(=O)CCCOCc1ccnc(c1)Br 7a_100000759063_100010254460 [0,1,0,0,0,1|2,0,0]=4 8462 B15R1.119 CC(=O)CCCOCc1ccnc(c1)Br 7a_100009814636_100011215641 [0,1,0,0,0,1|2,0,0]=4 8463 B15R1.119 CC(=O)CCCOCc1ccnc(c1)C 34a_100000759063_200020672517 [0,1,0,0,0,1|2,0,0]=4 8464 B15R1.119 CC(=O)CCCOCc1ccnc(c1)C 34a_100011998630_100000685027 [0,1,0,0,0,1|2,0,0]=4 8465 B15R1.119 CC(=O)CCCOCc1ccnc(c1)C 7a_100000759063_200020672517 [0,1,0,0,0,1|2,0,0]=4 8466 B15R1.119 CC(=O)CCCOCc1ccnc(c1)Cl 34a_100000748751_100000685027 [0,1,0,0,0,1|2,0,0]=4 8467 B15R1.119 CC(=O)CCCOCc1ccnc(c1)Cl 34a_100000759063_100000764220 [0,1,0,0,0,1|2,0,0]=4 8468 B15R1.119 CC(=O)CCCOCc1ccnc(c1)Cl 7a_100000759063_100000764220 [0,1,0,0,0,1|2,0,0]=4 8469 B15R1.119 CC(=O)CCCOCc1ccnc(c1)F 34a_100000082451_100000685027 [0,1,0,0,0,1|2,0,0]=4 8470 B15R1.119 CC(=O)CCCOCc1cncc(c1)Br 34a_100000759063_100000738771 [0,1,0,0,0,1|2,0,0]=4 8471 B15R1.119 CC(=O)CCCOCc1cncc(c1)Br 34a_100011259137_100000685027 [0,1,0,0,0,1|2,0,0]=4 8472 B15R1.119 CC(=O)CCCOCc1cncc(c1)Br 7a_100000759063_100000738771 [0,1,0,0,0,1|2,0,0]=4 8473 B15R1.119 CC(=O)CCCOCc1cncc(c1)Br 7a_100011259137_100011215641 [0,1,0,0,0,1|2,0,0]=4 8474 B15R1.119 CC(=O)CCCOCc1cncc(c1)C 34a_100000759063_100000716715 [0,1,0,0,0,1|2,0,0]=4 8475 B15R1.119 CC(=O)CCCOCc1cncc(c1)C 34a_100011998709_100000685027 [0,1,0,0,0,1|2,0,0]=4 8476 B15R1.119 CC(=O)CCCOCc1cncc(c1)C 7a_100000759063_100000716715 [0,1,0,0,0,1|2,0,0]=4 8477 B15R1.119 CC(=O)CCCOCc1cncc(c1)C 7a_100011998709_100011215641 [0,1,0,0,0,1|2,0,0]=4 8478 B15R1.119 CC(=O)CCCOCc1cncc(c1)Cl 34a_100000092867_100000685027 [0,1,0,0,0,1|2,0,0]=4 8479 B15R1.119 CC(=O)CCCOCc1cncc(c1)Cl 34a_100000759063_100016992070 [0,1,0,0,0,1|2,0,0]=4 8480 B15R1.119 CC(=O)CCCOCc1cncc(c1)Cl 7a_100000092867_100011215641 [0,1,0,0,0,1|2,0,0]=4 8481 B15R1.119 CC(=O)CCCOCc1cncc(c1)Cl 7a_100000759063_100016992070 [0,1,0,0,0,1|2,0,0]=4 8482 B15R1.119 CC(=O)CCCOCc1cncc(c1)F 34a_100000759063_100000725299 [0,1,0,0,0,1|2,0,0]=4 8483 B15R1.119 CC(=O)CCCOCc1cncc(c1)F 34a_100011962875_100000685027 [0,1,0,0,0,1|2,0,0]=4 8484 B15R1.119 CC(=O)CCCOCc1cncc(c1)F 7a_100000759063_100000725299 [0,1,0,0,0,1|2,0,0]=4 8485 B15R1.119 CC(=O)CCCOCc1cncc(c1)F 7a_100011962875_100011215641 [0,1,0,0,0,1|2,0,0]=4 8486 B15R1.119 CC(=O)CCCOCc1cncc(c1)N 34a_100000085308_100000685027 [0,1,0,0,0,1|2,0,0]=4 8487 B15R1.119 CC(=O)CCCSCc1cc(ccn1)Br 62a_100010173614_100011215641 [0,1,0,0,0,1|2,0,0]=4 8488 B15R1.119 CC(=O)CCCSCc1cc(ccn1)Br 62a_100011215641_100010173614 [0,1,0,0,0,1|2,0,0]=4 8489 B15R1.119 CC(=O)CCCSCc1cc(ccn1)C 62a_100000718516_100011215641 [0,1,0,0,0,1|2,0,0]=4 8490 B15R1.119 CC(=O)CCCSCc1cc(ccn1)C 62a_100011215641_100000718516 [0,1,0,0,0,1|2,0,0]=4 8491 B15R1.119 CC(=O)CCCSCc1cc(ccn1)Cl 62a_100011215641_100016988179 [0,1,0,0,0,1|2,0,0]=4 8492 B15R1.119 CC(=O)CCCSCc1cc(ccn1)Cl 62a_100016988179_100011215641 [0,1,0,0,0,1|2,0,0]=4 8493 B15R1.119 CC(=O)CCCSCc1cccc(c1)Br 62a_100000211773_100011215641 [0,1,0,0,0,1|1,0,0]=3 8494 B15R1.119 CC(=O)CCCSCc1cccc(c1)Br 62a_100011215641_100000211773 [0,1,0,0,0,1|1,0,0]=3 8495 B15R1.119 CC(=O)CCCSCc1cccc(c1)C 62a_100000211840_100011215641 [0,1,0,0,0,1|1,0,0]=3 8496 B15R1.119 CC(=O)CCCSCc1cccc(c1)C 62a_100011215641_100000211840 [0,1,0,0,0,1|1,0,0]=3 8497 B15R1.119 CC(=O)CCCSCc1cccc(c1)Cl 62a_100000187163_100011215641 [0,1,0,0,0,1|1,0,0]=3 8498 B15R1.119 CC(=O)CCCSCc1cccc(c1)Cl 62a_100011215641_100000187163 [0,1,0,0,0,1|1,0,0]=3 8499 B15R1.119 CC(=O)CCCSCc1cccc(c1)F 62a_100000230114_100011215641 [0,1,0,0,0,1|1,0,0]=3 8500 B15R1.119 CC(=O)CCCSCc1cccc(c1)F 62a_100011215641_100000230114 [0,1,0,0,0,1|1,0,0]=3 8501 B15R1.119 CC(=O)CCCSCc1cccc(c1)I 62a_100011215641_100011218688 [0,1,0,0,0,1|1,0,0]=3 8502 B15R1.119 CC(=O)CCCSCc1cccc(c1)I 62a_100011218688_100011215641 [0,1,0,0,0,1|1,0,0]=3 8503 B15R1.119 CC(=O)CCCSCc1cccc(c1)O 62a_100011215641_100011660834 [0,1,0,0,0,1|1,0,0]=3 8504 B15R1.119 CC(=O)CCCSCc1cccc(c1)O 62a_100011660834_100011215641 [0,1,0,0,0,1|1,0,0]=3 8505 B15R1.119 CC(=O)CCCSCc1cccc(n1)Br 62a_100009889011_100011215641 [0,1,0,0,0,1|2,0,0]=4 8506 B15R1.119 CC(=O)CCCSCc1cccc(n1)Br 62a_100011215641_100009889011 [0,1,0,0,0,1|2,0,0]=4 8507 B15R1.119 CC(=O)CCCSCc1cccc(n1)C 62a_100000757606_100011215641 [0,1,0,0,0,1|2,0,0]=4 8508 B15R1.119 CC(=O)CCCSCc1cccc(n1)C 62a_100011215641_100000757606 [0,1,0,0,0,1|2,0,0]=4 8509 B15R1.119 CC(=O)CCCSCc1cccc(n1)Cl 62a_100000086093_100011215641 [0,1,0,0,0,1|2,0,0]=4 8510 B15R1.119 CC(=O)CCCSCc1cccc(n1)Cl 62a_100011215641_100000086093 [0,1,0,0,0,1|2,0,0]=4 8511 B15R1.119 CC(=O)CCCSCc1cccc(n1)F 62a_100009819644_100011215641 [0,1,0,0,0,1|2,0,0]=4 8512 B15R1.119 CC(=O)CCCSCc1cccc(n1)F 62a_100011215641_100009819644 [0,1,0,0,0,1|2,0,0]=4 8513 B15R1.119 CC(=O)CCCSCc1ccnc(c1)Br 62a_100010254460_100011215641 [0,1,0,0,0,1|2,0,0]=4 8514 B15R1.119 CC(=O)CCCSCc1ccnc(c1)Br 62a_100011215641_100010243470 [0,1,0,0,0,1|2,0,0]=4 8515 B15R1.119 CC(=O)CCCSCc1ccnc(c1)C 62a_100011215641_200020672517 [0,1,0,0,0,1|2,0,0]=4 8516 B15R1.119 CC(=O)CCCSCc1ccnc(c1)C 62a_200020672517_100011215641 [0,1,0,0,0,1|2,0,0]=4 8517 B15R1.119 CC(=O)CCCSCc1ccnc(c1)Cl 62a_100000764220_100011215641 [0,1,0,0,0,1|2,0,0]=4 8518 B15R1.119 CC(=O)CCCSCc1ccnc(c1)Cl 62a_100011215641_100000764220 [0,1,0,0,0,1|2,0,0]=4 8519 B15R1.119 CC(=O)CCCSCc1cncc(c1)Br 62a_100000738771_100011215641 [0,1,0,0,0,1|2,0,0]=4 8520 B15R1.119 CC(=O)CCCSCc1cncc(c1)Br 62a_100011215641_100000738771 [0,1,0,0,0,1|2,0,0]=4 8521 B15R1.119 CC(=O)CCCSCc1cncc(c1)C 62a_100000716715_100011215641 [0,1,0,0,0,1|2,0,0]=4 8522 B15R1.119 CC(=O)CCCSCc1cncc(c1)C 62a_100011215641_100000716715 [0,1,0,0,0,1|2,0,0]=4 8523 B15R1.119 CC(=O)CCCSCc1cncc(c1)Cl 62a_100011215641_100016992070 [0,1,0,0,0,1|2,0,0]=4 8524 B15R1.119 CC(=O)CCCSCc1cncc(c1)Cl 62a_100016992070_100011215641 [0,1,0,0,0,1|2,0,0]=4 8525 B15R1.119 CC(=O)CCCSCc1cncc(c1)F 62a_100000725299_100011215641 [0,1,0,0,0,1|2,0,0]=4 8526 B15R1.119 CC(=O)CCCSCc1cncc(c1)F 62a_100011215641_100000725299 [0,1,0,0,0,1|2,0,0]=4 8527 B15R1.119 CC(=O)CCOCCc1cccc(c1)Br 34a_100000759926_100011740638 [0,1,0,0,0,1|1,0,0]=3 8528 B15R1.119 CC(=O)CCOCCc1cccc(c1)Br 7a_100000759926_100011740638 [0,1,0,0,0,1|1,0,0]=3 8529 B15R1.119 CC(=O)CCOCCc1cccc(c1)Br 7a_100011217444_100000053229 [0,1,0,0,0,1|1,0,0]=3 8530 B15R1.119 CC(=O)CCOCCc1cccc(c1)C 34a_100000759926_100011713685 [0,1,0,0,0,1|1,0,0]=3 8531 B15R1.119 CC(=O)CCOCCc1cccc(c1)C 7a_100000759926_100011713685 [0,1,0,0,0,1|1,0,0]=3 8532 B15R1.119 CC(=O)CCOCCc1cccc(c1)C 7a_100011217157_100000053229 [0,1,0,0,0,1|1,0,0]=3 8533 B15R1.119 CC(=O)CCOCCc1cccc(c1)Cl 34a_100000759926_100011713710 [0,1,0,0,0,1|1,0,0]=3 8534 B15R1.119 CC(=O)CCOCCc1cccc(c1)Cl 7a_100000754733_100000053229 [0,1,0,0,0,1|1,0,0]=3 8535 B15R1.119 CC(=O)CCOCCc1cccc(c1)Cl 7a_100000759926_100011713710 [0,1,0,0,0,1|1,0,0]=3 8536 B15R1.119 CC(=O)CCOCCc1cccc(c1)F 34a_100000759926_100011217235 [0,1,0,0,0,1|1,0,0]=3 8537 B15R1.119 CC(=O)CCOCCc1cccc(c1)F 7a_100000759926_100011217235 [0,1,0,0,0,1|1,0,0]=3 8538 B15R1.119 CC(=O)CCOCCc1cccc(c1)F 7a_100000763591_100000053229 [0,1,0,0,0,1|1,0,0]=3 8539 B15R1.119 CC(=O)CCOCCc1cccc(n1)Br 7a_100010221043_100000053229 [0,1,0,0,0,1|2,0,0]=4 8540 B15R1.119 CC(=O)CCSCCc1cccc(c1)Br 62a_100000053229_100011740638 [0,1,0,0,0,1|1,0,0]=3 8541 B15R1.119 CC(=O)CCSCCc1cccc(c1)Br 62a_100011740638_100000053229 [0,1,0,0,0,1|1,0,0]=3 8542 B15R1.119 CC(=O)CCSCCc1cccc(c1)C 62a_100000053229_100011713685 [0,1,0,0,0,1|1,0,0]=3 8543 B15R1.119 CC(=O)CCSCCc1cccc(c1)C 62a_100011713685_100000053229 [0,1,0,0,0,1|1,0,0]=3 8544 B15R1.119 CC(=O)CCSCCc1cccc(c1)Cl 62a_100000053229_100011713710 [0,1,0,0,0,1|1,0,0]=3 8545 B15R1.119 CC(=O)CCSCCc1cccc(c1)Cl 62a_100011713710_100000053229 [0,1,0,0,0,1|1,0,0]=3 8546 B15R1.119 CC(=O)CCSCCc1cccc(c1)F 62a_100000053229_100011217235 [0,1,0,0,0,1|1,0,0]=3 8547 B15R1.119 CC(=O)CCSCCc1cccc(c1)F 62a_100011217235_100000053229 [0,1,0,0,0,1|1,0,0]=3 8548 B15R1.119 CC(=O)COCCCc1cccc(c1)Br 34a_100000211253_100011713683 [0,1,0,0,0,1|1,0,0]=3 8549 B15R1.119 CC(=O)COCCCc1cccc(c1)F 34a_100000211253_200000698031 [0,1,0,0,0,1|1,0,0]=3 8550 B15R1.119 CC(=O)COCCOc1cccc(c1)Br 34a_100000211253_100000183150 [0,1,0,0,0,1|2,0,0]=4 8551 B15R1.119 CC(=O)COCCOc1cccc(c1)Cl 34a_100000211253_100000181161 [0,1,0,0,0,1|2,0,0]=4 8552 B15R1.119 CC(=O)COCCOc1cccc(c1)F 34a_100000211253_100000739188 [0,1,0,0,0,1|2,0,0]=4 8553 B15R1.119 CC(=O)NCCCOc1cccc(c1)Cl 11a_100011220311_100015343762 [0,1,0,0,0,1|2,0,0]=4 8554 B15R1.119 CC(=O)NCCCOc1cccc(c1)Cl 1626a_100011220311_100015343762 [0,1,0,0,0,1|2,0,0]=4 8555 B15R1.119 CC(=O)NCCCOc1cccc(c1)Cl 240690a_100011220311_100015343762 [0,1,0,0,0,1|2,0,0]=4 8556 B15R1.119 CC(=O)NCCCOc1cccc(c1)Cl 527a_100011220311_100103153847 [0,1,0,0,0,1|2,0,0]=4 8557 B15R1.119 CC(=O)NCCCOc1cccc(c1)F 11a_100102661586_100015343762 [0,1,0,0,0,1|2,0,0]=4 8558 B15R1.119 CC(=O)NCCCOc1cccc(c1)F 1626a_100102661586_100015343762 [0,1,0,0,0,1|2,0,0]=4 8559 B15R1.119 CC(=O)NCCCOc1cccc(c1)F 240690a_100102661586_100015343762 [0,1,0,0,0,1|2,0,0]=4 8560 B15R1.119 CC(=O)NCCCOc1cccc(c1)F 527a_100102661586_100103153847 [0,1,0,0,0,1|2,0,0]=4 8561 B15R1.119 CC(=O)NCCNCc1cccc(c1)Br 207a_100000209853_100000210085 [0,1,0,0,0,1|2,0,0]=4 8562 B15R1.119 CC(=O)NCCNCc1cccc(c1)Br 2230a_100000174977_100000189650 [0,1,0,0,0,1|2,0,0]=4 8563 B15R1.119 CC(=O)NCCNCc1cccc(c1)Br 2230a_100000209853_100000698116 [0,1,0,0,0,1|2,0,0]=4 8564 B15R1.119 CC(=O)NCCNCc1cccc(c1)C 207a_100000209853_100000211157 [0,1,0,0,0,1|2,0,0]=4 8565 B15R1.119 CC(=O)NCCNCc1cccc(c1)C 2230a_100000185548_100000189650 [0,1,0,0,0,1|2,0,0]=4 8566 B15R1.119 CC(=O)NCCNCc1cccc(c1)C 2230a_100000209853_100000211840 [0,1,0,0,0,1|2,0,0]=4 8567 B15R1.119 CC(=O)NCCNCc1cccc(c1)Cl 207a_100000209853_100000210801 [0,1,0,0,0,1|2,0,0]=4 8568 B15R1.119 CC(=O)NCCNCc1cccc(c1)Cl 2230a_100000174878_100000189650 [0,1,0,0,0,1|2,0,0]=4 8569 B15R1.119 CC(=O)NCCNCc1cccc(c1)Cl 2230a_100000209853_100000181238 [0,1,0,0,0,1|2,0,0]=4 8570 B15R1.119 CC(=O)NCCNCc1cccc(c1)F 207a_100000209853_100000210812 [0,1,0,0,0,1|2,0,0]=4 8571 B15R1.119 CC(=O)NCCNCc1cccc(c1)F 2230a_100000174948_100000189650 [0,1,0,0,0,1|2,0,0]=4 8572 B15R1.119 CC(=O)NCCNCc1cccc(c1)F 2230a_100000209853_100000230114 [0,1,0,0,0,1|2,0,0]=4 8573 B15R1.119 CC(=O)NCCNCc1cccc(c1)I 207a_100000209853_100000014684 [0,1,0,0,0,1|2,0,0]=4 8574 B15R1.119 CC(=O)NCCNCc1cccc(c1)I 2230a_100000106179_100000189650 [0,1,0,0,0,1|2,0,0]=4 8575 B15R1.119 CC(=O)NCCNCc1cccc(c1)I 2230a_100000209853_100011218688 [0,1,0,0,0,1|2,0,0]=4 8576 B15R1.119 CC(=O)NCCNCc1cccc(c1)O 207a_100000209853_100000188321 [0,1,0,0,0,1|2,0,0]=4 8577 B15R1.119 CC(=O)NCCNCc1cccc(c1)O 2230a_100000209853_100011660834 [0,1,0,0,0,1|2,0,0]=4 8578 B15R1.119 CC(=O)NCCNCc1cccc(c1)O 2230a_100000743036_100000189650 [0,1,0,0,0,1|2,0,0]=4 8579 B15R1.119 CC(=O)NCCOCc1cccc(c1)Br 34a_100000158858_100000698116 [0,1,0,0,0,1|2,0,0]=4 8580 B15R1.119 CC(=O)NCCOCc1cccc(c1)Br 7a_100000687537_100000189650 [0,1,0,0,0,1|2,0,0]=4 8581 B15R1.119 CC(=O)NCCOCc1cccc(c1)C 34a_100000158858_100000211840 [0,1,0,0,0,1|2,0,0]=4 8582 B15R1.119 CC(=O)NCCOCc1cccc(c1)C 7a_100011217746_100000189650 [0,1,0,0,0,1|2,0,0]=4 8583 B15R1.119 CC(=O)NCCOCc1cccc(c1)Cl 34a_100000158858_100000187163 [0,1,0,0,0,1|2,0,0]=4 8584 B15R1.119 CC(=O)NCCOCc1cccc(c1)Cl 7a_100000241301_100000189650 [0,1,0,0,0,1|2,0,0]=4 8585 B15R1.119 CC(=O)NCCOCc1cccc(c1)F 34a_100000158858_100000187166 [0,1,0,0,0,1|2,0,0]=4 8586 B15R1.119 CC(=O)NCCOCc1cccc(c1)F 7a_100000210976_100000189650 [0,1,0,0,0,1|2,0,0]=4 8587 B15R1.119 CC(=O)NCCOCc1cccc(c1)I 34a_100000158858_100011218688 [0,1,0,0,0,1|2,0,0]=4 8588 B15R1.119 CC(=O)NCCOCc1cccc(c1)I 7a_100011215336_100000189650 [0,1,0,0,0,1|2,0,0]=4 8589 B15R1.119 CC(=O)NCCOCc1cccc(c1)O 34a_100000158858_100011660834 [0,1,0,0,0,1|2,0,0]=4 8590 B15R1.119 CC(=O)NCCSCc1cccc(c1)Br 62a_100000189650_100000211773 [0,1,0,0,0,1|2,0,0]=4 8591 B15R1.119 CC(=O)NCCSCc1cccc(c1)Br 62a_100000211773_100000189650 [0,1,0,0,0,1|2,0,0]=4 8592 B15R1.119 CC(=O)NCCSCc1cccc(c1)C 62a_100000189650_100000211840 [0,1,0,0,0,1|2,0,0]=4 8593 B15R1.119 CC(=O)NCCSCc1cccc(c1)C 62a_100000211840_100000189650 [0,1,0,0,0,1|2,0,0]=4 8594 B15R1.119 CC(=O)NCCSCc1cccc(c1)Cl 11a_200011225440_100015343762 [0,1,0,0,0,1|2,0,0]=4 8595 B15R1.119 CC(=O)NCCSCc1cccc(c1)Cl 1626a_200011225440_100015343762 [0,1,0,0,0,1|2,0,0]=4 8596 B15R1.119 CC(=O)NCCSCc1cccc(c1)Cl 240690a_200011225440_100015343762 [0,1,0,0,0,1|2,0,0]=4 8597 B15R1.119 CC(=O)NCCSCc1cccc(c1)Cl 527a_200011225440_100103153847 [0,1,0,0,0,1|2,0,0]=4 8598 B15R1.119 CC(=O)NCCSCc1cccc(c1)Cl 62a_100000187163_100000189650 [0,1,0,0,0,1|2,0,0]=4 8599 B15R1.119 CC(=O)NCCSCc1cccc(c1)Cl 62a_100000189650_100000187163 [0,1,0,0,0,1|2,0,0]=4 8600 B15R1.119 CC(=O)NCCSCc1cccc(c1)F 62a_100000189650_100000230114 [0,1,0,0,0,1|2,0,0]=4 8601 B15R1.119 CC(=O)NCCSCc1cccc(c1)F 62a_100000230114_100000189650 [0,1,0,0,0,1|2,0,0]=4 8602 B15R1.119 CC(=O)NCCSCc1cccc(c1)I 62a_100000189650_100011218688 [0,1,0,0,0,1|2,0,0]=4 8603 B15R1.119 CC(=O)NCCSCc1cccc(c1)I 62a_100011218688_100000189650 [0,1,0,0,0,1|2,0,0]=4 8604 B15R1.119 CC(=O)NCCSCc1cccc(c1)O 62a_100000189650_100011660834 [0,1,0,0,0,1|2,0,0]=4 8605 B15R1.119 CC(=O)NCCSCc1cccc(c1)O 62a_100011660834_100000189650 [0,1,0,0,0,1|2,0,0]=4 8606 B15R1.119 CC(=O)OCCCNc1cccc(c1)Br 34a_100000210019_100000042594 [0,1,0,0,0,1|2,0,0]=4 8607 B15R1.119 CC(=O)OCCCNc1cccc(c1)C 34a_100000188690_100000042594 [0,1,0,0,0,1|2,0,0]=4 8608 B15R1.119 CC(=O)OCCCNc1cccc(c1)Cl 34a_100000185859_100000042594 [0,1,0,0,0,1|2,0,0]=4 8609 B15R1.119 CC(=O)OCCCNc1cccc(c1)F 34a_100000210047_100000042594 [0,1,0,0,0,1|2,0,0]=4 8610 B15R1.119 CC(=O)OCCCNc1cccc(c1)I 34a_100000211102_100000042594 [0,1,0,0,0,1|2,0,0]=4 8611 B15R1.119 CC(=O)OCCCNc1cccc(c1)O 34a_100000210217_100000042594 [0,1,0,0,0,1|2,0,0]=4 8612 B15R1.119 CC(=O)OCCCOc1cccc(c1)Br 34a_100000210342_100000042594 [0,1,0,0,0,1|2,0,0]=4 8613 B15R1.119 CC(=O)OCCCOc1cccc(c1)Br 7a_100000210342_100000042594 [0,1,0,0,0,1|2,0,0]=4 8614 B15R1.119 CC(=O)OCCCOc1cccc(c1)C 34a_100000210337_100000042594 [0,1,0,0,0,1|2,0,0]=4 8615 B15R1.119 CC(=O)OCCCOc1cccc(c1)C 7a_100000210337_100000042594 [0,1,0,0,0,1|2,0,0]=4 8616 B15R1.119 CC(=O)OCCCOc1cccc(c1)Cl 34a_100000210295_100000042594 [0,1,0,0,0,1|2,0,0]=4 8617 B15R1.119 CC(=O)OCCCOc1cccc(c1)Cl 7a_100000210295_100000042594 [0,1,0,0,0,1|2,0,0]=4 8618 B15R1.119 CC(=O)OCCCOc1cccc(c1)F 34a_100000210426_100000042594 [0,1,0,0,0,1|2,0,0]=4 8619 B15R1.119 CC(=O)OCCCOc1cccc(c1)F 7a_100000210426_100000042594 [0,1,0,0,0,1|2,0,0]=4 8620 B15R1.119 CC(=O)OCCCOc1cccc(c1)I 34a_100000211634_100000042594 [0,1,0,0,0,1|2,0,0]=4 8621 B15R1.119 CC(=O)OCCCOc1cccc(c1)I 7a_100000211634_100000042594 [0,1,0,0,0,1|2,0,0]=4 8622 B15R1.119 CC(=O)OCCCOc1cccc(c1)N 34a_100000210217_100000042594 [0,1,0,0,0,1|2,0,0]=4 8623 B15R1.119 CC(=O)OCCCSc1cccc(c1)Br 62a_100000042594_100000691529 [0,1,0,0,0,1|2,0,0]=4 8624 B15R1.119 CC(=O)OCCCSc1cccc(c1)Br 62a_100000691529_100000042594 [0,1,0,0,0,1|2,0,0]=4 8625 B15R1.119 CC(=O)OCCCSc1cccc(c1)C 62a_100000042594_100011215228 [0,1,0,0,0,1|2,0,0]=4 8626 B15R1.119 CC(=O)OCCCSc1cccc(c1)C 62a_100011215228_100000042594 [0,1,0,0,0,1|2,0,0]=4 8627 B15R1.119 CC(=O)OCCCSc1cccc(c1)Cl 62a_100000042594_100000699651 [0,1,0,0,0,1|2,0,0]=4 8628 B15R1.119 CC(=O)OCCCSc1cccc(c1)Cl 62a_100000699651_100000042594 [0,1,0,0,0,1|2,0,0]=4 8629 B15R1.119 CC(=O)OCCCSc1cccc(c1)F 62a_100000042594_100000685547 [0,1,0,0,0,1|2,0,0]=4 8630 B15R1.119 CC(=O)OCCCSc1cccc(c1)F 62a_100000685547_100000042594 [0,1,0,0,0,1|2,0,0]=4 8631 B15R1.119 CC(=O)OCCCSc1cccc(c1)N 62a_100000042594_100000210019 [0,1,0,0,0,1|2,0,0]=4 8632 B15R1.119 CC(=O)OCCCSc1cccc(c1)N 62a_100000210019_100000042594 [0,1,0,0,0,1|2,0,0]=4 8633 B15R1.119 CC(=O)OCCCSc1cccc(c1)O 62a_100000042594_100000211634 [0,1,0,0,0,1|2,0,0]=4 8634 B15R1.119 CC(=O)OCCCSc1cccc(c1)[S] 62a_100000042594_114929384022 [0,1,0,0,0,1|2,0,0]=4 8635 B15R1.119 CC(=O)OCCCSc1cccc(c1)[S] 62a_114929384022_100000042594 [0,1,0,0,0,1|2,0,0]=4 8636 B15R1.119 CC(=O)OCCNCc1cccc(c1)Br 34a_100000174977_100009814007 [0,1,0,0,0,1|2,0,0]=4 8637 B15R1.119 CC(=O)OCCNCc1cccc(c1)C 34a_100000185548_100009814007 [0,1,0,0,0,1|2,0,0]=4 8638 B15R1.119 CC(=O)OCCNCc1cccc(c1)Cl 34a_100000174878_100009814007 [0,1,0,0,0,1|2,0,0]=4 8639 B15R1.119 CC(=O)OCCNCc1cccc(c1)F 34a_100000174948_100009814007 [0,1,0,0,0,1|2,0,0]=4 8640 B15R1.119 CC(=O)OCCNCc1cccc(c1)I 34a_100000106179_100009814007 [0,1,0,0,0,1|2,0,0]=4 8641 B15R1.119 CC(=O)OCCNCc1cccc(c1)O 34a_100000743036_100009814007 [0,1,0,0,0,1|2,0,0]=4 8642 B15R1.119 CC(=O)OCCOCc1cccc(c1)Br 34a_100000687537_100009814007 [0,1,0,0,0,1|2,0,0]=4 8643 B15R1.119 CC(=O)OCCOCc1cccc(c1)Br 7a_100000687537_100009814007 [0,1,0,0,0,1|2,0,0]=4 8644 B15R1.119 CC(=O)OCCOCc1cccc(c1)C 34a_100011217746_100009814007 [0,1,0,0,0,1|2,0,0]=4 8645 B15R1.119 CC(=O)OCCOCc1cccc(c1)C 7a_100011217746_100009814007 [0,1,0,0,0,1|2,0,0]=4 8646 B15R1.119 CC(=O)OCCOCc1cccc(c1)Cl 34a_100000241301_100009814007 [0,1,0,0,0,1|2,0,0]=4 8647 B15R1.119 CC(=O)OCCOCc1cccc(c1)Cl 7a_100000241301_100009814007 [0,1,0,0,0,1|2,0,0]=4 8648 B15R1.119 CC(=O)OCCOCc1cccc(c1)F 34a_100000210976_100009814007 [0,1,0,0,0,1|2,0,0]=4 8649 B15R1.119 CC(=O)OCCOCc1cccc(c1)F 7a_100000210976_100009814007 [0,1,0,0,0,1|2,0,0]=4 8650 B15R1.119 CC(=O)OCCOCc1cccc(c1)I 34a_100011215336_100009814007 [0,1,0,0,0,1|2,0,0]=4 8651 B15R1.119 CC(=O)OCCOCc1cccc(c1)I 7a_100011215336_100009814007 [0,1,0,0,0,1|2,0,0]=4 8652 B15R1.119 CC(=O)OCCOCc1cccc(c1)N 34a_100000211919_100009814007 [0,1,0,0,0,1|2,0,0]=4 8653 B15R1.119 CC(=O)OCCSCc1cccc(c1)Br 62a_100000211773_100009814007 [0,1,0,0,0,1|2,0,0]=4 8654 B15R1.119 CC(=O)OCCSCc1cccc(c1)Br 62a_100009814007_100000211773 [0,1,0,0,0,1|2,0,0]=4 8655 B15R1.119 CC(=O)OCCSCc1cccc(c1)C 62a_100000211840_100009814007 [0,1,0,0,0,1|2,0,0]=4 8656 B15R1.119 CC(=O)OCCSCc1cccc(c1)C 62a_100009814007_100000211840 [0,1,0,0,0,1|2,0,0]=4 8657 B15R1.119 CC(=O)OCCSCc1cccc(c1)Cl 62a_100000187163_100009814007 [0,1,0,0,0,1|2,0,0]=4 8658 B15R1.119 CC(=O)OCCSCc1cccc(c1)Cl 62a_100009814007_100000187163 [0,1,0,0,0,1|2,0,0]=4 8659 B15R1.119 CC(=O)OCCSCc1cccc(c1)F 62a_100000230114_100009814007 [0,1,0,0,0,1|2,0,0]=4 8660 B15R1.119 CC(=O)OCCSCc1cccc(c1)F 62a_100009814007_100000230114 [0,1,0,0,0,1|2,0,0]=4 8661 B15R1.119 CC(=O)OCCSCc1cccc(c1)I 62a_100009814007_100011218688 [0,1,0,0,0,1|2,0,0]=4 8662 B15R1.119 CC(=O)OCCSCc1cccc(c1)I 62a_100011218688_100009814007 [0,1,0,0,0,1|2,0,0]=4 8663 B15R1.119 CC(=O)OCCSCc1cccc(c1)O 62a_100009814007_100011660834 [0,1,0,0,0,1|2,0,0]=4 8664 B15R1.119 CC(=O)OCCSCc1cccc(c1)O 62a_100011660834_100009814007 [0,1,0,0,0,1|2,0,0]=4 8665 B15R1.119 CC(=O)OCNCCc1cccc(c1)Br 34a_100011207229_100009813279 [0,1,0,0,0,1|2,0,0]=4 8666 B15R1.119 CC(=O)OCNCCc1cccc(c1)C 34a_100000749837_100009813279 [0,1,0,0,0,1|2,0,0]=4 8667 B15R1.119 CC(=O)OCNCCc1cccc(c1)Cl 34a_100000185263_100009813279 [0,1,0,0,0,1|2,0,0]=4 8668 B15R1.119 CC(=O)OCNCCc1cccc(c1)F 34a_100000205154_100009813279 [0,1,0,0,0,1|2,0,0]=4 8669 B15R1.119 CC(=O)OCNCCc1cccc(c1)O 34a_100000747277_100009813279 [0,1,0,0,0,1|2,0,0]=4 8670 B15R1.119 CC(=O)OCOCCc1cccc(c1)Br 34a_100011217444_100009813279 [0,1,0,0,0,1|2,0,0]=4 8671 B15R1.119 CC(=O)OCOCCc1cccc(c1)C 34a_100011217157_100009813279 [0,1,0,0,0,1|2,0,0]=4 8672 B15R1.119 CC(=O)OCOCCc1cccc(c1)Cl 34a_100000754733_100009813279 [0,1,0,0,0,1|2,0,0]=4 8673 B15R1.119 CC(=O)OCOCCc1cccc(c1)F 34a_100000763591_100009813279 [0,1,0,0,0,1|2,0,0]=4 8674 B15R1.119 CC(=O)OCOCCc1cccc(c1)N 34a_100011996697_100009813279 [0,1,0,0,0,1|2,0,0]=4 8675 B15R1.119 CC(=O)OCSCCc1cccc(c1)Br 62a_100000076356_100011740638 [0,1,0,0,0,1|2,0,0]=4 8676 B15R1.119 CC(=O)OCSCCc1cccc(c1)Br 62a_100011740638_100000076356 [0,1,0,0,0,1|2,0,0]=4 8677 B15R1.119 CC(=O)OCSCCc1cccc(c1)C 62a_100000076356_100011713685 [0,1,0,0,0,1|2,0,0]=4 8678 B15R1.119 CC(=O)OCSCCc1cccc(c1)C 62a_100011713685_100000076356 [0,1,0,0,0,1|2,0,0]=4 8679 B15R1.119 CC(=O)OCSCCc1cccc(c1)Cl 62a_100000076356_100011713710 [0,1,0,0,0,1|2,0,0]=4 8680 B15R1.119 CC(=O)OCSCCc1cccc(c1)Cl 62a_100011713710_100000076356 [0,1,0,0,0,1|2,0,0]=4 8681 B15R1.119 CC(=O)OCSCCc1cccc(c1)F 62a_100000076356_100011217235 [0,1,0,0,0,1|2,0,0]=4 8682 B15R1.119 CC(=O)OCSCCc1cccc(c1)F 62a_100011217235_100000076356 [0,1,0,0,0,1|2,0,0]=4 8683 B15R1.119 CC(=O)SCCCNc1cccc(c1)Br 34a_100000210019_100000038929 [0,1,0,0,0,1|2,0,0]=4 8684 B15R1.119 CC(=O)SCCCNc1cccc(c1)C 2230a_100000188690_100000038929 [0,1,0,0,0,1|2,0,0]=4 8685 B15R1.119 CC(=O)SCCCNc1cccc(c1)C 34a_100000188690_100000038929 [0,1,0,0,0,1|2,0,0]=4 8686 B15R1.119 CC(=O)SCCCNc1cccc(c1)Cl 34a_100000185859_100000038929 [0,1,0,0,0,1|2,0,0]=4 8687 B15R1.119 CC(=O)SCCCNc1cccc(c1)F 34a_100000210047_100000038929 [0,1,0,0,0,1|2,0,0]=4 8688 B15R1.119 CC(=O)SCCCNc1cccc(c1)I 34a_100000211102_100000038929 [0,1,0,0,0,1|2,0,0]=4 8689 B15R1.119 CC(=O)SCCCNc1cccc(c1)O 34a_100000210217_100000038929 [0,1,0,0,0,1|2,0,0]=4 8690 B15R1.119 CC(=O)SCCCOc1cccc(c1)Br 34a_100000210342_100000038929 [0,1,0,0,0,1|2,0,0]=4 8691 B15R1.119 CC(=O)SCCCOc1cccc(c1)Br 7a_100000210342_100000038929 [0,1,0,0,0,1|2,0,0]=4 8692 B15R1.119 CC(=O)SCCCOc1cccc(c1)C 34a_100000210337_100000038929 [0,1,0,0,0,1|2,0,0]=4 8693 B15R1.119 CC(=O)SCCCOc1cccc(c1)C 7a_100000210337_100000038929 [0,1,0,0,0,1|2,0,0]=4 8694 B15R1.119 CC(=O)SCCCOc1cccc(c1)Cl 34a_100000210295_100000038929 [0,1,0,0,0,1|2,0,0]=4 8695 B15R1.119 CC(=O)SCCCOc1cccc(c1)Cl 7a_100000210295_100000038929 [0,1,0,0,0,1|2,0,0]=4 8696 B15R1.119 CC(=O)SCCCOc1cccc(c1)F 34a_100000210426_100000038929 [0,1,0,0,0,1|2,0,0]=4 8697 B15R1.119 CC(=O)SCCCOc1cccc(c1)F 7a_100000210426_100000038929 [0,1,0,0,0,1|2,0,0]=4 8698 B15R1.119 CC(=O)SCCCOc1cccc(c1)I 34a_100000211634_100000038929 [0,1,0,0,0,1|2,0,0]=4 8699 B15R1.119 CC(=O)SCCCOc1cccc(c1)I 7a_100000211634_100000038929 [0,1,0,0,0,1|2,0,0]=4 8700 B15R1.119 CC(=O)SCCCOc1cccc(c1)N 34a_100000210217_100000038929 [0,1,0,0,0,1|2,0,0]=4 8701 B15R1.119 CC(=O)SCCCSc1cccc(c1)Br 62a_100000038929_100000691529 [0,1,0,0,0,1|2,0,0]=4 8702 B15R1.119 CC(=O)SCCCSc1cccc(c1)Br 62a_100000691529_100000038929 [0,1,0,0,0,1|2,0,0]=4 8703 B15R1.119 CC(=O)SCCCSc1cccc(c1)C 62a_100000038929_100011215228 [0,1,0,0,0,1|2,0,0]=4 8704 B15R1.119 CC(=O)SCCCSc1cccc(c1)C 62a_100011215228_100000038929 [0,1,0,0,0,1|2,0,0]=4 8705 B15R1.119 CC(=O)SCCCSc1cccc(c1)Cl 62a_100000038929_100000699651 [0,1,0,0,0,1|2,0,0]=4 8706 B15R1.119 CC(=O)SCCCSc1cccc(c1)Cl 62a_100000699651_100000038929 [0,1,0,0,0,1|2,0,0]=4 8707 B15R1.119 CC(=O)SCCCSc1cccc(c1)F 62a_100000038929_100000685547 [0,1,0,0,0,1|2,0,0]=4 8708 B15R1.119 CC(=O)SCCCSc1cccc(c1)F 62a_100000685547_100000038929 [0,1,0,0,0,1|2,0,0]=4 8709 B15R1.119 CC(=O)SCCCSc1cccc(c1)N 62a_100000038929_100000210019 [0,1,0,0,0,1|2,0,0]=4 8710 B15R1.119 CC(=O)SCCCSc1cccc(c1)N 62a_100000210019_100000038929 [0,1,0,0,0,1|2,0,0]=4 8711 B15R1.119 CC(=O)SCCCSc1cccc(c1)O 62a_100000038929_100000211634 [0,1,0,0,0,1|2,0,0]=4 8712 B15R1.119 CC(=O)SCCCSc1cccc(c1)[S] 62a_100000038929_114929384022 [0,1,0,0,0,1|2,0,0]=4 8713 B15R1.119 CC(=O)SCCCSc1cccc(c1)[S] 62a_114929384022_100000038929 [0,1,0,0,0,1|2,0,0]=4 8714 B15R1.119 CC(O)CCCNCc1cccc(c1)Br 2230a_100000174977_200000718107 [0,1,0,0,0,1|1,0,1]=4 8715 B15R1.119 CC(O)CCCNCc1cccc(c1)Br 34a_100000174977_200000718107 [0,1,0,0,0,1|1,0,1]=4 8716 B15R1.119 CC(O)CCCNCc1cccc(c1)Cl 2230a_100000174878_200000718107 [0,1,0,0,0,1|1,0,1]=4 8717 B15R1.119 CC(O)CCCNCc1cccc(c1)Cl 34a_100000174878_200000718107 [0,1,0,0,0,1|1,0,1]=4 8718 B15R1.119 CC(O)CCCNCc1cccc(c1)F 2230a_100000174948_200000718107 [0,1,0,0,0,1|1,0,1]=4 8719 B15R1.119 CC(O)CCCNCc1cccc(c1)F 34a_100000174948_200000718107 [0,1,0,0,0,1|1,0,1]=4 8720 B15R1.119 CC(O)CCCNCc1cccc(c1)I 2230a_100000106179_200000718107 [0,1,0,0,0,1|1,0,1]=4 8721 B15R1.119 CC(O)CCCNCc1cccc(c1)I 34a_100000106179_200000718107 [0,1,0,0,0,1|1,0,1]=4 8722 B15R1.119 CC(O)CCCNCc1cccc(c1)O 2230a_100000743036_200000718107 [0,1,0,0,0,1|1,0,1]=4 8723 B15R1.119 CC(O)CCCNCc1cccc(c1)O 34a_100000743036_200000718107 [0,1,0,0,0,1|1,0,1]=4 8724 B15R1.119 CC(O)CCCOCc1cccc(c1)Br 34a_100000687537_200000718107 [0,1,0,0,0,1|1,0,1]=4 8725 B15R1.119 CC(O)CCCOCc1cccc(c1)Br 7a_100000687537_200000718107 [0,1,0,0,0,1|1,0,1]=4 8726 B15R1.119 CC(O)CCCOCc1cccc(c1)Cl 34a_100000241301_200000718107 [0,1,0,0,0,1|1,0,1]=4 8727 B15R1.119 CC(O)CCCOCc1cccc(c1)Cl 7a_100000241301_200000718107 [0,1,0,0,0,1|1,0,1]=4 8728 B15R1.119 CC(O)CCCOCc1cccc(c1)F 34a_100000210976_200000718107 [0,1,0,0,0,1|1,0,1]=4 8729 B15R1.119 CC(O)CCCOCc1cccc(c1)F 7a_100000210976_200000718107 [0,1,0,0,0,1|1,0,1]=4 8730 B15R1.119 CC(O)CCCOCc1cccc(c1)I 34a_100011215336_200000718107 [0,1,0,0,0,1|1,0,1]=4 8731 B15R1.119 CC(O)CCCOCc1cccc(c1)I 7a_100011215336_200000718107 [0,1,0,0,0,1|1,0,1]=4 8732 B15R1.119 CC(O)CCCOCc1cccc(c1)N 34a_100000211919_200000718107 [0,1,0,0,0,1|1,0,1]=4 8733 B15R1.119 CC(O)CCCSCc1cccc(c1)Br 62a_100000211773_200000718107 [0,1,0,0,0,1|1,0,1]=4 8734 B15R1.119 CC(O)CCCSCc1cccc(c1)Br 62a_200000718107_100000211773 [0,1,0,0,0,1|1,0,1]=4 8735 B15R1.119 CC(O)CCCSCc1cccc(c1)Cl 62a_100000187163_200000718107 [0,1,0,0,0,1|1,0,1]=4 8736 B15R1.119 CC(O)CCCSCc1cccc(c1)Cl 62a_200000718107_100000187163 [0,1,0,0,0,1|1,0,1]=4 8737 B15R1.119 CC(O)CCCSCc1cccc(c1)F 62a_100000230114_200000718107 [0,1,0,0,0,1|1,0,1]=4 8738 B15R1.119 CC(O)CCCSCc1cccc(c1)F 62a_200000718107_100000230114 [0,1,0,0,0,1|1,0,1]=4 8739 B15R1.119 CC(O)CCCSCc1cccc(c1)I 62a_100011218688_200000718107 [0,1,0,0,0,1|1,0,1]=4 8740 B15R1.119 CC(O)CCCSCc1cccc(c1)I 62a_200000718107_100011218688 [0,1,0,0,0,1|1,0,1]=4 8741 B15R1.119 CC(O)CCCSCc1cccc(c1)O 62a_100011660834_200000718107 [0,1,0,0,0,1|1,0,1]=4 8742 B15R1.119 CC(O)CCCSCc1cccc(c1)O 62a_200000718107_100011660834 [0,1,0,0,0,1|1,0,1]=4 8743 B15R1.119 CC(O)CCNCCc1cccc(c1)Br 2230a_100011207229_100012276601 [0,1,0,0,0,1|1,0,1]=4 8744 B15R1.119 CC(O)CCNCCc1cccc(c1)Br 2230a_200000755665_100011740638 [0,1,0,0,0,1|1,0,1]=4 8745 B15R1.119 CC(O)CCNCCc1cccc(c1)Br 34a_100011207229_100012276601 [0,1,0,0,0,1|1,0,1]=4 8746 B15R1.119 CC(O)CCNCCc1cccc(c1)Cl 2230a_100000185263_100012276601 [0,1,0,0,0,1|1,0,1]=4 8747 B15R1.119 CC(O)CCNCCc1cccc(c1)Cl 2230a_200000755665_100011713710 [0,1,0,0,0,1|1,0,1]=4 8748 B15R1.119 CC(O)CCNCCc1cccc(c1)Cl 34a_100000185263_100012276601 [0,1,0,0,0,1|1,0,1]=4 8749 B15R1.119 CC(O)CCNCCc1cccc(c1)F 2230a_100000205154_100012276601 [0,1,0,0,0,1|1,0,1]=4 8750 B15R1.119 CC(O)CCNCCc1cccc(c1)F 2230a_200000755665_100011217235 [0,1,0,0,0,1|1,0,1]=4 8751 B15R1.119 CC(O)CCNCCc1cccc(c1)F 34a_100000205154_100012276601 [0,1,0,0,0,1|1,0,1]=4 8752 B15R1.119 CC(O)CCNCCc1cccc(c1)O 2230a_100000747277_100012276601 [0,1,0,0,0,1|1,0,1]=4 8753 B15R1.119 CC(O)CCNCCc1cccc(c1)O 34a_100000747277_100012276601 [0,1,0,0,0,1|1,0,1]=4 8754 B15R1.119 CC(O)CCOCCc1cccc(c1)Br 34a_100011217444_100012276601 [0,1,0,0,0,1|1,0,1]=4 8755 B15R1.119 CC(O)CCOCCc1cccc(c1)Br 7a_100011217444_100012276601 [0,1,0,0,0,1|1,0,1]=4 8756 B15R1.119 CC(O)CCOCCc1cccc(c1)Cl 34a_100000754733_100012276601 [0,1,0,0,0,1|1,0,1]=4 8757 B15R1.119 CC(O)CCOCCc1cccc(c1)Cl 7a_100000754733_100012276601 [0,1,0,0,0,1|1,0,1]=4 8758 B15R1.119 CC(O)CCOCCc1cccc(c1)F 34a_100000763591_100012276601 [0,1,0,0,0,1|1,0,1]=4 8759 B15R1.119 CC(O)CCOCCc1cccc(c1)F 7a_100000763591_100012276601 [0,1,0,0,0,1|1,0,1]=4 8760 B15R1.119 CC(O)CCOCCc1cccc(c1)N 34a_100011996697_100012276601 [0,1,0,0,0,1|1,0,1]=4 8761 B15R1.119 CC(O)CCSCCc1cccc(c1)Br 62a_100011740638_100012276601 [0,1,0,0,0,1|1,0,1]=4 8762 B15R1.119 CC(O)CCSCCc1cccc(c1)Br 62a_100012276601_100011740638 [0,1,0,0,0,1|1,0,1]=4 8763 B15R1.119 CC(O)CCSCCc1cccc(c1)Cl 62a_100011713710_100012276601 [0,1,0,0,0,1|1,0,1]=4 8764 B15R1.119 CC(O)CCSCCc1cccc(c1)Cl 62a_100012276601_100011713710 [0,1,0,0,0,1|1,0,1]=4 8765 B15R1.119 CC(O)CCSCCc1cccc(c1)F 62a_100011217235_100012276601 [0,1,0,0,0,1|1,0,1]=4 8766 B15R1.119 CC(O)CCSCCc1cccc(c1)F 62a_100012276601_100011217235 [0,1,0,0,0,1|1,0,1]=4 8767 B15R1.119 CC(O)CNCCCc1cccc(c1)Br 2230a_100000210904_100011713683 [0,1,0,0,0,1|1,0,1]=4 8768 B15R1.119 CC(O)CNCCCc1cccc(c1)Br 2230a_100000753791_100011218427 [0,1,0,0,0,1|1,0,1]=4 8769 B15R1.119 CC(O)CNCCCc1cccc(c1)Br 34a_100000210904_100011713683 [0,1,0,0,0,1|1,0,1]=4 8770 B15R1.119 CC(O)CNCCCc1cccc(c1)Br 34a_100000753791_100011218427 [0,1,0,0,0,1|1,0,1]=4 8771 B15R1.119 CC(O)CNCCCc1cccc(c1)Cl 2230a_100000704586_100011218427 [0,1,0,0,0,1|1,0,1]=4 8772 B15R1.119 CC(O)CNCCCc1cccc(c1)Cl 34a_100000704586_100011218427 [0,1,0,0,0,1|1,0,1]=4 8773 B15R1.119 CC(O)CNCCCc1cccc(c1)F 2230a_100000210904_200000698031 [0,1,0,0,0,1|1,0,1]=4 8774 B15R1.119 CC(O)CNCCCc1cccc(c1)F 2230a_100000754185_100011218427 [0,1,0,0,0,1|1,0,1]=4 8775 B15R1.119 CC(O)CNCCCc1cccc(c1)F 34a_100000210904_200000698031 [0,1,0,0,0,1|1,0,1]=4 8776 B15R1.119 CC(O)CNCCCc1cccc(c1)F 34a_100000754185_100011218427 [0,1,0,0,0,1|1,0,1]=4 8777 B15R1.119 CC(O)COCCCc1cccc(c1)Br 34a_100011709248_100011218427 [0,1,0,0,0,1|1,0,1]=4 8778 B15R1.119 CC(O)COCCCc1cccc(c1)Br 7a_100011709248_100011218427 [0,1,0,0,0,1|1,0,1]=4 8779 B15R1.119 CC(O)COCCCc1cccc(c1)Cl 34a_100011709246_100011218427 [0,1,0,0,0,1|1,0,1]=4 8780 B15R1.119 CC(O)COCCCc1cccc(c1)Cl 7a_100011709246_100011218427 [0,1,0,0,0,1|1,0,1]=4 8781 B15R1.119 CC(O)COCCCc1cccc(c1)N 34a_200000698965_100011218427 [0,1,0,0,0,1|1,0,1]=4 8782 B15R1.119 CC(O)COCCCc1cccc(c1)N 7a_200000698965_100011218427 [0,1,0,0,0,1|1,0,1]=4 8783 B15R1.119 CC(O)CSCCCc1cccc(c1)Br 62a_100011218427_100011713683 [0,1,0,0,0,1|1,0,1]=4 8784 B15R1.119 CC(O)CSCCCc1cccc(c1)Br 62a_100011713683_100011218427 [0,1,0,0,0,1|1,0,1]=4 8785 B15R1.119 CC(O)CSCCCc1cccc(c1)F 62a_100011218427_200000698031 [0,1,0,0,0,1|1,0,1]=4 8786 B15R1.119 CC(O)CSCCCc1cccc(c1)F 62a_200000698031_100011218427 [0,1,0,0,0,1|1,0,1]=4 8787 B15R1.119 CS(=O)CCCNCc1cccc(c1)Br 207a_200000753449_100000210085 [0,1,0,0,0,1|2,0,0]=4 8788 B15R1.119 CS(=O)CCCNCc1cccc(c1)Br 2230a_200000753449_100000698116 [0,1,0,0,0,1|2,0,0]=4 8789 B15R1.119 CS(=O)CCCNCc1cccc(c1)Br 270004a_200000753449_100000210085 [0,1,0,0,0,1|2,0,0]=4 8790 B15R1.119 CS(=O)CCCNCc1cccc(c1)Cl 207a_200000753449_100000210801 [0,1,0,0,0,1|2,0,0]=4 8791 B15R1.119 CS(=O)CCCNCc1cccc(c1)Cl 2230a_200000753449_100000181238 [0,1,0,0,0,1|2,0,0]=4 8792 B15R1.119 CS(=O)CCCNCc1cccc(c1)Cl 270004a_200000753449_100000210801 [0,1,0,0,0,1|2,0,0]=4 8793 B15R1.119 CS(=O)CCCNCc1cccc(c1)F 207a_200000753449_100000210812 [0,1,0,0,0,1|2,0,0]=4 8794 B15R1.119 CS(=O)CCCNCc1cccc(c1)F 2230a_200000753449_100000230114 [0,1,0,0,0,1|2,0,0]=4 8795 B15R1.119 CS(=O)CCCNCc1cccc(c1)F 270004a_200000753449_100000210812 [0,1,0,0,0,1|2,0,0]=4 8796 B15R1.119 CS(=O)CCCNCc1cccc(c1)I 207a_200000753449_100000014684 [0,1,0,0,0,1|2,0,0]=4 8797 B15R1.119 CS(=O)CCCNCc1cccc(c1)I 2230a_200000753449_100011218688 [0,1,0,0,0,1|2,0,0]=4 8798 B15R1.119 CS(=O)CCCNCc1cccc(c1)I 270004a_200000753449_100000014684 [0,1,0,0,0,1|2,0,0]=4 8799 B15R1.119 CS(=O)CCCNCc1cccc(c1)O 207a_200000753449_100000188321 [0,1,0,0,0,1|2,0,0]=4 8800 B15R1.119 CS(=O)CCCNCc1cccc(c1)O 2230a_200000753449_100011660834 [0,1,0,0,0,1|2,0,0]=4 8801 B15R1.119 CS(=O)CCCNCc1cccc(c1)O 270004a_200000753449_100000188321 [0,1,0,0,0,1|2,0,0]=4 8802 B15R1.119 C[C@@H](O)CNCCCc1cccc(c1)Br 2230a_100000753791_100009817552 [0,1,0,0,0,1|1,0,1]=4 8803 B15R1.119 C[C@@H](O)CNCCCc1cccc(c1)Br 34a_100000753791_100009817552 [0,1,0,0,0,1|1,0,1]=4 8804 B15R1.119 C[C@@H](O)CNCCCc1cccc(c1)Cl 2230a_100000704586_100009817552 [0,1,0,0,0,1|1,0,1]=4 8805 B15R1.119 C[C@@H](O)CNCCCc1cccc(c1)Cl 34a_100000704586_100009817552 [0,1,0,0,0,1|1,0,1]=4 8806 B15R1.119 C[C@@H](O)CNCCCc1cccc(c1)F 2230a_100000754185_100009817552 [0,1,0,0,0,1|1,0,1]=4 8807 B15R1.119 C[C@@H](O)CNCCCc1cccc(c1)F 34a_100000754185_100009817552 [0,1,0,0,0,1|1,0,1]=4 8808 B15R1.119 C[C@@H](O)COCCCc1cccc(c1)Br 34a_100011709248_100009817552 [0,1,0,0,0,1|1,0,1]=4 8809 B15R1.119 C[C@@H](O)COCCCc1cccc(c1)Br 7a_100011709248_100009817552 [0,1,0,0,0,1|1,0,1]=4 8810 B15R1.119 C[C@@H](O)COCCCc1cccc(c1)Cl 34a_100011709246_100009817552 [0,1,0,0,0,1|1,0,1]=4 8811 B15R1.119 C[C@@H](O)COCCCc1cccc(c1)Cl 7a_100011709246_100009817552 [0,1,0,0,0,1|1,0,1]=4 8812 B15R1.119 C[C@@H](O)COCCCc1cccc(c1)N 34a_200000698965_100009817552 [0,1,0,0,0,1|1,0,1]=4 8813 B15R1.119 C[C@@H](O)COCCCc1cccc(c1)N 7a_200000698965_100009817552 [0,1,0,0,0,1|1,0,1]=4 8814 B15R1.119 C[C@@H](O)CSCCCc1cccc(c1)Br 62a_100009817552_100011713683 [0,1,0,0,0,1|1,0,1]=4 8815 B15R1.119 C[C@@H](O)CSCCCc1cccc(c1)Br 62a_100011713683_100009817552 [0,1,0,0,0,1|1,0,1]=4 8816 B15R1.119 C[C@@H](O)CSCCCc1cccc(c1)F 62a_100009817552_200000698031 [0,1,0,0,0,1|1,0,1]=4 8817 B15R1.119 C[C@@H](O)CSCCCc1cccc(c1)F 62a_200000698031_100009817552 [0,1,0,0,0,1|1,0,1]=4 8818 B15R1.119 Cc1cc(ccn1)CNCCCC(=O)N 34a_100000739312_200020672517 [0,1,0,0,0,1|2,0,0]=4 8819 B15R1.119 Cc1cc(ccn1)CNCCCC(=O)N 34a_100011934566_100102525003 [0,1,0,0,0,1|2,0,0]=4 8820 B15R1.119 Cc1cc(ccn1)COCCCC(=O)N 34a_100011998630_100102525003 [0,1,0,0,0,1|2,0,0]=4 8821 B15R1.119 Cc1cc(ccn1)CSCCCC(=O)N 62a_100102525003_200020672517 [0,1,0,0,0,1|2,0,0]=4 8822 B15R1.119 Cc1cc(ccn1)CSCCCC(=O)N 62a_200020672517_100102525003 [0,1,0,0,0,1|2,0,0]=4 8823 B15R1.119 Cc1cccc(c1)CCCNCC(=O)N 2230a_103496528808_100000747473 [0,1,0,0,0,1|1,0,0]=3 8824 B15R1.119 Cc1cccc(c1)CCCNCC(=O)N 34a_103496528808_100000187820 [0,1,0,0,0,1|1,0,0]=3 8825 B15R1.119 Cc1cccc(c1)CCCNCC(=O)[O-] 34a_103496528808_100020667443 [0,1,0,0,0,1|0,0,1]=3 8826 B15R1.119 Cc1cccc(c1)CCCNCC(C)O 2230a_103496528808_100011218427 [0,1,0,0,0,1|1,0,1]=4 8827 B15R1.119 Cc1cccc(c1)CCCNCC(C)O 34a_103496528808_100011218427 [0,1,0,0,0,1|1,0,1]=4 8828 B15R1.119 Cc1cccc(c1)CCCNC[C@@H](C)O 2230a_103496528808_100009817552 [0,1,0,0,0,1|1,0,1]=4 8829 B15R1.119 Cc1cccc(c1)CCCNC[C@@H](C)O 34a_103496528808_100009817552 [0,1,0,0,0,1|1,0,1]=4 8830 B15R1.119 Cc1cccc(c1)CCCNC[N+](=O)[O-] 34a_103496528808_100000761209 [0,1,0,0,0,1|1,0,1]=4 8831 B15R1.119 Cc1cccc(c1)CCNCCC(=O)N 2230a_100000749837_100000744528 [0,1,0,0,0,1|1,0,0]=3 8832 B15R1.119 Cc1cccc(c1)CCNCCC(=O)N 34a_100000749837_100000731001 [0,1,0,0,0,1|1,0,0]=3 8833 B15R1.119 Cc1cccc(c1)CCNCCC(C)O 2230a_100000749837_100012276601 [0,1,0,0,0,1|1,0,1]=4 8834 B15R1.119 Cc1cccc(c1)CCNCCC(C)O 2230a_200000755665_100011713685 [0,1,0,0,0,1|1,0,1]=4 8835 B15R1.119 Cc1cccc(c1)CCNCCC(C)O 34a_100000749837_100012276601 [0,1,0,0,0,1|1,0,1]=4 8836 B15R1.119 Cc1cccc(c1)CCNOCC(=O)O 269956a_100000106656_100011713685 [0,1,0,0,0,1|1,0,0]=3 8837 B15R1.119 Cc1cccc(c1)CCOCCC(=O)N 34a_100000757172_100011713685 [0,1,0,0,0,1|1,0,0]=3 8838 B15R1.119 Cc1cccc(c1)CCOCCC(=O)N 34a_100011217157_100000731001 [0,1,0,0,0,1|1,0,0]=3 8839 B15R1.119 Cc1cccc(c1)CCOCCC(=O)N 7a_100000757172_100011713685 [0,1,0,0,0,1|1,0,0]=3 8840 B15R1.119 Cc1cccc(c1)CCOCCC(=O)N 7a_100011217157_100000744528 [0,1,0,0,0,1|1,0,0]=3 8841 B15R1.119 Cc1cccc(c1)CCOCCC(C)O 34a_100011217157_100012276601 [0,1,0,0,0,1|1,0,1]=4 8842 B15R1.119 Cc1cccc(c1)CCOCCC(C)O 7a_100011217157_100012276601 [0,1,0,0,0,1|1,0,1]=4 8843 B15R1.119 Cc1cccc(c1)CCSCCC(=O)N 62a_100000744528_100011713685 [0,1,0,0,0,1|1,0,0]=3 8844 B15R1.119 Cc1cccc(c1)CCSCCC(=O)N 62a_100011713685_100000744528 [0,1,0,0,0,1|1,0,0]=3 8845 B15R1.119 Cc1cccc(c1)CCSCCC(C)O 62a_100011713685_100012276601 [0,1,0,0,0,1|1,0,1]=4 8846 B15R1.119 Cc1cccc(c1)CCSCCC(C)O 62a_100012276601_100011713685 [0,1,0,0,0,1|1,0,1]=4 8847 B15R1.119 Cc1cccc(c1)CNCCCC(=O)N 34a_100000185548_100102525003 [0,1,0,0,0,1|1,0,0]=3 8848 B15R1.119 Cc1cccc(c1)CNCCCC(=O)N 34a_100000739312_100000211840 [0,1,0,0,0,1|1,0,0]=3 8849 B15R1.119 Cc1cccc(c1)CNCCCC(C)O 2230a_100000185548_200000718107 [0,1,0,0,0,1|1,0,1]=4 8850 B15R1.119 Cc1cccc(c1)CNCCCC(C)O 34a_100000185548_200000718107 [0,1,0,0,0,1|1,0,1]=4 8851 B15R1.119 Cc1cccc(c1)CNCCCS(=O)C 207a_200000753449_100000211157 [0,1,0,0,0,1|2,0,0]=4 8852 B15R1.119 Cc1cccc(c1)CNCCCS(=O)C 2230a_200000753449_100000211840 [0,1,0,0,0,1|2,0,0]=4 8853 B15R1.119 Cc1cccc(c1)CNCCCS(=O)C 270004a_200000753449_100000211157 [0,1,0,0,0,1|2,0,0]=4 8854 B15R1.119 Cc1cccc(c1)CNCCNC(=O)N 207a_100020590234_100000211157 [0,1,0,0,0,1|2,0,0]=4 8855 B15R1.119 Cc1cccc(c1)CNCCNC(=O)N 2230a_100000185548_200000034859 [0,1,0,0,0,1|2,0,0]=4 8856 B15R1.119 Cc1cccc(c1)CNCCNC(=O)N 34a_100020590234_100000211840 [0,1,0,0,0,1|2,0,0]=4 8857 B15R1.119 Cc1cccc(c1)CNCCOC(=O)N 34a_100000185548_200011214921 [0,1,0,0,0,1|2,0,0]=4 8858 B15R1.119 Cc1cccc(c1)COCCCC(=O)N 34a_100011217746_100102525003 [0,1,0,0,0,1|1,0,0]=3 8859 B15R1.119 Cc1cccc(c1)COCCCC(=O)N 7a_100011217746_100102525003 [0,1,0,0,0,1|1,0,0]=3 8860 B15R1.119 Cc1cccc(c1)COCCCC(C)O 34a_100011217746_200000718107 [0,1,0,0,0,1|1,0,1]=4 8861 B15R1.119 Cc1cccc(c1)COCCCC(C)O 7a_100011217746_200000718107 [0,1,0,0,0,1|1,0,1]=4 8862 B15R1.119 Cc1cccc(c1)COCCC[N+](=O)[O-] 34a_200000037920_100000211840 [0,1,0,0,0,1|1,0,1]=4 8863 B15R1.119 Cc1cccc(c1)COCCNC(=O)N 34a_100000181757_100000211840 [0,1,0,0,0,1|2,0,0]=4 8864 B15R1.119 Cc1cccc(c1)COCCNC(=O)N 7a_100011217746_200000034859 [0,1,0,0,0,1|2,0,0]=4 8865 B15R1.119 Cc1cccc(c1)COCCOC(=O)N 34a_100011217746_200011214921 [0,1,0,0,0,1|2,0,0]=4 8866 B15R1.119 Cc1cccc(c1)COCCOC(=O)N 7a_100000766696_100000211840 [0,1,0,0,0,1|2,0,0]=4 8867 B15R1.119 Cc1cccc(c1)COCCOC(=O)N 7a_100011217746_200011214921 [0,1,0,0,0,1|2,0,0]=4 8868 B15R1.119 Cc1cccc(c1)CSCCCC(=O)N 62a_100000211840_100102525003 [0,1,0,0,0,1|1,0,0]=3 8869 B15R1.119 Cc1cccc(c1)CSCCCC(=O)N 62a_100102525003_100000211840 [0,1,0,0,0,1|1,0,0]=3 8870 B15R1.119 Cc1cccc(c1)CSCCCC(C)O 62a_100000211840_200000718107 [0,1,0,0,0,1|1,0,1]=4 8871 B15R1.119 Cc1cccc(c1)CSCCCC(C)O 62a_200000718107_100000211840 [0,1,0,0,0,1|1,0,1]=4 8872 B15R1.119 Cc1cccc(c1)CSCCNC(=O)N 62a_100000211840_200000034859 [0,1,0,0,0,1|2,0,0]=4 8873 B15R1.119 Cc1cccc(c1)CSCCNC(=O)N 62a_200000034859_100000211840 [0,1,0,0,0,1|2,0,0]=4 8874 B15R1.119 Cc1cccc(c1)CSCCOC(=O)N 62a_100000211840_200011214921 [0,1,0,0,0,1|2,0,0]=4 8875 B15R1.119 Cc1cccc(c1)CSCCOC(=O)N 62a_200011214921_100000211840 [0,1,0,0,0,1|2,0,0]=4 8876 B15R1.119 Cc1cccc(c1)NCCCCB(O)O 2230a_100000188690_200009817182 [0,1,0,0,0,1|1,0,1]=4 8877 B15R1.119 Cc1cccc(c1)NCCCCB(O)O 34a_100000188690_200009817182 [0,1,0,0,0,1|1,0,1]=4 8878 B15R1.119 Cc1cccc(c1)NCCOCC(=O)N 2230a_100000188690_100000076697 [0,1,0,0,0,1|2,0,0]=4 8879 B15R1.119 Cc1cccc(c1)NCCOCC(=O)N 34a_100000188690_100000076697 [0,1,0,0,0,1|2,0,0]=4 8880 B15R1.119 Cc1cccc(c1)OCCCCB(O)O 34a_100000210337_200009817182 [0,1,0,0,0,1|1,0,1]=4 8881 B15R1.119 Cc1cccc(c1)OCCCCB(O)O 7a_100000210337_200009817182 [0,1,0,0,0,1|1,0,1]=4 8882 B15R1.119 Cc1cccc(c1)OCCCCC(=O)[13CH3] 1458a_100000745151_200025704644 [0,1,0,0,0,1|1,0,0]=3 8883 B15R1.119 Cc1cccc(c1)OCCNCC(=O)N 2230a_100015185188_100000747473 [0,1,0,0,0,1|2,0,0]=4 8884 B15R1.119 Cc1cccc(c1)OCCNCC(=O)N 34a_100015185188_100000187820 [0,1,0,0,0,1|2,0,0]=4 8885 B15R1.119 Cc1cccc(c1)OCCNCC(=O)[O-] 34a_100015185188_100020667443 [0,1,0,0,0,1|1,0,1]=4 8886 B15R1.119 Cc1cccc(c1)OCCOCC(=O)N 34a_100000210337_100000076697 [0,1,0,0,0,1|2,0,0]=4 8887 B15R1.119 Cc1cccc(c1)OCCOCC(=O)N 34a_200011215094_100000187820 [0,1,0,0,0,1|2,0,0]=4 8888 B15R1.119 Cc1cccc(c1)OCCOCC(=O)N 7a_100000210337_100000076697 [0,1,0,0,0,1|2,0,0]=4 8889 B15R1.119 Cc1cccc(c1)OCCOCC(=O)N 7a_200011215094_100000187820 [0,1,0,0,0,1|2,0,0]=4 8890 B15R1.119 Cc1cccc(c1)OCCOCC(=O)[O-] 34a_200011215094_100020667443 [0,1,0,0,0,1|1,0,1]=4 8891 B15R1.119 Cc1cccc(c1)SCCCCB(O)O 62a_100011215228_200009817182 [0,1,0,0,0,1|1,0,1]=4 8892 B15R1.119 Cc1cccc(c1)SCCCCB(O)O 62a_200009817182_100011215228 [0,1,0,0,0,1|1,0,1]=4 8893 B15R1.119 Cc1cccc(c1)SCCOCC(=O)N 34a_200011432187_100000187820 [0,1,0,0,0,1|2,0,0]=4 8894 B15R1.119 Cc1cccc(c1)SCCOCC(=O)N 62a_100000076697_100011215228 [0,1,0,0,0,1|2,0,0]=4 8895 B15R1.119 Cc1cccc(c1)SCCOCC(=O)N 62a_100011215228_100000076697 [0,1,0,0,0,1|2,0,0]=4 8896 B15R1.119 Cc1cccc(c1)SCCOCC(=O)N 7a_200011432187_100000187820 [0,1,0,0,0,1|2,0,0]=4 8897 B15R1.119 Cc1cccc(c1)SCCOCC(=O)[O-] 34a_200011432187_100020667443 [0,1,0,0,0,1|1,0,1]=4 8898 B15R1.119 Cc1cccc(n1)CCCOCC(=O)N 34a_100000211354_100000187820 [0,1,0,0,0,1|2,0,0]=4 8899 B15R1.119 Cc1cccc(n1)CCCOCC(=O)[O-] 34a_100000211354_100020667443 [0,1,0,0,0,1|1,0,1]=4 8900 B15R1.119 Cc1cccc(n1)CCNCCC(=O)N 2230a_100011824523_100000744528 [0,1,0,0,0,1|2,0,0]=4 8901 B15R1.119 Cc1cccc(n1)CCNCCC(=O)N 34a_100011824523_100000731001 [0,1,0,0,0,1|2,0,0]=4 8902 B15R1.119 Cc1cccc(n1)CNCCCC(=O)N 34a_100000701342_100102525003 [0,1,0,0,0,1|2,0,0]=4 8903 B15R1.119 Cc1cccc(n1)CNCCCC(=O)N 34a_100000739312_100000757606 [0,1,0,0,0,1|2,0,0]=4 8904 B15R1.119 Cc1cccc(n1)COCCCC(=O)N 34a_100000690600_100102525003 [0,1,0,0,0,1|2,0,0]=4 8905 B15R1.119 Cc1cccc(n1)CSCCCC(=O)N 62a_100000757606_100102525003 [0,1,0,0,0,1|2,0,0]=4 8906 B15R1.119 Cc1cccc(n1)CSCCCC(=O)N 62a_100102525003_100000757606 [0,1,0,0,0,1|2,0,0]=4 8907 B15R1.119 Cc1ccnc(c1)CNCCCC(=O)N 34a_100000739312_100000718516 [0,1,0,0,0,1|2,0,0]=4 8908 B15R1.119 Cc1ccnc(c1)COCCCC(=O)N 34a_100011998357_100102525003 [0,1,0,0,0,1|2,0,0]=4 8909 B15R1.119 Cc1ccnc(c1)CSCCCC(=O)N 62a_100000718516_100102525003 [0,1,0,0,0,1|2,0,0]=4 8910 B15R1.119 Cc1ccnc(c1)CSCCCC(=O)N 62a_100102525003_100000718516 [0,1,0,0,0,1|2,0,0]=4 8911 B15R1.119 Cc1cncc(c1)CNCCCC(=O)N 34a_100000692839_100102525003 [0,1,0,0,0,1|2,0,0]=4 8912 B15R1.119 Cc1cncc(c1)CNCCCC(=O)N 34a_100000739312_100000716715 [0,1,0,0,0,1|2,0,0]=4 8913 B15R1.119 Cc1cncc(c1)COCCCC(=O)N 34a_100011998709_100102525003 [0,1,0,0,0,1|2,0,0]=4 8914 B15R1.119 Cc1cncc(c1)COCCCC(=O)N 7a_100011998709_100102525003 [0,1,0,0,0,1|2,0,0]=4 8915 B15R1.119 Cc1cncc(c1)CSCCCC(=O)N 62a_100000716715_100102525003 [0,1,0,0,0,1|2,0,0]=4 8916 B15R1.119 Cc1cncc(c1)CSCCCC(=O)N 62a_100102525003_100000716715 [0,1,0,0,0,1|2,0,0]=4 8917 B15R1.119 NC(=O)CCCNCc1cc(ccn1)Br 34a_100000739312_100010173614 [0,1,0,0,0,1|2,0,0]=4 8918 B15R1.119 NC(=O)CCCNCc1cc(ccn1)Cl 34a_100000739312_100016988179 [0,1,0,0,0,1|2,0,0]=4 8919 B15R1.119 NC(=O)CCCNCc1cccc(c1)Br 34a_100000174977_100102525003 [0,1,0,0,0,1|1,0,0]=3 8920 B15R1.119 NC(=O)CCCNCc1cccc(c1)Br 34a_100000739312_100000698116 [0,1,0,0,0,1|1,0,0]=3 8921 B15R1.119 NC(=O)CCCNCc1cccc(c1)Cl 34a_100000174878_100102525003 [0,1,0,0,0,1|1,0,0]=3 8922 B15R1.119 NC(=O)CCCNCc1cccc(c1)Cl 34a_100000739312_100000187163 [0,1,0,0,0,1|1,0,0]=3 8923 B15R1.119 NC(=O)CCCNCc1cccc(c1)F 34a_100000174948_100102525003 [0,1,0,0,0,1|1,0,0]=3 8924 B15R1.119 NC(=O)CCCNCc1cccc(c1)F 34a_100000739312_100000187166 [0,1,0,0,0,1|1,0,0]=3 8925 B15R1.119 NC(=O)CCCNCc1cccc(c1)I 34a_100000106179_100102525003 [0,1,0,0,0,1|1,0,0]=3 8926 B15R1.119 NC(=O)CCCNCc1cccc(c1)I 34a_100000739312_100011218688 [0,1,0,0,0,1|1,0,0]=3 8927 B15R1.119 NC(=O)CCCNCc1cccc(c1)O 34a_100000739312_100011660834 [0,1,0,0,0,1|1,0,0]=3 8928 B15R1.119 NC(=O)CCCNCc1cccc(c1)O 34a_100000743036_100102525003 [0,1,0,0,0,1|1,0,0]=3 8929 B15R1.119 NC(=O)CCCNCc1cccc(n1)Br 34a_100000739312_100009889011 [0,1,0,0,0,1|2,0,0]=4 8930 B15R1.119 NC(=O)CCCNCc1cccc(n1)Cl 34a_100000739312_100000086093 [0,1,0,0,0,1|2,0,0]=4 8931 B15R1.119 NC(=O)CCCNCc1cccc(n1)F 34a_100000739312_100009819644 [0,1,0,0,0,1|2,0,0]=4 8932 B15R1.119 NC(=O)CCCNCc1cccc(n1)F 34a_100015188798_100102525003 [0,1,0,0,0,1|2,0,0]=4 8933 B15R1.119 NC(=O)CCCNCc1ccnc(c1)Br 34a_100000739312_100010243470 [0,1,0,0,0,1|2,0,0]=4 8934 B15R1.119 NC(=O)CCCNCc1ccnc(c1)Br 34a_100025757509_100102525003 [0,1,0,0,0,1|2,0,0]=4 8935 B15R1.119 NC(=O)CCCNCc1ccnc(c1)Cl 34a_100000739312_100000764220 [0,1,0,0,0,1|2,0,0]=4 8936 B15R1.119 NC(=O)CCCNCc1ccnc(c1)Cl 34a_100015205668_100102525003 [0,1,0,0,0,1|2,0,0]=4 8937 B15R1.119 NC(=O)CCCNCc1ccnc(c1)F 34a_100015188774_100102525003 [0,1,0,0,0,1|2,0,0]=4 8938 B15R1.119 NC(=O)CCCNCc1cncc(c1)Br 34a_100000739312_100000738771 [0,1,0,0,0,1|2,0,0]=4 8939 B15R1.119 NC(=O)CCCNCc1cncc(c1)Cl 34a_100000739312_100016992070 [0,1,0,0,0,1|2,0,0]=4 8940 B15R1.119 NC(=O)CCCNCc1cncc(c1)F 34a_100000739312_100000725299 [0,1,0,0,0,1|2,0,0]=4 8941 B15R1.119 NC(=O)CCCNCc1cncc(c1)F 34a_100011962886_100102525003 [0,1,0,0,0,1|2,0,0]=4 8942 B15R1.119 NC(=O)CCCOCc1cc(ccn1)Cl 34a_100000748867_100102525003 [0,1,0,0,0,1|2,0,0]=4 8943 B15R1.119 NC(=O)CCCOCc1cc(ccn1)N 34a_100000692640_100102525003 [0,1,0,0,0,1|2,0,0]=4 8944 B15R1.119 NC(=O)CCCOCc1ccc[n+](c1)[O-] 34a_100000037817_100102525003 [0,1,0,0,0,1|2,0,0]=4 8945 B15R1.119 NC(=O)CCCOCc1ccc[n+](c1)[O-] 7a_100000037817_100102525003 [0,1,0,0,0,1|2,0,0]=4 8946 B15R1.119 NC(=O)CCCOCc1cccc(c1)Br 34a_100000687537_100102525003 [0,1,0,0,0,1|1,0,0]=3 8947 B15R1.119 NC(=O)CCCOCc1cccc(c1)Br 7a_100000687537_100102525003 [0,1,0,0,0,1|1,0,0]=3 8948 B15R1.119 NC(=O)CCCOCc1cccc(c1)Cl 34a_100000241301_100102525003 [0,1,0,0,0,1|1,0,0]=3 8949 B15R1.119 NC(=O)CCCOCc1cccc(c1)Cl 7a_100000241301_100102525003 [0,1,0,0,0,1|1,0,0]=3 8950 B15R1.119 NC(=O)CCCOCc1cccc(c1)F 34a_100000210976_100102525003 [0,1,0,0,0,1|1,0,0]=3 8951 B15R1.119 NC(=O)CCCOCc1cccc(c1)F 7a_100000210976_100102525003 [0,1,0,0,0,1|1,0,0]=3 8952 B15R1.119 NC(=O)CCCOCc1cccc(c1)I 34a_100011215336_100102525003 [0,1,0,0,0,1|1,0,0]=3 8953 B15R1.119 NC(=O)CCCOCc1cccc(c1)I 7a_100011215336_100102525003 [0,1,0,0,0,1|1,0,0]=3 8954 B15R1.119 NC(=O)CCCOCc1cccc(c1)N 34a_100000211919_100102525003 [0,1,0,0,0,1|1,0,0]=3 8955 B15R1.119 NC(=O)CCCOCc1cccc(n1)Br 34a_100000694195_100102525003 [0,1,0,0,0,1|2,0,0]=4 8956 B15R1.119 NC(=O)CCCOCc1cccc(n1)Cl 34a_100011998359_100102525003 [0,1,0,0,0,1|2,0,0]=4 8957 B15R1.119 NC(=O)CCCOCc1cccc(n1)F 34a_100000086748_100102525003 [0,1,0,0,0,1|2,0,0]=4 8958 B15R1.119 NC(=O)CCCOCc1ccnc(c1)Br 34a_100009814636_100102525003 [0,1,0,0,0,1|2,0,0]=4 8959 B15R1.119 NC(=O)CCCOCc1ccnc(c1)Br 7a_100009814636_100102525003 [0,1,0,0,0,1|2,0,0]=4 8960 B15R1.119 NC(=O)CCCOCc1ccnc(c1)Cl 34a_100000748751_100102525003 [0,1,0,0,0,1|2,0,0]=4 8961 B15R1.119 NC(=O)CCCOCc1ccnc(c1)F 34a_100000082451_100102525003 [0,1,0,0,0,1|2,0,0]=4 8962 B15R1.119 NC(=O)CCCOCc1cncc(c1)Br 34a_100011259137_100102525003 [0,1,0,0,0,1|2,0,0]=4 8963 B15R1.119 NC(=O)CCCOCc1cncc(c1)Br 7a_100011259137_100102525003 [0,1,0,0,0,1|2,0,0]=4 8964 B15R1.119 NC(=O)CCCOCc1cncc(c1)Cl 34a_100000092867_100102525003 [0,1,0,0,0,1|2,0,0]=4 8965 B15R1.119 NC(=O)CCCOCc1cncc(c1)Cl 7a_100000092867_100102525003 [0,1,0,0,0,1|2,0,0]=4 8966 B15R1.119 NC(=O)CCCOCc1cncc(c1)F 34a_100011962875_100102525003 [0,1,0,0,0,1|2,0,0]=4 8967 B15R1.119 NC(=O)CCCOCc1cncc(c1)F 7a_100011962875_100102525003 [0,1,0,0,0,1|2,0,0]=4 8968 B15R1.119 NC(=O)CCCOCc1cncc(c1)N 34a_100000085308_100102525003 [0,1,0,0,0,1|2,0,0]=4 8969 B15R1.119 NC(=O)CCCSCc1cc(ccn1)Br 62a_100010173614_100102525003 [0,1,0,0,0,1|2,0,0]=4 8970 B15R1.119 NC(=O)CCCSCc1cc(ccn1)Br 62a_100102525003_100010173614 [0,1,0,0,0,1|2,0,0]=4 8971 B15R1.119 NC(=O)CCCSCc1cc(ccn1)Cl 62a_100016988179_100102525003 [0,1,0,0,0,1|2,0,0]=4 8972 B15R1.119 NC(=O)CCCSCc1cc(ccn1)Cl 62a_100102525003_100016988179 [0,1,0,0,0,1|2,0,0]=4 8973 B15R1.119 NC(=O)CCCSCc1cccc(c1)Br 62a_100000211773_100102525003 [0,1,0,0,0,1|1,0,0]=3 8974 B15R1.119 NC(=O)CCCSCc1cccc(c1)Br 62a_100102525003_100000211773 [0,1,0,0,0,1|1,0,0]=3 8975 B15R1.119 NC(=O)CCCSCc1cccc(c1)Cl 62a_100000187163_100102525003 [0,1,0,0,0,1|1,0,0]=3 8976 B15R1.119 NC(=O)CCCSCc1cccc(c1)Cl 62a_100102525003_100000187163 [0,1,0,0,0,1|1,0,0]=3 8977 B15R1.119 NC(=O)CCCSCc1cccc(c1)F 62a_100000230114_100102525003 [0,1,0,0,0,1|1,0,0]=3 8978 B15R1.119 NC(=O)CCCSCc1cccc(c1)F 62a_100102525003_100000230114 [0,1,0,0,0,1|1,0,0]=3 8979 B15R1.119 NC(=O)CCCSCc1cccc(c1)I 62a_100011218688_100102525003 [0,1,0,0,0,1|1,0,0]=3 8980 B15R1.119 NC(=O)CCCSCc1cccc(c1)I 62a_100102525003_100011218688 [0,1,0,0,0,1|1,0,0]=3 8981 B15R1.119 NC(=O)CCCSCc1cccc(c1)O 62a_100011660834_100102525003 [0,1,0,0,0,1|1,0,0]=3 8982 B15R1.119 NC(=O)CCCSCc1cccc(c1)O 62a_100102525003_100011660834 [0,1,0,0,0,1|1,0,0]=3 8983 B15R1.119 NC(=O)CCCSCc1cccc(n1)Br 62a_100009889011_100102525003 [0,1,0,0,0,1|2,0,0]=4 8984 B15R1.119 NC(=O)CCCSCc1cccc(n1)Br 62a_100102525003_100009889011 [0,1,0,0,0,1|2,0,0]=4 8985 B15R1.119 NC(=O)CCCSCc1cccc(n1)Cl 62a_100000086093_100102525003 [0,1,0,0,0,1|2,0,0]=4 8986 B15R1.119 NC(=O)CCCSCc1cccc(n1)Cl 62a_100102525003_100000086093 [0,1,0,0,0,1|2,0,0]=4 8987 B15R1.119 NC(=O)CCCSCc1cccc(n1)F 62a_100009819644_100102525003 [0,1,0,0,0,1|2,0,0]=4 8988 B15R1.119 NC(=O)CCCSCc1cccc(n1)F 62a_100102525003_100009819644 [0,1,0,0,0,1|2,0,0]=4 8989 B15R1.119 NC(=O)CCCSCc1ccnc(c1)Br 62a_100010254460_100102525003 [0,1,0,0,0,1|2,0,0]=4 8990 B15R1.119 NC(=O)CCCSCc1ccnc(c1)Br 62a_100102525003_100010243470 [0,1,0,0,0,1|2,0,0]=4 8991 B15R1.119 NC(=O)CCCSCc1ccnc(c1)Cl 62a_100000764220_100102525003 [0,1,0,0,0,1|2,0,0]=4 8992 B15R1.119 NC(=O)CCCSCc1ccnc(c1)Cl 62a_100102525003_100000764220 [0,1,0,0,0,1|2,0,0]=4 8993 B15R1.119 NC(=O)CCCSCc1cncc(c1)Br 62a_100000738771_100102525003 [0,1,0,0,0,1|2,0,0]=4 8994 B15R1.119 NC(=O)CCCSCc1cncc(c1)Br 62a_100102525003_100000738771 [0,1,0,0,0,1|2,0,0]=4 8995 B15R1.119 NC(=O)CCCSCc1cncc(c1)Cl 62a_100016992070_100102525003 [0,1,0,0,0,1|2,0,0]=4 8996 B15R1.119 NC(=O)CCCSCc1cncc(c1)Cl 62a_100102525003_100016992070 [0,1,0,0,0,1|2,0,0]=4 8997 B15R1.119 NC(=O)CCCSCc1cncc(c1)F 62a_100000725299_100102525003 [0,1,0,0,0,1|2,0,0]=4 8998 B15R1.119 NC(=O)CCCSCc1cncc(c1)F 62a_100102525003_100000725299 [0,1,0,0,0,1|2,0,0]=4 8999 B15R1.119 NC(=O)CCNCCc1cccc(c1)Br 2230a_100011207229_100000744528 [0,1,0,0,0,1|1,0,0]=3 9000 B15R1.119 NC(=O)CCNCCc1cccc(c1)Br 34a_100011207229_100000731001 [0,1,0,0,0,1|1,0,0]=3 9001 B15R1.119 NC(=O)CCNCCc1cccc(c1)Cl 2230a_100000185263_100000744528 [0,1,0,0,0,1|1,0,0]=3 9002 B15R1.119 NC(=O)CCNCCc1cccc(c1)Cl 34a_100000185263_100000731001 [0,1,0,0,0,1|1,0,0]=3 9003 B15R1.119 NC(=O)CCNCCc1cccc(c1)F 2230a_100000205154_100000744528 [0,1,0,0,0,1|1,0,0]=3 9004 B15R1.119 NC(=O)CCNCCc1cccc(c1)F 34a_100000205154_100000731001 [0,1,0,0,0,1|1,0,0]=3 9005 B15R1.119 NC(=O)CCNCCc1cccc(c1)O 2230a_100000747277_100000744528 [0,1,0,0,0,1|1,0,0]=3 9006 B15R1.119 NC(=O)CCNCCc1cccc(c1)O 34a_100000747277_100000731001 [0,1,0,0,0,1|1,0,0]=3 9007 B15R1.119 NC(=O)CCOCCc1cccc(c1)Br 34a_100000757172_100011740638 [0,1,0,0,0,1|1,0,0]=3 9008 B15R1.119 NC(=O)CCOCCc1cccc(c1)Br 34a_100011217444_100000731001 [0,1,0,0,0,1|1,0,0]=3 9009 B15R1.119 NC(=O)CCOCCc1cccc(c1)Br 7a_100000757172_100011740638 [0,1,0,0,0,1|1,0,0]=3 9010 B15R1.119 NC(=O)CCOCCc1cccc(c1)Br 7a_100011217444_100000744528 [0,1,0,0,0,1|1,0,0]=3 9011 B15R1.119 NC(=O)CCOCCc1cccc(c1)Cl 34a_100000754733_100000731001 [0,1,0,0,0,1|1,0,0]=3 9012 B15R1.119 NC(=O)CCOCCc1cccc(c1)Cl 34a_100000757172_100011713710 [0,1,0,0,0,1|1,0,0]=3 9013 B15R1.119 NC(=O)CCOCCc1cccc(c1)Cl 7a_100000754733_100000744528 [0,1,0,0,0,1|1,0,0]=3 9014 B15R1.119 NC(=O)CCOCCc1cccc(c1)Cl 7a_100000757172_100011713710 [0,1,0,0,0,1|1,0,0]=3 9015 B15R1.119 NC(=O)CCOCCc1cccc(c1)F 34a_100000757172_100011217235 [0,1,0,0,0,1|1,0,0]=3 9016 B15R1.119 NC(=O)CCOCCc1cccc(c1)F 34a_100000763591_100000731001 [0,1,0,0,0,1|1,0,0]=3 9017 B15R1.119 NC(=O)CCOCCc1cccc(c1)F 7a_100000757172_100011217235 [0,1,0,0,0,1|1,0,0]=3 9018 B15R1.119 NC(=O)CCOCCc1cccc(c1)F 7a_100000763591_100000744528 [0,1,0,0,0,1|1,0,0]=3 9019 B15R1.119 NC(=O)CCOCCc1cccc(c1)N 34a_100011996697_100000731001 [0,1,0,0,0,1|1,0,0]=3 9020 B15R1.119 NC(=O)CCOCCc1cccc(n1)Br 34a_100010221043_100000731001 [0,1,0,0,0,1|2,0,0]=4 9021 B15R1.119 NC(=O)CCOCCc1cccc(n1)Br 7a_100010221043_100000744528 [0,1,0,0,0,1|2,0,0]=4 9022 B15R1.119 NC(=O)CCSCCc1cccc(c1)Br 62a_100000744528_100011740638 [0,1,0,0,0,1|1,0,0]=3 9023 B15R1.119 NC(=O)CCSCCc1cccc(c1)Br 62a_100011740638_100000744528 [0,1,0,0,0,1|1,0,0]=3 9024 B15R1.119 NC(=O)CCSCCc1cccc(c1)Cl 62a_100000744528_100011713710 [0,1,0,0,0,1|1,0,0]=3 9025 B15R1.119 NC(=O)CCSCCc1cccc(c1)Cl 62a_100011713710_100000744528 [0,1,0,0,0,1|1,0,0]=3 9026 B15R1.119 NC(=O)CCSCCc1cccc(c1)F 62a_100000744528_100011217235 [0,1,0,0,0,1|1,0,0]=3 9027 B15R1.119 NC(=O)CCSCCc1cccc(c1)F 62a_100011217235_100000744528 [0,1,0,0,0,1|1,0,0]=3 9028 B15R1.119 NC(=O)CNCCCc1cccc(c1)Br 2230a_100000711301_100011713683 [0,1,0,0,0,1|1,0,0]=3 9029 B15R1.119 NC(=O)CNCCCc1cccc(c1)Br 2230a_100000753791_100000747473 [0,1,0,0,0,1|1,0,0]=3 9030 B15R1.119 NC(=O)CNCCCc1cccc(c1)Br 34a_100000753791_100000187820 [0,1,0,0,0,1|1,0,0]=3 9031 B15R1.119 NC(=O)CNCCCc1cccc(c1)Cl 2230a_100000704586_100000747473 [0,1,0,0,0,1|1,0,0]=3 9032 B15R1.119 NC(=O)CNCCCc1cccc(c1)Cl 34a_100000704586_100000187820 [0,1,0,0,0,1|1,0,0]=3 9033 B15R1.119 NC(=O)CNCCCc1cccc(c1)F 2230a_100000711301_200000698031 [0,1,0,0,0,1|1,0,0]=3 9034 B15R1.119 NC(=O)CNCCCc1cccc(c1)F 2230a_100000754185_100000747473 [0,1,0,0,0,1|1,0,0]=3 9035 B15R1.119 NC(=O)CNCCCc1cccc(c1)F 34a_100000754185_100000187820 [0,1,0,0,0,1|1,0,0]=3 9036 B15R1.119 NC(=O)CNCCOc1cccc(c1)Br 2230a_100000711301_100000183150 [0,1,0,0,0,1|2,0,0]=4 9037 B15R1.119 NC(=O)CNCCOc1cccc(c1)Br 2230a_100000743521_100000747473 [0,1,0,0,0,1|2,0,0]=4 9038 B15R1.119 NC(=O)CNCCOc1cccc(c1)Br 34a_100000743521_100000187820 [0,1,0,0,0,1|2,0,0]=4 9039 B15R1.119 NC(=O)CNCCOc1cccc(c1)Cl 2230a_100000711301_100000181161 [0,1,0,0,0,1|2,0,0]=4 9040 B15R1.119 NC(=O)CNCCOc1cccc(c1)Cl 2230a_100000740232_100000747473 [0,1,0,0,0,1|2,0,0]=4 9041 B15R1.119 NC(=O)CNCCOc1cccc(c1)Cl 34a_100000740232_100000187820 [0,1,0,0,0,1|2,0,0]=4 9042 B15R1.119 NC(=O)CNCCOc1cccc(c1)F 2230a_100000711301_100000739188 [0,1,0,0,0,1|2,0,0]=4 9043 B15R1.119 NC(=O)CNCCOc1cccc(c1)F 2230a_100000738948_100000747473 [0,1,0,0,0,1|2,0,0]=4 9044 B15R1.119 NC(=O)CNCCOc1cccc(c1)F 34a_100000738948_100000187820 [0,1,0,0,0,1|2,0,0]=4 9045 B15R1.119 NC(=O)COCCCc1cccc(c1)Br 34a_100011709248_100000187820 [0,1,0,0,0,1|1,0,0]=3 9046 B15R1.119 NC(=O)COCCCc1cccc(c1)Br 7a_100011709248_100000187820 [0,1,0,0,0,1|1,0,0]=3 9047 B15R1.119 NC(=O)COCCCc1cccc(c1)Cl 34a_100011709246_100000187820 [0,1,0,0,0,1|1,0,0]=3 9048 B15R1.119 NC(=O)COCCCc1cccc(c1)Cl 7a_100011709246_100000187820 [0,1,0,0,0,1|1,0,0]=3 9049 B15R1.119 NC(=O)COCCCc1cccc(c1)N 34a_200000698965_100000187820 [0,1,0,0,0,1|1,0,0]=3 9050 B15R1.119 NC(=O)COCCCc1cccc(c1)N 7a_200000698965_100000187820 [0,1,0,0,0,1|1,0,0]=3 9051 B15R1.119 NC(=O)COCCNc1cccc(c1)Br 34a_100000210019_100000076697 [0,1,0,0,0,1|2,0,0]=4 9052 B15R1.119 NC(=O)COCCNc1cccc(c1)Cl 34a_100000185859_100000076697 [0,1,0,0,0,1|2,0,0]=4 9053 B15R1.119 NC(=O)COCCNc1cccc(c1)F 34a_100000210047_100000076697 [0,1,0,0,0,1|2,0,0]=4 9054 B15R1.119 NC(=O)COCCNc1cccc(c1)I 34a_100000211102_100000076697 [0,1,0,0,0,1|2,0,0]=4 9055 B15R1.119 NC(=O)COCCNc1cccc(c1)O 34a_100000210217_100000076697 [0,1,0,0,0,1|2,0,0]=4 9056 B15R1.119 NC(=O)COCCOc1cccc(c1)Br 34a_100000210342_100000076697 [0,1,0,0,0,1|2,0,0]=4 9057 B15R1.119 NC(=O)COCCOc1cccc(c1)Br 34a_100000757546_100000187820 [0,1,0,0,0,1|2,0,0]=4 9058 B15R1.119 NC(=O)COCCOc1cccc(c1)Br 7a_100000210342_100000076697 [0,1,0,0,0,1|2,0,0]=4 9059 B15R1.119 NC(=O)COCCOc1cccc(c1)Br 7a_100000757546_100000187820 [0,1,0,0,0,1|2,0,0]=4 9060 B15R1.119 NC(=O)COCCOc1cccc(c1)Cl 34a_100000210295_100000076697 [0,1,0,0,0,1|2,0,0]=4 9061 B15R1.119 NC(=O)COCCOc1cccc(c1)Cl 34a_100000230539_100000187820 [0,1,0,0,0,1|2,0,0]=4 9062 B15R1.119 NC(=O)COCCOc1cccc(c1)Cl 7a_100000210295_100000076697 [0,1,0,0,0,1|2,0,0]=4 9063 B15R1.119 NC(=O)COCCOc1cccc(c1)Cl 7a_100000230539_100000187820 [0,1,0,0,0,1|2,0,0]=4 9064 B15R1.119 NC(=O)COCCOc1cccc(c1)F 34a_100000210426_100000076697 [0,1,0,0,0,1|2,0,0]=4 9065 B15R1.119 NC(=O)COCCOc1cccc(c1)F 7a_100000210426_100000076697 [0,1,0,0,0,1|2,0,0]=4 9066 B15R1.119 NC(=O)COCCOc1cccc(c1)I 34a_100000211634_100000076697 [0,1,0,0,0,1|2,0,0]=4 9067 B15R1.119 NC(=O)COCCOc1cccc(c1)I 7a_100000211634_100000076697 [0,1,0,0,0,1|2,0,0]=4 9068 B15R1.119 NC(=O)COCCOc1cccc(c1)N 34a_100000210217_100000076697 [0,1,0,0,0,1|2,0,0]=4 9069 B15R1.119 NC(=O)COCCOc1cccc(c1)N 34a_100011232151_100000187820 [0,1,0,0,0,1|2,0,0]=4 9070 B15R1.119 NC(=O)COCCSc1cccc(c1)Br 62a_100000076697_100000691529 [0,1,0,0,0,1|2,0,0]=4 9071 B15R1.119 NC(=O)COCCSc1cccc(c1)Br 62a_100000691529_100000076697 [0,1,0,0,0,1|2,0,0]=4 9072 B15R1.119 NC(=O)COCCSc1cccc(c1)Br 7a_200011756134_100000187820 [0,1,0,0,0,1|2,0,0]=4 9073 B15R1.119 NC(=O)COCCSc1cccc(c1)Cl 34a_200011721761_100000187820 [0,1,0,0,0,1|2,0,0]=4 9074 B15R1.119 NC(=O)COCCSc1cccc(c1)Cl 62a_100000076697_100000699651 [0,1,0,0,0,1|2,0,0]=4 9075 B15R1.119 NC(=O)COCCSc1cccc(c1)Cl 62a_100000699651_100000076697 [0,1,0,0,0,1|2,0,0]=4 9076 B15R1.119 NC(=O)COCCSc1cccc(c1)Cl 7a_200011721761_100000187820 [0,1,0,0,0,1|2,0,0]=4 9077 B15R1.119 NC(=O)COCCSc1cccc(c1)F 34a_200011996949_100000187820 [0,1,0,0,0,1|2,0,0]=4 9078 B15R1.119 NC(=O)COCCSc1cccc(c1)F 62a_100000076697_100000685547 [0,1,0,0,0,1|2,0,0]=4 9079 B15R1.119 NC(=O)COCCSc1cccc(c1)F 62a_100000685547_100000076697 [0,1,0,0,0,1|2,0,0]=4 9080 B15R1.119 NC(=O)COCCSc1cccc(c1)F 7a_200011996949_100000187820 [0,1,0,0,0,1|2,0,0]=4 9081 B15R1.119 NC(=O)COCCSc1cccc(c1)N 62a_100000076697_100000210019 [0,1,0,0,0,1|2,0,0]=4 9082 B15R1.119 NC(=O)COCCSc1cccc(c1)N 62a_100000210019_100000076697 [0,1,0,0,0,1|2,0,0]=4 9083 B15R1.119 NC(=O)COCCSc1cccc(c1)O 62a_100000076697_100000211634 [0,1,0,0,0,1|2,0,0]=4 9084 B15R1.119 NC(=O)COCCSc1cccc(c1)[S] 62a_100000076697_114929384022 [0,1,0,0,0,1|2,0,0]=4 9085 B15R1.119 NC(=O)COCCSc1cccc(c1)[S] 62a_114929384022_100000076697 [0,1,0,0,0,1|2,0,0]=4 9086 B15R1.119 NC(=O)CSCCCc1cccc(c1)Br 62a_100000747473_100011713683 [0,1,0,0,0,1|1,0,0]=3 9087 B15R1.119 NC(=O)CSCCCc1cccc(c1)Br 62a_100011713683_100000747473 [0,1,0,0,0,1|1,0,0]=3 9088 B15R1.119 NC(=O)CSCCCc1cccc(c1)F 62a_100000747473_200000698031 [0,1,0,0,0,1|1,0,0]=3 9089 B15R1.119 NC(=O)CSCCCc1cccc(c1)F 62a_200000698031_100000747473 [0,1,0,0,0,1|1,0,0]=3 9090 B15R1.119 NC(=O)CSCCOc1cccc(c1)Br 62a_100000183150_100000747473 [0,1,0,0,0,1|2,0,0]=4 9091 B15R1.119 NC(=O)CSCCOc1cccc(c1)Br 62a_100000747473_100000183150 [0,1,0,0,0,1|2,0,0]=4 9092 B15R1.119 NC(=O)CSCCOc1cccc(c1)Cl 62a_100000181161_100000747473 [0,1,0,0,0,1|2,0,0]=4 9093 B15R1.119 NC(=O)CSCCOc1cccc(c1)Cl 62a_100000747473_100000181161 [0,1,0,0,0,1|2,0,0]=4 9094 B15R1.119 NC(=O)CSCCOc1cccc(c1)F 62a_100000739188_100000747473 [0,1,0,0,0,1|2,0,0]=4 9095 B15R1.119 NC(=O)CSCCOc1cccc(c1)F 62a_100000747473_100000739188 [0,1,0,0,0,1|2,0,0]=4 9096 B15R1.119 NC(=O)NCCNCc1cccc(c1)Br 207a_100020590234_100000210085 [0,1,0,0,0,1|2,0,0]=4 9097 B15R1.119 NC(=O)NCCNCc1cccc(c1)Br 2230a_100000174977_200000034859 [0,1,0,0,0,1|2,0,0]=4 9098 B15R1.119 NC(=O)NCCNCc1cccc(c1)Br 34a_100020590234_100000698116 [0,1,0,0,0,1|2,0,0]=4 9099 B15R1.119 NC(=O)NCCNCc1cccc(c1)Cl 207a_100020590234_100000210801 [0,1,0,0,0,1|2,0,0]=4 9100 B15R1.119 NC(=O)NCCNCc1cccc(c1)Cl 2230a_100000174878_200000034859 [0,1,0,0,0,1|2,0,0]=4 9101 B15R1.119 NC(=O)NCCNCc1cccc(c1)Cl 34a_100020590234_100000187163 [0,1,0,0,0,1|2,0,0]=4 9102 B15R1.119 NC(=O)NCCNCc1cccc(c1)F 207a_100020590234_100000210812 [0,1,0,0,0,1|2,0,0]=4 9103 B15R1.119 NC(=O)NCCNCc1cccc(c1)F 2230a_100000174948_200000034859 [0,1,0,0,0,1|2,0,0]=4 9104 B15R1.119 NC(=O)NCCNCc1cccc(c1)F 34a_100020590234_100000187166 [0,1,0,0,0,1|2,0,0]=4 9105 B15R1.119 NC(=O)NCCNCc1cccc(c1)I 207a_100020590234_100000014684 [0,1,0,0,0,1|2,0,0]=4 9106 B15R1.119 NC(=O)NCCNCc1cccc(c1)I 2230a_100000106179_200000034859 [0,1,0,0,0,1|2,0,0]=4 9107 B15R1.119 NC(=O)NCCNCc1cccc(c1)I 34a_100020590234_100011218688 [0,1,0,0,0,1|2,0,0]=4 9108 B15R1.119 NC(=O)NCCNCc1cccc(c1)O 207a_100020590234_100000188321 [0,1,0,0,0,1|2,0,0]=4 9109 B15R1.119 NC(=O)NCCNCc1cccc(c1)O 2230a_100000743036_200000034859 [0,1,0,0,0,1|2,0,0]=4 9110 B15R1.119 NC(=O)NCCNCc1cccc(c1)O 34a_100020590234_100011660834 [0,1,0,0,0,1|2,0,0]=4 9111 B15R1.119 NC(=O)NCCOCc1cccc(c1)Br 34a_100000181757_100000698116 [0,1,0,0,0,1|2,0,0]=4 9112 B15R1.119 NC(=O)NCCOCc1cccc(c1)Br 7a_100000687537_200000034859 [0,1,0,0,0,1|2,0,0]=4 9113 B15R1.119 NC(=O)NCCOCc1cccc(c1)Cl 34a_100000181757_100000187163 [0,1,0,0,0,1|2,0,0]=4 9114 B15R1.119 NC(=O)NCCOCc1cccc(c1)Cl 7a_100000241301_200000034859 [0,1,0,0,0,1|2,0,0]=4 9115 B15R1.119 NC(=O)NCCOCc1cccc(c1)F 34a_100000181757_100000187166 [0,1,0,0,0,1|2,0,0]=4 9116 B15R1.119 NC(=O)NCCOCc1cccc(c1)F 7a_100000210976_200000034859 [0,1,0,0,0,1|2,0,0]=4 9117 B15R1.119 NC(=O)NCCOCc1cccc(c1)I 34a_100000181757_100011218688 [0,1,0,0,0,1|2,0,0]=4 9118 B15R1.119 NC(=O)NCCOCc1cccc(c1)I 7a_100011215336_200000034859 [0,1,0,0,0,1|2,0,0]=4 9119 B15R1.119 NC(=O)NCCOCc1cccc(c1)O 34a_100000181757_100011660834 [0,1,0,0,0,1|2,0,0]=4 9120 B15R1.119 NC(=O)NCCSCc1cccc(c1)Br 62a_100000211773_200000034859 [0,1,0,0,0,1|2,0,0]=4 9121 B15R1.119 NC(=O)NCCSCc1cccc(c1)Br 62a_200000034859_100000211773 [0,1,0,0,0,1|2,0,0]=4 9122 B15R1.119 NC(=O)NCCSCc1cccc(c1)Cl 62a_100000187163_200000034859 [0,1,0,0,0,1|2,0,0]=4 9123 B15R1.119 NC(=O)NCCSCc1cccc(c1)Cl 62a_200000034859_100000187163 [0,1,0,0,0,1|2,0,0]=4 9124 B15R1.119 NC(=O)NCCSCc1cccc(c1)F 62a_100000230114_200000034859 [0,1,0,0,0,1|2,0,0]=4 9125 B15R1.119 NC(=O)NCCSCc1cccc(c1)F 62a_200000034859_100000230114 [0,1,0,0,0,1|2,0,0]=4 9126 B15R1.119 NC(=O)NCCSCc1cccc(c1)I 62a_100011218688_200000034859 [0,1,0,0,0,1|2,0,0]=4 9127 B15R1.119 NC(=O)NCCSCc1cccc(c1)I 62a_200000034859_100011218688 [0,1,0,0,0,1|2,0,0]=4 9128 B15R1.119 NC(=O)NCCSCc1cccc(c1)O 62a_100011660834_200000034859 [0,1,0,0,0,1|2,0,0]=4 9129 B15R1.119 NC(=O)NCCSCc1cccc(c1)O 62a_200000034859_100011660834 [0,1,0,0,0,1|2,0,0]=4 9130 B15R1.119 NC(=O)OCCNCc1cccc(c1)Br 34a_100000174977_200011214921 [0,1,0,0,0,1|2,0,0]=4 9131 B15R1.119 NC(=O)OCCNCc1cccc(c1)Cl 34a_100000174878_200011214921 [0,1,0,0,0,1|2,0,0]=4 9132 B15R1.119 NC(=O)OCCNCc1cccc(c1)F 34a_100000174948_200011214921 [0,1,0,0,0,1|2,0,0]=4 9133 B15R1.119 NC(=O)OCCNCc1cccc(c1)I 34a_100000106179_200011214921 [0,1,0,0,0,1|2,0,0]=4 9134 B15R1.119 NC(=O)OCCNCc1cccc(c1)O 34a_100000743036_200011214921 [0,1,0,0,0,1|2,0,0]=4 9135 B15R1.119 NC(=O)OCCOCc1cccc(c1)Br 34a_100000687537_200011214921 [0,1,0,0,0,1|2,0,0]=4 9136 B15R1.119 NC(=O)OCCOCc1cccc(c1)Br 7a_100000687537_200011214921 [0,1,0,0,0,1|2,0,0]=4 9137 B15R1.119 NC(=O)OCCOCc1cccc(c1)Br 7a_100000766696_100000211773 [0,1,0,0,0,1|2,0,0]=4 9138 B15R1.119 NC(=O)OCCOCc1cccc(c1)Cl 34a_100000241301_200011214921 [0,1,0,0,0,1|2,0,0]=4 9139 B15R1.119 NC(=O)OCCOCc1cccc(c1)Cl 7a_100000241301_200011214921 [0,1,0,0,0,1|2,0,0]=4 9140 B15R1.119 NC(=O)OCCOCc1cccc(c1)Cl 7a_100000766696_100000187163 [0,1,0,0,0,1|2,0,0]=4 9141 B15R1.119 NC(=O)OCCOCc1cccc(c1)F 34a_100000210976_200011214921 [0,1,0,0,0,1|2,0,0]=4 9142 B15R1.119 NC(=O)OCCOCc1cccc(c1)F 7a_100000210976_200011214921 [0,1,0,0,0,1|2,0,0]=4 9143 B15R1.119 NC(=O)OCCOCc1cccc(c1)F 7a_100000766696_100000230114 [0,1,0,0,0,1|2,0,0]=4 9144 B15R1.119 NC(=O)OCCOCc1cccc(c1)I 34a_100011215336_200011214921 [0,1,0,0,0,1|2,0,0]=4 9145 B15R1.119 NC(=O)OCCOCc1cccc(c1)I 7a_100000766696_100011218688 [0,1,0,0,0,1|2,0,0]=4 9146 B15R1.119 NC(=O)OCCOCc1cccc(c1)I 7a_100011215336_200011214921 [0,1,0,0,0,1|2,0,0]=4 9147 B15R1.119 NC(=O)OCCOCc1cccc(c1)N 34a_100000211919_200011214921 [0,1,0,0,0,1|2,0,0]=4 9148 B15R1.119 NC(=O)OCCOCc1cccc(c1)O 7a_100000766696_100000084143 [0,1,0,0,0,1|2,0,0]=4 9149 B15R1.119 NC(=O)OCCSCc1cccc(c1)Br 62a_100000211773_200011214921 [0,1,0,0,0,1|2,0,0]=4 9150 B15R1.119 NC(=O)OCCSCc1cccc(c1)Br 62a_200011214921_100000211773 [0,1,0,0,0,1|2,0,0]=4 9151 B15R1.119 NC(=O)OCCSCc1cccc(c1)Cl 62a_100000187163_200011214921 [0,1,0,0,0,1|2,0,0]=4 9152 B15R1.119 NC(=O)OCCSCc1cccc(c1)Cl 62a_200011214921_100000187163 [0,1,0,0,0,1|2,0,0]=4 9153 B15R1.119 NC(=O)OCCSCc1cccc(c1)F 62a_100000230114_200011214921 [0,1,0,0,0,1|2,0,0]=4 9154 B15R1.119 NC(=O)OCCSCc1cccc(c1)F 62a_200011214921_100000230114 [0,1,0,0,0,1|2,0,0]=4 9155 B15R1.119 NC(=O)OCCSCc1cccc(c1)I 62a_100011218688_200011214921 [0,1,0,0,0,1|2,0,0]=4 9156 B15R1.119 NC(=O)OCCSCc1cccc(c1)I 62a_200011214921_100011218688 [0,1,0,0,0,1|2,0,0]=4 9157 B15R1.119 NC(=O)OCCSCc1cccc(c1)O 62a_100011660834_200011214921 [0,1,0,0,0,1|2,0,0]=4 9158 B15R1.119 NC(=O)OCCSCc1cccc(c1)O 62a_200011214921_100011660834 [0,1,0,0,0,1|2,0,0]=4 9159 B15R1.119 Nc1cccc(c1)CCCOCC(=O)[O-] 34a_200000698965_100020667443 [0,1,0,0,0,1|0,0,1]=3 9160 B15R1.119 Nc1cccc(c1)CCCOC[N+](=O)[O-] 34a_200000698965_100000761209 [0,1,0,0,0,1|1,0,1]=4 9161 B15R1.119 Nc1cccc(c1)OCCCCB(O)O 34a_100000210217_200009817182 [0,1,0,0,0,1|1,0,1]=4 9162 B15R1.119 Nc1cccc(c1)OCCOCC(=O)[O-] 34a_100011232151_100020667443 [0,1,0,0,0,1|1,0,1]=4 9163 B15R1.119 Nc1cccc(c1)SCCCCB(O)O 62a_100000210019_200009817182 [0,1,0,0,0,1|1,0,1]=4 9164 B15R1.119 Nc1cccc(c1)SCCCCB(O)O 62a_200009817182_100000210019 [0,1,0,0,0,1|1,0,1]=4 9165 B15R1.119 O=C(O)CNCC#Cc1cccc(c1)Br 269956a_100016091260_100010706776 [0,1,0,0,0,1|0,0,2]=4 9166 B15R1.119 O=C(O)CNCC#Cc1cccc(c1)F 269956a_100016091260_100010402994 [0,1,0,0,0,1|0,0,2]=4 9167 B15R1.119 O=C(O)CNCCCc1cccc(c1)Br 269956a_100016091260_100011713683 [0,1,0,0,0,1|0,0,0]=2 9168 B15R1.119 O=C(O)CNCCCc1cccc(c1)F 269956a_100016091260_200000698031 [0,1,0,0,0,1|0,0,0]=2 9169 B15R1.119 O=C(O)CNCCOc1cccc(c1)Br 269956a_100016091260_100000183150 [0,1,0,0,0,1|1,0,0]=3 9170 B15R1.119 O=C(O)CNCCOc1cccc(c1)Cl 269956a_100016091260_100000181161 [0,1,0,0,0,1|1,0,0]=3 9171 B15R1.119 O=C(O)CNCCOc1cccc(c1)F 269956a_100016091260_100000739188 [0,1,0,0,0,1|1,0,0]=3 9172 B15R1.119 O=C(O)CONCCc1cccc(c1)Br 269956a_100000106656_100011740638 [0,1,0,0,0,1|1,0,0]=3 9173 B15R1.119 O=C(O)CONCCc1cccc(c1)Cl 269956a_100000106656_100011713710 [0,1,0,0,0,1|1,0,0]=3 9174 B15R1.119 O=C(O)CONCCc1cccc(c1)F 269956a_100000106656_100011217235 [0,1,0,0,0,1|1,0,0]=3 9175 B15R1.119 O=C([O-])CNCCCc1cccc(c1)Br 34a_100000753791_100020667443 [0,1,0,0,0,1|0,0,1]=3 9176 B15R1.119 O=C([O-])CNCCCc1cccc(c1)Cl 34a_100000704586_100020667443 [0,1,0,0,0,1|0,0,1]=3 9177 B15R1.119 O=C([O-])CNCCCc1cccc(c1)F 34a_100000754185_100020667443 [0,1,0,0,0,1|0,0,1]=3 9178 B15R1.119 O=C([O-])CNCCOc1cccc(c1)Br 34a_100000743521_100020667443 [0,1,0,0,0,1|1,0,1]=4 9179 B15R1.119 O=C([O-])CNCCOc1cccc(c1)Cl 34a_100000740232_100020667443 [0,1,0,0,0,1|1,0,1]=4 9180 B15R1.119 O=C([O-])CNCCOc1cccc(c1)F 34a_100000738948_100020667443 [0,1,0,0,0,1|1,0,1]=4 9181 B15R1.119 O=C([O-])COCCCc1cccc(c1)Br 34a_100011709248_100020667443 [0,1,0,0,0,1|0,0,1]=3 9182 B15R1.119 O=C([O-])COCCCc1cccc(c1)Cl 34a_100011709246_100020667443 [0,1,0,0,0,1|0,0,1]=3 9183 B15R1.119 O=C([O-])COCCOc1cccc(c1)Br 34a_100000757546_100020667443 [0,1,0,0,0,1|1,0,1]=4 9184 B15R1.119 O=C([O-])COCCOc1cccc(c1)Cl 34a_100000230539_100020667443 [0,1,0,0,0,1|1,0,1]=4 9185 B15R1.119 O=C([O-])COCCSc1cccc(c1)Cl 34a_200011721761_100020667443 [0,1,0,0,0,1|1,0,1]=4 9186 B15R1.119 O=C([O-])COCCSc1cccc(c1)F 34a_200011996949_100020667443 [0,1,0,0,0,1|1,0,1]=4 9187 B15R1.119 O=C([O-])CSCCCc1cccc(c1)Br 62a_100011713683_100020667443 [0,1,0,0,0,1|0,0,1]=3 9188 B15R1.119 O=C([O-])CSCCCc1cccc(c1)Br 62a_100020667443_100011713683 [0,1,0,0,0,1|0,0,1]=3 9189 B15R1.119 O=C([O-])CSCCCc1cccc(c1)F 62a_100020667443_200000698031 [0,1,0,0,0,1|0,0,1]=3 9190 B15R1.119 O=C([O-])CSCCCc1cccc(c1)F 62a_200000698031_100020667443 [0,1,0,0,0,1|0,0,1]=3 9191 B15R1.119 O=C([O-])CSCCOc1cccc(c1)Br 62a_100000183150_100020667443 [0,1,0,0,0,1|1,0,1]=4 9192 B15R1.119 O=C([O-])CSCCOc1cccc(c1)Br 62a_100020667443_100000183150 [0,1,0,0,0,1|1,0,1]=4 9193 B15R1.119 O=C([O-])CSCCOc1cccc(c1)Cl 62a_100000181161_100020667443 [0,1,0,0,0,1|1,0,1]=4 9194 B15R1.119 O=C([O-])CSCCOc1cccc(c1)Cl 62a_100020667443_100000181161 [0,1,0,0,0,1|1,0,1]=4 9195 B15R1.119 O=C([O-])CSCCOc1cccc(c1)F 62a_100000739188_100020667443 [0,1,0,0,0,1|1,0,1]=4 9196 B15R1.119 O=C([O-])CSCCOc1cccc(c1)F 62a_100020667443_100000739188 [0,1,0,0,0,1|1,0,1]=4 9197 B15R1.119 O=[N+]([O-])CCCOCc1cccc(c1)Br 34a_200000037920_100000698116 [0,1,0,0,0,1|1,0,1]=4 9198 B15R1.119 O=[N+]([O-])CCCOCc1cccc(c1)Cl 34a_200000037920_100000187163 [0,1,0,0,0,1|1,0,1]=4 9199 B15R1.119 O=[N+]([O-])CCCOCc1cccc(c1)F 34a_200000037920_100000187166 [0,1,0,0,0,1|1,0,1]=4 9200 B15R1.119 O=[N+]([O-])CCCOCc1cccc(c1)I 34a_200000037920_100011218688 [0,1,0,0,0,1|1,0,1]=4 9201 B15R1.119 O=[N+]([O-])CCCOCc1cccc(c1)O 34a_200000037920_100011660834 [0,1,0,0,0,1|1,0,1]=4 9202 B15R1.119 O=[N+]([O-])CNCCCc1cccc(c1)Br 34a_100000753791_100000761209 [0,1,0,0,0,1|1,0,1]=4 9203 B15R1.119 O=[N+]([O-])CNCCCc1cccc(c1)Cl 34a_100000704586_100000761209 [0,1,0,0,0,1|1,0,1]=4 9204 B15R1.119 O=[N+]([O-])CNCCCc1cccc(c1)F 34a_100000754185_100000761209 [0,1,0,0,0,1|1,0,1]=4 9205 B15R1.119 O=[N+]([O-])COCCCc1cccc(c1)Br 34a_100011709248_100000761209 [0,1,0,0,0,1|1,0,1]=4 9206 B15R1.119 O=[N+]([O-])COCCCc1cccc(c1)Cl 34a_100011709246_100000761209 [0,1,0,0,0,1|1,0,1]=4 9207 B15R1.119 O=[N+]([O-])CSCCCc1cccc(c1)Br 62a_100011713683_100000761209 [0,1,0,0,0,1|1,0,1]=4 9208 B15R1.119 O=[N+]([O-])CSCCCc1cccc(c1)F 62a_200000698031_100000761209 [0,1,0,0,0,1|1,0,1]=4 9209 B15R1.119 OB(O)CCCCNc1cccc(c1)Br 34a_100000210019_200009817182 [0,1,0,0,0,1|1,0,1]=4 9210 B15R1.119 OB(O)CCCCNc1cccc(c1)Cl 34a_100000185859_200009817182 [0,1,0,0,0,1|1,0,1]=4 9211 B15R1.119 OB(O)CCCCNc1cccc(c1)F 34a_100000210047_200009817182 [0,1,0,0,0,1|1,0,1]=4 9212 B15R1.119 OB(O)CCCCNc1cccc(c1)I 34a_100000211102_200009817182 [0,1,0,0,0,1|1,0,1]=4 9213 B15R1.119 OB(O)CCCCNc1cccc(c1)O 34a_100000210217_200009817182 [0,1,0,0,0,1|1,0,1]=4 9214 B15R1.119 OB(O)CCCCOc1cccc(c1)Br 34a_100000210342_200009817182 [0,1,0,0,0,1|1,0,1]=4 9215 B15R1.119 OB(O)CCCCOc1cccc(c1)Br 7a_100000210342_200009817182 [0,1,0,0,0,1|1,0,1]=4 9216 B15R1.119 OB(O)CCCCOc1cccc(c1)Cl 34a_100000210295_200009817182 [0,1,0,0,0,1|1,0,1]=4 9217 B15R1.119 OB(O)CCCCOc1cccc(c1)Cl 7a_100000210295_200009817182 [0,1,0,0,0,1|1,0,1]=4 9218 B15R1.119 OB(O)CCCCOc1cccc(c1)F 34a_100000210426_200009817182 [0,1,0,0,0,1|1,0,1]=4 9219 B15R1.119 OB(O)CCCCOc1cccc(c1)F 7a_100000210426_200009817182 [0,1,0,0,0,1|1,0,1]=4 9220 B15R1.119 OB(O)CCCCOc1cccc(c1)I 34a_100000211634_200009817182 [0,1,0,0,0,1|1,0,1]=4 9221 B15R1.119 OB(O)CCCCOc1cccc(c1)I 7a_100000211634_200009817182 [0,1,0,0,0,1|1,0,1]=4 9222 B15R1.119 OB(O)CCCCSc1cccc(c1)Br 62a_100000691529_200009817182 [0,1,0,0,0,1|1,0,1]=4 9223 B15R1.119 OB(O)CCCCSc1cccc(c1)Br 62a_200009817182_100000691529 [0,1,0,0,0,1|1,0,1]=4 9224 B15R1.119 OB(O)CCCCSc1cccc(c1)Cl 62a_100000699651_200009817182 [0,1,0,0,0,1|1,0,1]=4 9225 B15R1.119 OB(O)CCCCSc1cccc(c1)Cl 62a_200009817182_100000699651 [0,1,0,0,0,1|1,0,1]=4 9226 B15R1.119 OB(O)CCCCSc1cccc(c1)F 62a_100000685547_200009817182 [0,1,0,0,0,1|1,0,1]=4 9227 B15R1.119 OB(O)CCCCSc1cccc(c1)F 62a_200009817182_100000685547 [0,1,0,0,0,1|1,0,1]=4 9228 B15R1.119 OB(O)CCCCSc1cccc(c1)O 62a_200009817182_100000211634 [0,1,0,0,0,1|1,0,1]=4 9229 B15R1.119 OB(O)CCCCSc1cccc(c1)[S] 62a_114929384022_200009817182 [0,1,0,0,0,1|1,0,1]=4 9230 B15R1.119 OB(O)CCCCSc1cccc(c1)[S] 62a_200009817182_114929384022 [0,1,0,0,0,1|1,0,1]=4 9231 B15R1.131 C=C(Br)CCOCCc1ccccc1Br 34a_100009813270_100012161201 [0,1,0,0,0,1|2,0,0]=4 9232 B15R1.131 C=C(Br)CCOCCc1ccccc1C 34a_100009813270_100011713688 [0,1,0,0,0,1|2,0,0]=4 9233 B15R1.131 C=C(Br)CCOCCc1ccccc1Cl 34a_100009813270_100011713703 [0,1,0,0,0,1|2,0,0]=4 9234 B15R1.131 C=C(Br)CCOCCc1ccccc1F 34a_100009813270_100000720011 [0,1,0,0,0,1|2,0,0]=4 9235 B15R1.131 C=C(Br)CCOCCc1ccccc1O 34a_100009813270_100000722297 [0,1,0,0,0,1|2,0,0]=4 9236 B15R1.131 C=C(C)CCNCCc1ccccc1Br 2230a_100000747383_100000730704 [0,1,0,0,0,1|2,0,0]=4 9237 B15R1.131 C=C(C)CCNCCc1ccccc1Br 34a_100000747383_100000730704 [0,1,0,0,0,1|2,0,0]=4 9238 B15R1.131 C=C(C)CCNCCc1ccccc1C 2230a_100000685071_100000730704 [0,1,0,0,0,1|2,0,0]=4 9239 B15R1.131 C=C(C)CCNCCc1ccccc1C 34a_100000685071_100000730704 [0,1,0,0,0,1|2,0,0]=4 9240 B15R1.131 C=C(C)CCNCCc1ccccc1Cl 2230a_100011207228_100000730704 [0,1,0,0,0,1|2,0,0]=4 9241 B15R1.131 C=C(C)CCNCCc1ccccc1Cl 34a_100011207228_100000730704 [0,1,0,0,0,1|2,0,0]=4 9242 B15R1.131 C=C(C)CCNCCc1ccccc1F 2230a_100000185272_100000730704 [0,1,0,0,0,1|2,0,0]=4 9243 B15R1.131 C=C(C)CCNCCc1ccccc1F 34a_100000185272_100000730704 [0,1,0,0,0,1|2,0,0]=4 9244 B15R1.131 C=C(C)CCNCCc1ccccc1O 34a_100011207237_100000730704 [0,1,0,0,0,1|2,0,0]=4 9245 B15R1.131 C=C(C)CCOCCc1ccccc1Br 34a_100000731337_100000730704 [0,1,0,0,0,1|2,0,0]=4 9246 B15R1.131 C=C(C)CCOCCc1ccccc1Br 34a_100000764851_100012161201 [0,1,0,0,0,1|2,0,0]=4 9247 B15R1.131 C=C(C)CCOCCc1ccccc1Br 7a_100000731337_100000730704 [0,1,0,0,0,1|2,0,0]=4 9248 B15R1.131 C=C(C)CCOCCc1ccccc1C 34a_100000764851_100011713688 [0,1,0,0,0,1|2,0,0]=4 9249 B15R1.131 C=C(C)CCOCCc1ccccc1C 34a_100011220023_100000730704 [0,1,0,0,0,1|2,0,0]=4 9250 B15R1.131 C=C(C)CCOCCc1ccccc1C 7a_100011220023_100000730704 [0,1,0,0,0,1|2,0,0]=4 9251 B15R1.131 C=C(C)CCOCCc1ccccc1Cl 34a_100000764851_100011713703 [0,1,0,0,0,1|2,0,0]=4 9252 B15R1.131 C=C(C)CCOCCc1ccccc1Cl 34a_100011215284_100000730704 [0,1,0,0,0,1|2,0,0]=4 9253 B15R1.131 C=C(C)CCOCCc1ccccc1Cl 7a_100011215284_100000730704 [0,1,0,0,0,1|2,0,0]=4 9254 B15R1.131 C=C(C)CCOCCc1ccccc1F 34a_100000753711_100000730704 [0,1,0,0,0,1|2,0,0]=4 9255 B15R1.131 C=C(C)CCOCCc1ccccc1F 34a_100000764851_100000720011 [0,1,0,0,0,1|2,0,0]=4 9256 B15R1.131 C=C(C)CCOCCc1ccccc1F 7a_100000753711_100000730704 [0,1,0,0,0,1|2,0,0]=4 9257 B15R1.131 C=C(C)CCOCCc1ccccc1I 34a_100010255290_100000730704 [0,1,0,0,0,1|2,0,0]=4 9258 B15R1.131 C=C(C)CCOCCc1ccccc1I 7a_100010255290_100000730704 [0,1,0,0,0,1|2,0,0]=4 9259 B15R1.131 C=C(C)CCOCCc1ccccc1N 34a_100011215289_100000730704 [0,1,0,0,0,1|2,0,0]=4 9260 B15R1.131 C=C(C)CCOCCc1ccccc1O 34a_100000764851_100000722297 [0,1,0,0,0,1|2,0,0]=4 9261 B15R1.131 C=C(C)CCSCCc1ccccc1Br 62a_100000730704_100012161201 [0,1,0,0,0,1|2,0,0]=4 9262 B15R1.131 C=C(C)CCSCCc1ccccc1Br 62a_100012161201_100000730704 [0,1,0,0,0,1|2,0,0]=4 9263 B15R1.131 C=C(C)CCSCCc1ccccc1C 62a_100000730704_100011713688 [0,1,0,0,0,1|2,0,0]=4 9264 B15R1.131 C=C(C)CCSCCc1ccccc1C 62a_100011713688_100000730704 [0,1,0,0,0,1|2,0,0]=4 9265 B15R1.131 C=C(C)CCSCCc1ccccc1Cl 62a_100000730704_100011713703 [0,1,0,0,0,1|2,0,0]=4 9266 B15R1.131 C=C(C)CCSCCc1ccccc1Cl 62a_100011713703_100000730704 [0,1,0,0,0,1|2,0,0]=4 9267 B15R1.131 C=C(C)CCSCCc1ccccc1F 62a_100000730704_100011713696 [0,1,0,0,0,1|2,0,0]=4 9268 B15R1.131 C=C(C)CCSCCc1ccccc1F 62a_100011713696_100000730704 [0,1,0,0,0,1|2,0,0]=4 9269 B15R1.131 C=C(C)CCSCCc1ccccc1O 62a_100000722297_100000730704 [0,1,0,0,0,1|2,0,0]=4 9270 B15R1.131 C=C(C)CCSCCc1ccccc1O 62a_100000730704_100000722297 [0,1,0,0,0,1|2,0,0]=4 9271 B15R1.131 C=C(C)CNCCCc1ccccc1F 2230a_100000724733_100000748629 [0,1,0,0,0,1|2,0,0]=4 9272 B15R1.131 C=C(C)CNCCCc1ccccc1F 34a_100000724733_100000748629 [0,1,0,0,0,1|2,0,0]=4 9273 B15R1.131 C=C(C)COCCCc1ccccc1Br 34a_100000210245_200011713681 [0,1,0,0,0,1|2,0,0]=4 9274 B15R1.131 C=C(C)COCCCc1ccccc1Br 34a_100000699526_100000748629 [0,1,0,0,0,1|2,0,0]=4 9275 B15R1.131 C=C(C)COCCCc1ccccc1Br 7a_100000699526_100000748629 [0,1,0,0,0,1|2,0,0]=4 9276 B15R1.131 C=C(C)COCCCc1ccccc1Cl 34a_100011709251_100000748629 [0,1,0,0,0,1|2,0,0]=4 9277 B15R1.131 C=C(C)COCCCc1ccccc1Cl 7a_100011709251_100000748629 [0,1,0,0,0,1|2,0,0]=4 9278 B15R1.131 C=C(C)COCCCc1ccccc1F 34a_100011709249_100000748629 [0,1,0,0,0,1|2,0,0]=4 9279 B15R1.131 C=C(C)COCCCc1ccccc1F 7a_100011709249_100000748629 [0,1,0,0,0,1|2,0,0]=4 9280 B15R1.131 C=C(C)CSCCCc1ccccc1Br 62a_100000748629_200011713681 [0,1,0,0,0,1|2,0,0]=4 9281 B15R1.131 C=C(C)CSCCCc1ccccc1Br 62a_200011713681_100000211660 [0,1,0,0,0,1|2,0,0]=4 9282 B15R1.131 C=C(F)CNCCCc1ccccc1F 2230a_100000724733_100009893438 [0,1,0,0,0,1|2,0,0]=4 9283 B15R1.131 C=C(F)CNCCCc1ccccc1F 34a_100000724733_100009893438 [0,1,0,0,0,1|2,0,0]=4 9284 B15R1.131 C=C(F)COCCCc1ccccc1Br 34a_100000699526_100009893438 [0,1,0,0,0,1|2,0,0]=4 9285 B15R1.131 C=C(F)COCCCc1ccccc1Br 34a_200010262243_200011713681 [0,1,0,0,0,1|2,0,0]=4 9286 B15R1.131 C=C(F)COCCCc1ccccc1Br 7a_100000699526_100000042424 [0,1,0,0,0,1|2,0,0]=4 9287 B15R1.131 C=C(F)COCCCc1ccccc1Cl 34a_100011709251_100009893438 [0,1,0,0,0,1|2,0,0]=4 9288 B15R1.131 C=C(F)COCCCc1ccccc1Cl 7a_100011709251_100000042424 [0,1,0,0,0,1|2,0,0]=4 9289 B15R1.131 C=C(F)COCCCc1ccccc1F 34a_100011709249_100009893438 [0,1,0,0,0,1|2,0,0]=4 9290 B15R1.131 C=C(F)COCCCc1ccccc1F 7a_100011709249_100000042424 [0,1,0,0,0,1|2,0,0]=4 9291 B15R1.131 C=C(F)CSCCCc1ccccc1Br 62a_100000042424_200011713681 [0,1,0,0,0,1|2,0,0]=4 9292 B15R1.131 C=C(F)CSCCCc1ccccc1Br 62a_200011713681_100000042424 [0,1,0,0,0,1|2,0,0]=4 9293 B15R1.131 CC(=O)CCCCNc1ccccc1Br 34a_100000210017_100009817362 [0,1,0,0,0,1|1,0,0]=3 9294 B15R1.131 CC(=O)CCCCNc1ccccc1C 34a_100015192222_100009817362 [0,1,0,0,0,1|1,0,0]=3 9295 B15R1.131 CC(=O)CCCCNc1ccccc1Cl 34a_100000185783_100009817362 [0,1,0,0,0,1|1,0,0]=3 9296 B15R1.131 CC(=O)CCCCNc1ccccc1F 34a_100000210422_100009817362 [0,1,0,0,0,1|1,0,0]=3 9297 B15R1.131 CC(=O)CCCCNc1ccccc1I 34a_100000210053_100009817362 [0,1,0,0,0,1|1,0,0]=3 9298 B15R1.131 CC(=O)CCCCNc1ccccc1O 34a_100000185747_100009817362 [0,1,0,0,0,1|1,0,0]=3 9299 B15R1.131 CC(=O)CCCCOc1cccc[n+]1[O-] 7a_100000211761_100000735457 [0,1,0,0,0,1|2,0,0]=4 9300 B15R1.131 CC(=O)CCCCOc1ccccc1Br 34a_100000181306_100009817362 [0,1,0,0,0,1|1,0,0]=3 9301 B15R1.131 CC(=O)CCCCOc1ccccc1Br 7a_100000181306_100000735457 [0,1,0,0,0,1|1,0,0]=3 9302 B15R1.131 CC(=O)CCCCOc1ccccc1C 34a_100000210338_100009817362 [0,1,0,0,0,1|1,0,0]=3 9303 B15R1.131 CC(=O)CCCCOc1ccccc1C 7a_100000210338_100000735457 [0,1,0,0,0,1|1,0,0]=3 9304 B15R1.131 CC(=O)CCCCOc1ccccc1Cl 34a_100000210172_100009817362 [0,1,0,0,0,1|1,0,0]=3 9305 B15R1.131 CC(=O)CCCCOc1ccccc1Cl 7a_100000210172_100000735457 [0,1,0,0,0,1|1,0,0]=3 9306 B15R1.131 CC(=O)CCCCOc1ccccc1F 34a_100000210171_100009817362 [0,1,0,0,0,1|1,0,0]=3 9307 B15R1.131 CC(=O)CCCCOc1ccccc1F 7a_100000210171_100000735457 [0,1,0,0,0,1|1,0,0]=3 9308 B15R1.131 CC(=O)CCCCOc1ccccc1I 34a_100000739446_100009817362 [0,1,0,0,0,1|1,0,0]=3 9309 B15R1.131 CC(=O)CCCCOc1ccccc1I 7a_100000739446_100000735457 [0,1,0,0,0,1|1,0,0]=3 9310 B15R1.131 CC(=O)CCCCOc1ccccc1N 34a_100000185747_100009817362 [0,1,0,0,0,1|1,0,0]=3 9311 B15R1.131 CC(=O)CCCCOc1ccccc1N 7a_100000185747_100000735457 [0,1,0,0,0,1|1,0,0]=3 9312 B15R1.131 CC(=O)CCCCOc1cccnc1Br 34a_100000744436_100009817362 [0,1,0,0,0,1|2,0,0]=4 9313 B15R1.131 CC(=O)CCCCOc1cccnc1Br 7a_100000744436_100000735457 [0,1,0,0,0,1|2,0,0]=4 9314 B15R1.131 CC(=O)CCCCOc1cccnc1C 34a_100000745507_100009817362 [0,1,0,0,0,1|2,0,0]=4 9315 B15R1.131 CC(=O)CCCCOc1cccnc1C 7a_100000745507_100000735457 [0,1,0,0,0,1|2,0,0]=4 9316 B15R1.131 CC(=O)CCCCOc1cccnc1Cl 34a_100000757616_100009817362 [0,1,0,0,0,1|2,0,0]=4 9317 B15R1.131 CC(=O)CCCCOc1cccnc1Cl 7a_100000757616_100000735457 [0,1,0,0,0,1|2,0,0]=4 9318 B15R1.131 CC(=O)CCCCOc1cccnc1F 34a_100000061740_100009817362 [0,1,0,0,0,1|2,0,0]=4 9319 B15R1.131 CC(=O)CCCCOc1cccnc1F 7a_100000061740_100000735457 [0,1,0,0,0,1|2,0,0]=4 9320 B15R1.131 CC(=O)CCCCOc1cccnc1I 34a_100000034122_100009817362 [0,1,0,0,0,1|2,0,0]=4 9321 B15R1.131 CC(=O)CCCCOc1cccnc1I 7a_100000034122_100000735457 [0,1,0,0,0,1|2,0,0]=4 9322 B15R1.131 CC(=O)CCCCOc1cccnc1N 34a_100000211975_100009817362 [0,1,0,0,0,1|2,0,0]=4 9323 B15R1.131 CC(=O)CCCCOc1cccnc1N 7a_100000211975_100000735457 [0,1,0,0,0,1|2,0,0]=4 9324 B15R1.131 CC(=O)CCCCOc1cccoc1=O 34a_100000077404_100009817362 [0,1,0,0,0,1|2,0,0]=4 9325 B15R1.131 CC(=O)CCCCOc1cccoc1=O 7a_100000077404_100000735457 [0,1,0,0,0,1|2,0,0]=4 9326 B15R1.131 CC(=O)CCCCOc1ccncc1Br 34a_100011996408_100009817362 [0,1,0,0,0,1|2,0,0]=4 9327 B15R1.131 CC(=O)CCCCOc1ccncc1C 34a_100000694293_100009817362 [0,1,0,0,0,1|2,0,0]=4 9328 B15R1.131 CC(=O)CCCCOc1ccncc1Cl 34a_100011997054_100009817362 [0,1,0,0,0,1|2,0,0]=4 9329 B15R1.131 CC(=O)CCCCOc1ccncc1F 34a_200000081243_100009817362 [0,1,0,0,0,1|2,0,0]=4 9330 B15R1.131 CC(=O)CCCCOc1cnccc1C 34a_100011997053_100009817362 [0,1,0,0,0,1|2,0,0]=4 9331 B15R1.131 CC(=O)CCCCOc1cnccc1C 7a_100011997053_100000735457 [0,1,0,0,0,1|2,0,0]=4 9332 B15R1.131 CC(=O)CCCCOc1cnccc1Cl 34a_100011996695_100009817362 [0,1,0,0,0,1|2,0,0]=4 9333 B15R1.131 CC(=O)CCCCOc1cnccc1I 34a_100000050107_100009817362 [0,1,0,0,0,1|2,0,0]=4 9334 B15R1.131 CC(=O)CCCCOc1cnccc1N 34a_100000753702_100009817362 [0,1,0,0,0,1|2,0,0]=4 9335 B15R1.131 CC(=O)CCCCOc1coccc1=O 34a_100000060831_100009817362 [0,1,0,0,0,1|2,0,0]=4 9336 B15R1.131 CC(=O)CCCCOc1ncccc1Cl 34a_100011290957_100009817362 [0,1,0,0,0,1|2,0,0]=4 9337 B15R1.131 CC(=O)CCCCOc1ncccc1F 34a_100011219419_100009817362 [0,1,0,0,0,1|2,0,0]=4 9338 B15R1.131 CC(=O)CCCCOc1ncccc1N 34a_100000746358_100009817362 [0,1,0,0,0,1|2,0,0]=4 9339 B15R1.131 CC(=O)CCCCSc1c[nH]ccc1=O 62a_100000735457_100009998708 [0,1,0,0,0,1|2,0,0]=4 9340 B15R1.131 CC(=O)CCCCSc1c[nH]ccc1=O 62a_100009998708_100000735457 [0,1,0,0,0,1|2,0,0]=4 9341 B15R1.131 CC(=O)CCCCSc1c[nH]ccc1=S 62a_100000735457_200012280681 [0,1,0,0,0,1|2,0,0]=4 9342 B15R1.131 CC(=O)CCCCSc1c[nH]ccc1=S 62a_200012280681_100000735457 [0,1,0,0,0,1|2,0,0]=4 9343 B15R1.131 CC(=O)CCCCSc1cccc[n+]1C 62a_100000735457_100000212160 [0,1,0,0,0,1|2,0,0]=4 9344 B15R1.131 CC(=O)CCCCSc1cccc[n+]1[O-] 62a_100000735457_200000042595 [0,1,0,0,0,1|2,0,0]=4 9345 B15R1.131 CC(=O)CCCCSc1ccccc1Br 62a_100000695589_100000735457 [0,1,0,0,0,1|1,0,0]=3 9346 B15R1.131 CC(=O)CCCCSc1ccccc1Br 62a_100000735457_100000695589 [0,1,0,0,0,1|1,0,0]=3 9347 B15R1.131 CC(=O)CCCCSc1ccccc1C 62a_100000210755_100000735457 [0,1,0,0,0,1|1,0,0]=3 9348 B15R1.131 CC(=O)CCCCSc1ccccc1C 62a_100000735457_100000210755 [0,1,0,0,0,1|1,0,0]=3 9349 B15R1.131 CC(=O)CCCCSc1ccccc1Cl 62a_100000735457_100000764095 [0,1,0,0,0,1|1,0,0]=3 9350 B15R1.131 CC(=O)CCCCSc1ccccc1Cl 62a_100000764095_100000735457 [0,1,0,0,0,1|1,0,0]=3 9351 B15R1.131 CC(=O)CCCCSc1ccccc1F 62a_100000735457_100011215700 [0,1,0,0,0,1|1,0,0]=3 9352 B15R1.131 CC(=O)CCCCSc1ccccc1F 62a_100011215700_100000735457 [0,1,0,0,0,1|1,0,0]=3 9353 B15R1.131 CC(=O)CCCCSc1ccccc1N 62a_100000210017_100000735457 [0,1,0,0,0,1|1,0,0]=3 9354 B15R1.131 CC(=O)CCCCSc1ccccc1N 62a_100000735457_100000210017 [0,1,0,0,0,1|1,0,0]=3 9355 B15R1.131 CC(=O)CCCCSc1ccccc1O 62a_100000735457_100000739446 [0,1,0,0,0,1|1,0,0]=3 9356 B15R1.131 CC(=O)CCCCSc1ccccc1O 62a_100000739446_100000735457 [0,1,0,0,0,1|1,0,0]=3 9357 B15R1.131 CC(=O)CCCCSc1cccnc1Br 62a_100000735457_100010202626 [0,1,0,0,0,1|2,0,0]=4 9358 B15R1.131 CC(=O)CCCCSc1cccnc1Br 62a_100010202626_100000735457 [0,1,0,0,0,1|2,0,0]=4 9359 B15R1.131 CC(=O)CCCCSc1cccnc1C 62a_100000735457_100000751574 [0,1,0,0,0,1|2,0,0]=4 9360 B15R1.131 CC(=O)CCCCSc1cccnc1C 62a_100000751574_100000735457 [0,1,0,0,0,1|2,0,0]=4 9361 B15R1.131 CC(=O)CCCCSc1cccnc1Cl 62a_100000036424_100000735457 [0,1,0,0,0,1|2,0,0]=4 9362 B15R1.131 CC(=O)CCCCSc1cccnc1Cl 62a_100000735457_100000036424 [0,1,0,0,0,1|2,0,0]=4 9363 B15R1.131 CC(=O)CCCCSc1cccnc1F 62a_100000735457_100009816115 [0,1,0,0,0,1|2,0,0]=4 9364 B15R1.131 CC(=O)CCCCSc1cccnc1F 62a_100009816115_100000735457 [0,1,0,0,0,1|2,0,0]=4 9365 B15R1.131 CC(=O)CCCCSc1cccnc1N 62a_100000045569_100000735457 [0,1,0,0,0,1|2,0,0]=4 9366 B15R1.131 CC(=O)CCCCSc1cccnc1N 62a_100000735457_100000045569 [0,1,0,0,0,1|2,0,0]=4 9367 B15R1.131 CC(=O)CCCCSc1cccnc1O 62a_100000735457_100000760158 [0,1,0,0,0,1|2,0,0]=4 9368 B15R1.131 CC(=O)CCCCSc1cccnc1O 62a_100000760158_100000735457 [0,1,0,0,0,1|2,0,0]=4 9369 B15R1.131 CC(=O)CCCCSc1ccncc1Br 62a_100000726257_100000735457 [0,1,0,0,0,1|2,0,0]=4 9370 B15R1.131 CC(=O)CCCCSc1ccncc1Br 62a_100000735457_100000726257 [0,1,0,0,0,1|2,0,0]=4 9371 B15R1.131 CC(=O)CCCCSc1ccncc1C 62a_100000735457_100000765111 [0,1,0,0,0,1|2,0,0]=4 9372 B15R1.131 CC(=O)CCCCSc1ccncc1C 62a_100000765111_100000735457 [0,1,0,0,0,1|2,0,0]=4 9373 B15R1.131 CC(=O)CCCCSc1ccncc1Cl 62a_100000708259_100000735457 [0,1,0,0,0,1|2,0,0]=4 9374 B15R1.131 CC(=O)CCCCSc1ccncc1Cl 62a_100000735457_100000708259 [0,1,0,0,0,1|2,0,0]=4 9375 B15R1.131 CC(=O)CCCCSc1ccncc1F 62a_100000047030_100000735457 [0,1,0,0,0,1|2,0,0]=4 9376 B15R1.131 CC(=O)CCCCSc1ccncc1F 62a_100000735457_100000047030 [0,1,0,0,0,1|2,0,0]=4 9377 B15R1.131 CC(=O)CCCCSc1ccncc1N 62a_100000735457_100000756074 [0,1,0,0,0,1|2,0,0]=4 9378 B15R1.131 CC(=O)CCCCSc1ccncc1N 62a_100000756074_100000735457 [0,1,0,0,0,1|2,0,0]=4 9379 B15R1.131 CC(=O)CCCCSc1ccncc1O 62a_100000735457_100009817591 [0,1,0,0,0,1|2,0,0]=4 9380 B15R1.131 CC(=O)CCCCSc1ccncc1O 62a_100009817591_100000735457 [0,1,0,0,0,1|2,0,0]=4 9381 B15R1.131 CC(=O)CCCCSc1cnccc1Br 62a_100000735457_100010138639 [0,1,0,0,0,1|2,0,0]=4 9382 B15R1.131 CC(=O)CCCCSc1cnccc1Br 62a_100010138639_100000735457 [0,1,0,0,0,1|2,0,0]=4 9383 B15R1.131 CC(=O)CCCCSc1cnccc1C 62a_100000735457_100000761580 [0,1,0,0,0,1|2,0,0]=4 9384 B15R1.131 CC(=O)CCCCSc1cnccc1C 62a_100000761580_100000735457 [0,1,0,0,0,1|2,0,0]=4 9385 B15R1.131 CC(=O)CCCCSc1cnccc1Cl 62a_100000735457_100009995489 [0,1,0,0,0,1|2,0,0]=4 9386 B15R1.131 CC(=O)CCCCSc1cnccc1Cl 62a_100009995489_100000735457 [0,1,0,0,0,1|2,0,0]=4 9387 B15R1.131 CC(=O)CCCCSc1cnccc1F 62a_100000735457_100009820683 [0,1,0,0,0,1|2,0,0]=4 9388 B15R1.131 CC(=O)CCCCSc1cnccc1F 62a_100009820683_100000735457 [0,1,0,0,0,1|2,0,0]=4 9389 B15R1.131 CC(=O)CCCCSc1cnccc1N 62a_100000047001_100000735457 [0,1,0,0,0,1|2,0,0]=4 9390 B15R1.131 CC(=O)CCCCSc1cnccc1N 62a_100000735457_100000047001 [0,1,0,0,0,1|2,0,0]=4 9391 B15R1.131 CC(=O)CCCCSc1ncccc1Br 62a_100000696092_100000735457 [0,1,0,0,0,1|2,0,0]=4 9392 B15R1.131 CC(=O)CCCCSc1ncccc1Br 62a_100000735457_100000696092 [0,1,0,0,0,1|2,0,0]=4 9393 B15R1.131 CC(=O)CCCCSc1ncccc1C 62a_100000735457_100000751373 [0,1,0,0,0,1|2,0,0]=4 9394 B15R1.131 CC(=O)CCCCSc1ncccc1C 62a_100000751373_100000735457 [0,1,0,0,0,1|2,0,0]=4 9395 B15R1.131 CC(=O)CCCCSc1ncccc1Cl 62a_100000735457_100011356963 [0,1,0,0,0,1|2,0,0]=4 9396 B15R1.131 CC(=O)CCCCSc1ncccc1Cl 62a_100011356963_100000735457 [0,1,0,0,0,1|2,0,0]=4 9397 B15R1.131 CC(=O)CCCCSc1ncccc1F 62a_100000685392_100000735457 [0,1,0,0,0,1|2,0,0]=4 9398 B15R1.131 CC(=O)CCCCSc1ncccc1F 62a_100000735457_100000685392 [0,1,0,0,0,1|2,0,0]=4 9399 B15R1.131 CC(=O)CCCCSc1ncccc1N 62a_100000688686_100000735457 [0,1,0,0,0,1|2,0,0]=4 9400 B15R1.131 CC(=O)CCCCSc1ncccc1N 62a_100000735457_100000688686 [0,1,0,0,0,1|2,0,0]=4 9401 B15R1.131 CC(=O)CCCCSc1ncccc1O 62a_100000034122_100000735457 [0,1,0,0,0,1|2,0,0]=4 9402 B15R1.131 CC(=O)CCCCSc1ncccc1O 62a_100000735457_100000034122 [0,1,0,0,0,1|2,0,0]=4 9403 B15R1.131 CC(=O)CCCNCc1ccccc1Br 34a_100000689332_100000685027 [0,1,0,0,0,1|1,0,0]=3 9404 B15R1.131 CC(=O)CCCNCc1ccccc1C 34a_100000174972_100000685027 [0,1,0,0,0,1|1,0,0]=3 9405 B15R1.131 CC(=O)CCCNCc1ccccc1Cl 34a_100000174879_100000685027 [0,1,0,0,0,1|1,0,0]=3 9406 B15R1.131 CC(=O)CCCNCc1ccccc1F 34a_100000174869_100000685027 [0,1,0,0,0,1|1,0,0]=3 9407 B15R1.131 CC(=O)CCCNCc1ccccc1O 34a_100000185550_100000685027 [0,1,0,0,0,1|1,0,0]=3 9408 B15R1.131 CC(=O)CCCNCc1cccnc1Br 34a_100009818023_100000685027 [0,1,0,0,0,1|2,0,0]=4 9409 B15R1.131 CC(=O)CCCNCc1cccnc1Cl 34a_100015189234_100000685027 [0,1,0,0,0,1|2,0,0]=4 9410 B15R1.131 CC(=O)CCCNCc1cccnc1F 34a_100000724633_100000685027 [0,1,0,0,0,1|2,0,0]=4 9411 B15R1.131 CC(=O)CCCNCc1ccncc1F 34a_100011935246_100000685027 [0,1,0,0,0,1|2,0,0]=4 9412 B15R1.131 CC(=O)CCCNCc1ncccc1C 34a_100011223789_100000685027 [0,1,0,0,0,1|2,0,0]=4 9413 B15R1.131 CC(=O)CCCNCc1ncccc1F 34a_100000690088_100000685027 [0,1,0,0,0,1|2,0,0]=4 9414 B15R1.131 CC(=O)CCCOCc1ccccc1Br 34a_100000756307_100000685027 [0,1,0,0,0,1|1,0,0]=3 9415 B15R1.131 CC(=O)CCCOCc1ccccc1Br 34a_100000759063_100000184730 [0,1,0,0,0,1|1,0,0]=3 9416 B15R1.131 CC(=O)CCCOCc1ccccc1Br 7a_100000756307_100011215641 [0,1,0,0,0,1|1,0,0]=3 9417 B15R1.131 CC(=O)CCCOCc1ccccc1Br 7a_100000759063_100000184730 [0,1,0,0,0,1|1,0,0]=3 9418 B15R1.131 CC(=O)CCCOCc1ccccc1C 34a_100000698903_100000685027 [0,1,0,0,0,1|1,0,0]=3 9419 B15R1.131 CC(=O)CCCOCc1ccccc1C 34a_100000759063_100000211839 [0,1,0,0,0,1|1,0,0]=3 9420 B15R1.131 CC(=O)CCCOCc1ccccc1C 7a_100000698903_100011215641 [0,1,0,0,0,1|1,0,0]=3 9421 B15R1.131 CC(=O)CCCOCc1ccccc1C 7a_100000759063_100000211839 [0,1,0,0,0,1|1,0,0]=3 9422 B15R1.131 CC(=O)CCCOCc1ccccc1Cl 34a_100000210847_100000685027 [0,1,0,0,0,1|1,0,0]=3 9423 B15R1.131 CC(=O)CCCOCc1ccccc1Cl 34a_100000759063_100000187162 [0,1,0,0,0,1|1,0,0]=3 9424 B15R1.131 CC(=O)CCCOCc1ccccc1Cl 7a_100000210847_100011215641 [0,1,0,0,0,1|1,0,0]=3 9425 B15R1.131 CC(=O)CCCOCc1ccccc1Cl 7a_100000759063_100000187162 [0,1,0,0,0,1|1,0,0]=3 9426 B15R1.131 CC(=O)CCCOCc1ccccc1F 34a_100000211962_100000685027 [0,1,0,0,0,1|1,0,0]=3 9427 B15R1.131 CC(=O)CCCOCc1ccccc1F 34a_100000759063_100000211605 [0,1,0,0,0,1|1,0,0]=3 9428 B15R1.131 CC(=O)CCCOCc1ccccc1F 7a_100000211962_100011215641 [0,1,0,0,0,1|1,0,0]=3 9429 B15R1.131 CC(=O)CCCOCc1ccccc1F 7a_100000759063_100000211605 [0,1,0,0,0,1|1,0,0]=3 9430 B15R1.131 CC(=O)CCCOCc1ccccc1I 34a_100000187465_100000685027 [0,1,0,0,0,1|1,0,0]=3 9431 B15R1.131 CC(=O)CCCOCc1ccccc1I 34a_100000759063_100011215278 [0,1,0,0,0,1|1,0,0]=3 9432 B15R1.131 CC(=O)CCCOCc1ccccc1I 7a_100000187465_100011215641 [0,1,0,0,0,1|1,0,0]=3 9433 B15R1.131 CC(=O)CCCOCc1ccccc1I 7a_100000759063_100011215278 [0,1,0,0,0,1|1,0,0]=3 9434 B15R1.131 CC(=O)CCCOCc1ccccc1N 34a_100000212039_100000685027 [0,1,0,0,0,1|1,0,0]=3 9435 B15R1.131 CC(=O)CCCOCc1cccnc1Br 34a_100000719692_100000685027 [0,1,0,0,0,1|2,0,0]=4 9436 B15R1.131 CC(=O)CCCOCc1cccnc1Br 34a_100000759063_100010140945 [0,1,0,0,0,1|2,0,0]=4 9437 B15R1.131 CC(=O)CCCOCc1cccnc1Br 7a_100000719692_100011215641 [0,1,0,0,0,1|2,0,0]=4 9438 B15R1.131 CC(=O)CCCOCc1cccnc1Br 7a_100000759063_100010140945 [0,1,0,0,0,1|2,0,0]=4 9439 B15R1.131 CC(=O)CCCOCc1cccnc1C 34a_100000729262_100000685027 [0,1,0,0,0,1|2,0,0]=4 9440 B15R1.131 CC(=O)CCCOCc1cccnc1C 34a_100000759063_100000732876 [0,1,0,0,0,1|2,0,0]=4 9441 B15R1.131 CC(=O)CCCOCc1cccnc1C 7a_100000729262_100011215641 [0,1,0,0,0,1|2,0,0]=4 9442 B15R1.131 CC(=O)CCCOCc1cccnc1C 7a_100000759063_100000732876 [0,1,0,0,0,1|2,0,0]=4 9443 B15R1.131 CC(=O)CCCOCc1cccnc1Cl 34a_100000748726_100000685027 [0,1,0,0,0,1|2,0,0]=4 9444 B15R1.131 CC(=O)CCCOCc1cccnc1Cl 34a_100000759063_100000045678 [0,1,0,0,0,1|2,0,0]=4 9445 B15R1.131 CC(=O)CCCOCc1cccnc1Cl 7a_100000748726_100011215641 [0,1,0,0,0,1|2,0,0]=4 9446 B15R1.131 CC(=O)CCCOCc1cccnc1Cl 7a_100000759063_100000045678 [0,1,0,0,0,1|2,0,0]=4 9447 B15R1.131 CC(=O)CCCOCc1cccnc1F 34a_100000079888_100000685027 [0,1,0,0,0,1|2,0,0]=4 9448 B15R1.131 CC(=O)CCCOCc1cccnc1F 34a_100000759063_100000099810 [0,1,0,0,0,1|2,0,0]=4 9449 B15R1.131 CC(=O)CCCOCc1cccnc1F 7a_100000079888_100011215641 [0,1,0,0,0,1|2,0,0]=4 9450 B15R1.131 CC(=O)CCCOCc1cccnc1F 7a_100000759063_100000099810 [0,1,0,0,0,1|2,0,0]=4 9451 B15R1.131 CC(=O)CCCOCc1ccncc1C 34a_100000759063_100020672809 [0,1,0,0,0,1|2,0,0]=4 9452 B15R1.131 CC(=O)CCCOCc1ccncc1C 34a_100011997032_100000685027 [0,1,0,0,0,1|2,0,0]=4 9453 B15R1.131 CC(=O)CCCOCc1ccncc1C 7a_100000759063_100020672808 [0,1,0,0,0,1|2,0,0]=4 9454 B15R1.131 CC(=O)CCCOCc1ccncc1Cl 7a_100000759063_100000763264 [0,1,0,0,0,1|2,0,0]=4 9455 B15R1.131 CC(=O)CCCOCc1ccncc1F 34a_100012172863_100000685027 [0,1,0,0,0,1|2,0,0]=4 9456 B15R1.131 CC(=O)CCCOCc1cnccc1C 34a_100000759063_100000690890 [0,1,0,0,0,1|2,0,0]=4 9457 B15R1.131 CC(=O)CCCOCc1cnccc1C 34a_100011996381_100000685027 [0,1,0,0,0,1|2,0,0]=4 9458 B15R1.131 CC(=O)CCCOCc1cnccc1C 7a_100000759063_100000690890 [0,1,0,0,0,1|2,0,0]=4 9459 B15R1.131 CC(=O)CCCOCc1cnccc1Cl 34a_100000117392_100000685027 [0,1,0,0,0,1|2,0,0]=4 9460 B15R1.131 CC(=O)CCCOCc1ncccc1Br 34a_100000759063_100025702911 [0,1,0,0,0,1|2,0,0]=4 9461 B15R1.131 CC(=O)CCCOCc1ncccc1Br 34a_100011996772_100000685027 [0,1,0,0,0,1|2,0,0]=4 9462 B15R1.131 CC(=O)CCCOCc1ncccc1Br 7a_100000759063_100025702911 [0,1,0,0,0,1|2,0,0]=4 9463 B15R1.131 CC(=O)CCCOCc1ncccc1C 34a_100000698912_100000685027 [0,1,0,0,0,1|2,0,0]=4 9464 B15R1.131 CC(=O)CCCOCc1ncccc1C 34a_100000759063_100000696600 [0,1,0,0,0,1|2,0,0]=4 9465 B15R1.131 CC(=O)CCCOCc1ncccc1C 7a_100000759063_100000696600 [0,1,0,0,0,1|2,0,0]=4 9466 B15R1.131 CC(=O)CCCOCc1ncccc1Cl 34a_100012002383_100000685027 [0,1,0,0,0,1|2,0,0]=4 9467 B15R1.131 CC(=O)CCCOCc1ncccc1Cl 7a_100000759063_100000099807 [0,1,0,0,0,1|2,0,0]=4 9468 B15R1.131 CC(=O)CCCOCc1ncccc1F 34a_100000759063_100000104219 [0,1,0,0,0,1|2,0,0]=4 9469 B15R1.131 CC(=O)CCCOCc1ncccc1F 34a_100011934865_100000685027 [0,1,0,0,0,1|2,0,0]=4 9470 B15R1.131 CC(=O)CCCOCc1ncccc1F 7a_100000759063_100000104219 [0,1,0,0,0,1|2,0,0]=4 9471 B15R1.131 CC(=O)CCCOCc1ncccc1N 34a_114873767017_100000685027 [0,1,0,0,0,1|2,0,0]=4 9472 B15R1.131 CC(=O)CCCOCc1ncccc1O 34a_100000759063_200020655725 [0,1,0,0,0,1|2,0,0]=4 9473 B15R1.131 CC(=O)CCCOCc1ncccc1O 7a_100000759063_200020655725 [0,1,0,0,0,1|2,0,0]=4 9474 B15R1.131 CC(=O)CCCSCc1ccccc1Br 62a_100000184730_100011215641 [0,1,0,0,0,1|1,0,0]=3 9475 B15R1.131 CC(=O)CCCSCc1ccccc1Br 62a_100011215641_100000184730 [0,1,0,0,0,1|1,0,0]=3 9476 B15R1.131 CC(=O)CCCSCc1ccccc1C 62a_100000211839_100011215641 [0,1,0,0,0,1|1,0,0]=3 9477 B15R1.131 CC(=O)CCCSCc1ccccc1C 62a_100011215641_100000211839 [0,1,0,0,0,1|1,0,0]=3 9478 B15R1.131 CC(=O)CCCSCc1ccccc1Cl 62a_100000187162_100011215641 [0,1,0,0,0,1|1,0,0]=3 9479 B15R1.131 CC(=O)CCCSCc1ccccc1Cl 62a_100011215641_100000187162 [0,1,0,0,0,1|1,0,0]=3 9480 B15R1.131 CC(=O)CCCSCc1ccccc1F 62a_100000211605_100011215641 [0,1,0,0,0,1|1,0,0]=3 9481 B15R1.131 CC(=O)CCCSCc1ccccc1F 62a_100011215641_100000211605 [0,1,0,0,0,1|1,0,0]=3 9482 B15R1.131 CC(=O)CCCSCc1ccccc1I 62a_100011215641_100011216222 [0,1,0,0,0,1|1,0,0]=3 9483 B15R1.131 CC(=O)CCCSCc1ccccc1I 62a_100011216222_100011215641 [0,1,0,0,0,1|1,0,0]=3 9484 B15R1.131 CC(=O)CCCSCc1cccnc1Br 62a_100010140945_100011215641 [0,1,0,0,0,1|2,0,0]=4 9485 B15R1.131 CC(=O)CCCSCc1cccnc1Br 62a_100011215641_100010140945 [0,1,0,0,0,1|2,0,0]=4 9486 B15R1.131 CC(=O)CCCSCc1cccnc1C 62a_100000732876_100011215641 [0,1,0,0,0,1|2,0,0]=4 9487 B15R1.131 CC(=O)CCCSCc1cccnc1C 62a_100011215641_100000732876 [0,1,0,0,0,1|2,0,0]=4 9488 B15R1.131 CC(=O)CCCSCc1cccnc1Cl 62a_100000045678_100011215641 [0,1,0,0,0,1|2,0,0]=4 9489 B15R1.131 CC(=O)CCCSCc1cccnc1Cl 62a_100011215641_100000045678 [0,1,0,0,0,1|2,0,0]=4 9490 B15R1.131 CC(=O)CCCSCc1cccnc1F 62a_100000099810_100011215641 [0,1,0,0,0,1|2,0,0]=4 9491 B15R1.131 CC(=O)CCCSCc1cccnc1F 62a_100011215641_100000099810 [0,1,0,0,0,1|2,0,0]=4 9492 B15R1.131 CC(=O)CCCSCc1ccncc1C 62a_100011215641_100020672808 [0,1,0,0,0,1|2,0,0]=4 9493 B15R1.131 CC(=O)CCCSCc1ccncc1C 62a_100020672808_100011215641 [0,1,0,0,0,1|2,0,0]=4 9494 B15R1.131 CC(=O)CCCSCc1ccncc1Cl 62a_100000763264_100011215641 [0,1,0,0,0,1|2,0,0]=4 9495 B15R1.131 CC(=O)CCCSCc1ccncc1Cl 62a_100011215641_100000763264 [0,1,0,0,0,1|2,0,0]=4 9496 B15R1.131 CC(=O)CCCSCc1cnccc1C 62a_100000690890_100011215641 [0,1,0,0,0,1|2,0,0]=4 9497 B15R1.131 CC(=O)CCCSCc1cnccc1C 62a_100011215641_100000690890 [0,1,0,0,0,1|2,0,0]=4 9498 B15R1.131 CC(=O)CCCSCc1ncccc1Br 62a_100011215641_100025702911 [0,1,0,0,0,1|2,0,0]=4 9499 B15R1.131 CC(=O)CCCSCc1ncccc1Br 62a_100025702911_100011215641 [0,1,0,0,0,1|2,0,0]=4 9500 B15R1.131 CC(=O)CCCSCc1ncccc1C 62a_100000696600_100011215641 [0,1,0,0,0,1|2,0,0]=4 9501 B15R1.131 CC(=O)CCCSCc1ncccc1C 62a_100011215641_100000696600 [0,1,0,0,0,1|2,0,0]=4 9502 B15R1.131 CC(=O)CCCSCc1ncccc1Cl 62a_100000099807_100011215641 [0,1,0,0,0,1|2,0,0]=4 9503 B15R1.131 CC(=O)CCCSCc1ncccc1Cl 62a_100011215641_100000099807 [0,1,0,0,0,1|2,0,0]=4 9504 B15R1.131 CC(=O)CCCSCc1ncccc1F 62a_100000104219_100011215641 [0,1,0,0,0,1|2,0,0]=4 9505 B15R1.131 CC(=O)CCCSCc1ncccc1F 62a_100011215641_100000104219 [0,1,0,0,0,1|2,0,0]=4 9506 B15R1.131 CC(=O)CCCSCc1ncccc1O 62a_100011215641_200020655725 [0,1,0,0,0,1|2,0,0]=4 9507 B15R1.131 CC(=O)CCCSCc1ncccc1O 62a_200020655725_100011215641 [0,1,0,0,0,1|2,0,0]=4 9508 B15R1.131 CC(=O)CCOCCc1ccccc1Br 34a_100000759926_100012161201 [0,1,0,0,0,1|1,0,0]=3 9509 B15R1.131 CC(=O)CCOCCc1ccccc1Br 7a_100000731337_100000053229 [0,1,0,0,0,1|1,0,0]=3 9510 B15R1.131 CC(=O)CCOCCc1ccccc1Br 7a_100000759926_100012161201 [0,1,0,0,0,1|1,0,0]=3 9511 B15R1.131 CC(=O)CCOCCc1ccccc1C 34a_100000759926_100011713688 [0,1,0,0,0,1|1,0,0]=3 9512 B15R1.131 CC(=O)CCOCCc1ccccc1C 7a_100000759926_100011713688 [0,1,0,0,0,1|1,0,0]=3 9513 B15R1.131 CC(=O)CCOCCc1ccccc1C 7a_100011220023_100000053229 [0,1,0,0,0,1|1,0,0]=3 9514 B15R1.131 CC(=O)CCOCCc1ccccc1Cl 34a_100000759926_100011713703 [0,1,0,0,0,1|1,0,0]=3 9515 B15R1.131 CC(=O)CCOCCc1ccccc1Cl 7a_100000759926_100011713703 [0,1,0,0,0,1|1,0,0]=3 9516 B15R1.131 CC(=O)CCOCCc1ccccc1Cl 7a_100011215284_100000053229 [0,1,0,0,0,1|1,0,0]=3 9517 B15R1.131 CC(=O)CCOCCc1ccccc1F 34a_100000759926_100000720011 [0,1,0,0,0,1|1,0,0]=3 9518 B15R1.131 CC(=O)CCOCCc1ccccc1F 7a_100000753711_100000053229 [0,1,0,0,0,1|1,0,0]=3 9519 B15R1.131 CC(=O)CCOCCc1ccccc1F 7a_100000759926_100000720011 [0,1,0,0,0,1|1,0,0]=3 9520 B15R1.131 CC(=O)CCOCCc1ccccc1I 7a_100010255290_100000053229 [0,1,0,0,0,1|1,0,0]=3 9521 B15R1.131 CC(=O)CCOCCc1ccccc1O 34a_100000759926_100000722297 [0,1,0,0,0,1|1,0,0]=3 9522 B15R1.131 CC(=O)CCOCCc1ccccc1O 7a_100000759926_100000722297 [0,1,0,0,0,1|1,0,0]=3 9523 B15R1.131 CC(=O)CCOCCc1ncccc1C 7a_100011997706_100000053229 [0,1,0,0,0,1|2,0,0]=4 9524 B15R1.131 CC(=O)CCSCCc1ccccc1Br 62a_100000053229_100012161201 [0,1,0,0,0,1|1,0,0]=3 9525 B15R1.131 CC(=O)CCSCCc1ccccc1Br 62a_100012161201_100000053229 [0,1,0,0,0,1|1,0,0]=3 9526 B15R1.131 CC(=O)CCSCCc1ccccc1C 62a_100000053229_100011713688 [0,1,0,0,0,1|1,0,0]=3 9527 B15R1.131 CC(=O)CCSCCc1ccccc1C 62a_100011713688_100000053229 [0,1,0,0,0,1|1,0,0]=3 9528 B15R1.131 CC(=O)CCSCCc1ccccc1Cl 62a_100000053229_100011713703 [0,1,0,0,0,1|1,0,0]=3 9529 B15R1.131 CC(=O)CCSCCc1ccccc1Cl 62a_100011713703_100000053229 [0,1,0,0,0,1|1,0,0]=3 9530 B15R1.131 CC(=O)CCSCCc1ccccc1F 62a_100000053229_100011713696 [0,1,0,0,0,1|1,0,0]=3 9531 B15R1.131 CC(=O)CCSCCc1ccccc1F 62a_100011713696_100000053229 [0,1,0,0,0,1|1,0,0]=3 9532 B15R1.131 CC(=O)CCSCCc1ccccc1O 62a_100000053229_100000722297 [0,1,0,0,0,1|1,0,0]=3 9533 B15R1.131 CC(=O)CCSCCc1ccccc1O 62a_100000722297_100000053229 [0,1,0,0,0,1|1,0,0]=3 9534 B15R1.131 CC(=O)COCCCc1ccccc1Br 34a_100000211253_200011713681 [0,1,0,0,0,1|1,0,0]=3 9535 B15R1.131 CC(=O)COCCOc1ccccc1Br 34a_100000211253_100000695877 [0,1,0,0,0,1|2,0,0]=4 9536 B15R1.131 CC(=O)COCCOc1ccccc1C 34a_100000211253_100000184434 [0,1,0,0,0,1|2,0,0]=4 9537 B15R1.131 CC(=O)COCCOc1ccccc1F 34a_100000211253_100000183290 [0,1,0,0,0,1|2,0,0]=4 9538 B15R1.131 CC(=O)NCCCOc1ccccc1C 11a_106633784460_100015343762 [0,1,0,0,0,1|2,0,0]=4 9539 B15R1.131 CC(=O)NCCCOc1ccccc1C 1626a_106633784460_100015343762 [0,1,0,0,0,1|2,0,0]=4 9540 B15R1.131 CC(=O)NCCCOc1ccccc1C 240690a_106633784460_100015343762 [0,1,0,0,0,1|2,0,0]=4 9541 B15R1.131 CC(=O)NCCCOc1ccccc1C 527a_106633784460_100103153847 [0,1,0,0,0,1|2,0,0]=4 9542 B15R1.131 CC(=O)NCCCOc1ccccc1F 11a_100000707858_100015343762 [0,1,0,0,0,1|2,0,0]=4 9543 B15R1.131 CC(=O)NCCCOc1ccccc1F 1626a_100000707858_100015343762 [0,1,0,0,0,1|2,0,0]=4 9544 B15R1.131 CC(=O)NCCCOc1ccccc1F 240690a_100000707858_100015343762 [0,1,0,0,0,1|2,0,0]=4 9545 B15R1.131 CC(=O)NCCCOc1ccccc1F 527a_100000707858_100103153847 [0,1,0,0,0,1|2,0,0]=4 9546 B15R1.131 CC(=O)NCCNCc1ccccc1Br 207a_100000209853_100000211189 [0,1,0,0,0,1|2,0,0]=4 9547 B15R1.131 CC(=O)NCCNCc1ccccc1Br 2230a_100000209853_100000184730 [0,1,0,0,0,1|2,0,0]=4 9548 B15R1.131 CC(=O)NCCNCc1ccccc1Br 2230a_100000689332_100000189650 [0,1,0,0,0,1|2,0,0]=4 9549 B15R1.131 CC(=O)NCCNCc1ccccc1C 207a_100000209853_100000211143 [0,1,0,0,0,1|2,0,0]=4 9550 B15R1.131 CC(=O)NCCNCc1ccccc1C 2230a_100000209853_100000211839 [0,1,0,0,0,1|2,0,0]=4 9551 B15R1.131 CC(=O)NCCNCc1ccccc1Cl 207a_100000209853_100000210073 [0,1,0,0,0,1|2,0,0]=4 9552 B15R1.131 CC(=O)NCCNCc1ccccc1Cl 2230a_100000174879_100000189650 [0,1,0,0,0,1|2,0,0]=4 9553 B15R1.131 CC(=O)NCCNCc1ccccc1Cl 2230a_100000209853_100000187162 [0,1,0,0,0,1|2,0,0]=4 9554 B15R1.131 CC(=O)NCCNCc1ccccc1F 207a_100000209853_100000210811 [0,1,0,0,0,1|2,0,0]=4 9555 B15R1.131 CC(=O)NCCNCc1ccccc1F 2230a_100000209853_100000211605 [0,1,0,0,0,1|2,0,0]=4 9556 B15R1.131 CC(=O)NCCNCc1ccccc1I 207a_100000209853_100000010305 [0,1,0,0,0,1|2,0,0]=4 9557 B15R1.131 CC(=O)NCCNCc1ccccc1I 2230a_100000209853_100011215278 [0,1,0,0,0,1|2,0,0]=4 9558 B15R1.131 CC(=O)NCCOCc1ccccc1Br 34a_100000158858_100000184730 [0,1,0,0,0,1|2,0,0]=4 9559 B15R1.131 CC(=O)NCCOCc1ccccc1Br 7a_100000756307_100000189650 [0,1,0,0,0,1|2,0,0]=4 9560 B15R1.131 CC(=O)NCCOCc1ccccc1C 34a_100000158858_100000211839 [0,1,0,0,0,1|2,0,0]=4 9561 B15R1.131 CC(=O)NCCOCc1ccccc1C 7a_100000698903_100000189650 [0,1,0,0,0,1|2,0,0]=4 9562 B15R1.131 CC(=O)NCCOCc1ccccc1Cl 11a_100000745786_100015343762 [0,1,0,0,0,1|2,0,0]=4 9563 B15R1.131 CC(=O)NCCOCc1ccccc1Cl 1626a_100000745786_100015343762 [0,1,0,0,0,1|2,0,0]=4 9564 B15R1.131 CC(=O)NCCOCc1ccccc1Cl 240690a_100000745786_100015343762 [0,1,0,0,0,1|2,0,0]=4 9565 B15R1.131 CC(=O)NCCOCc1ccccc1Cl 34a_100000158858_100000187162 [0,1,0,0,0,1|2,0,0]=4 9566 B15R1.131 CC(=O)NCCOCc1ccccc1Cl 527a_100000745786_100103153847 [0,1,0,0,0,1|2,0,0]=4 9567 B15R1.131 CC(=O)NCCOCc1ccccc1Cl 7a_100000210847_100000189650 [0,1,0,0,0,1|2,0,0]=4 9568 B15R1.131 CC(=O)NCCOCc1ccccc1F 34a_100000158858_100000211605 [0,1,0,0,0,1|2,0,0]=4 9569 B15R1.131 CC(=O)NCCOCc1ccccc1F 7a_100000211962_100000189650 [0,1,0,0,0,1|2,0,0]=4 9570 B15R1.131 CC(=O)NCCOCc1ccccc1I 34a_100000158858_100011215278 [0,1,0,0,0,1|2,0,0]=4 9571 B15R1.131 CC(=O)NCCOCc1ccccc1I 7a_100000187465_100000189650 [0,1,0,0,0,1|2,0,0]=4 9572 B15R1.131 CC(=O)NCCSCc1ccccc1Br 62a_100000184730_100000189650 [0,1,0,0,0,1|2,0,0]=4 9573 B15R1.131 CC(=O)NCCSCc1ccccc1Br 62a_100000189650_100000184730 [0,1,0,0,0,1|2,0,0]=4 9574 B15R1.131 CC(=O)NCCSCc1ccccc1C 11a_200000189569_100015343762 [0,1,0,0,0,1|2,0,0]=4 9575 B15R1.131 CC(=O)NCCSCc1ccccc1C 240690a_200000189569_100015343762 [0,1,0,0,0,1|2,0,0]=4 9576 B15R1.131 CC(=O)NCCSCc1ccccc1C 527a_200000189569_100103153847 [0,1,0,0,0,1|2,0,0]=4 9577 B15R1.131 CC(=O)NCCSCc1ccccc1C 62a_100000189650_100000211839 [0,1,0,0,0,1|2,0,0]=4 9578 B15R1.131 CC(=O)NCCSCc1ccccc1C 62a_100000211839_100000189650 [0,1,0,0,0,1|2,0,0]=4 9579 B15R1.131 CC(=O)NCCSCc1ccccc1Cl 11a_100011219180_100015343762 [0,1,0,0,0,1|2,0,0]=4 9580 B15R1.131 CC(=O)NCCSCc1ccccc1Cl 1626a_100011219180_100015343762 [0,1,0,0,0,1|2,0,0]=4 9581 B15R1.131 CC(=O)NCCSCc1ccccc1Cl 240690a_100011219180_100015343762 [0,1,0,0,0,1|2,0,0]=4 9582 B15R1.131 CC(=O)NCCSCc1ccccc1Cl 527a_100011219180_100103153847 [0,1,0,0,0,1|2,0,0]=4 9583 B15R1.131 CC(=O)NCCSCc1ccccc1Cl 62a_100000187162_100000189650 [0,1,0,0,0,1|2,0,0]=4 9584 B15R1.131 CC(=O)NCCSCc1ccccc1Cl 62a_100000189650_100000187162 [0,1,0,0,0,1|2,0,0]=4 9585 B15R1.131 CC(=O)NCCSCc1ccccc1F 62a_100000189650_100000211605 [0,1,0,0,0,1|2,0,0]=4 9586 B15R1.131 CC(=O)NCCSCc1ccccc1F 62a_100000211605_100000189650 [0,1,0,0,0,1|2,0,0]=4 9587 B15R1.131 CC(=O)NCCSCc1ccccc1I 62a_100000189650_100011216222 [0,1,0,0,0,1|2,0,0]=4 9588 B15R1.131 CC(=O)NCCSCc1ccccc1I 62a_100011216222_100000189650 [0,1,0,0,0,1|2,0,0]=4 9589 B15R1.131 CC(=O)OCCCNc1ccccc1Br 34a_100000210017_100000042594 [0,1,0,0,0,1|2,0,0]=4 9590 B15R1.131 CC(=O)OCCCNc1ccccc1C 34a_100015192222_100000042594 [0,1,0,0,0,1|2,0,0]=4 9591 B15R1.131 CC(=O)OCCCNc1ccccc1Cl 34a_100000185783_100000042594 [0,1,0,0,0,1|2,0,0]=4 9592 B15R1.131 CC(=O)OCCCNc1ccccc1F 34a_100000210422_100000042594 [0,1,0,0,0,1|2,0,0]=4 9593 B15R1.131 CC(=O)OCCCNc1ccccc1I 34a_100000210053_100000042594 [0,1,0,0,0,1|2,0,0]=4 9594 B15R1.131 CC(=O)OCCCNc1ccccc1O 34a_100000185747_100000042594 [0,1,0,0,0,1|2,0,0]=4 9595 B15R1.131 CC(=O)OCCCOc1ccccc1Br 34a_100000181306_100000042594 [0,1,0,0,0,1|2,0,0]=4 9596 B15R1.131 CC(=O)OCCCOc1ccccc1Br 7a_100000181306_100000042594 [0,1,0,0,0,1|2,0,0]=4 9597 B15R1.131 CC(=O)OCCCOc1ccccc1C 34a_100000210338_100000042594 [0,1,0,0,0,1|2,0,0]=4 9598 B15R1.131 CC(=O)OCCCOc1ccccc1C 7a_100000210338_100000042594 [0,1,0,0,0,1|2,0,0]=4 9599 B15R1.131 CC(=O)OCCCOc1ccccc1Cl 34a_100000210172_100000042594 [0,1,0,0,0,1|2,0,0]=4 9600 B15R1.131 CC(=O)OCCCOc1ccccc1Cl 7a_100000210172_100000042594 [0,1,0,0,0,1|2,0,0]=4 9601 B15R1.131 CC(=O)OCCCOc1ccccc1F 34a_100000210171_100000042594 [0,1,0,0,0,1|2,0,0]=4 9602 B15R1.131 CC(=O)OCCCOc1ccccc1F 7a_100000210171_100000042594 [0,1,0,0,0,1|2,0,0]=4 9603 B15R1.131 CC(=O)OCCCOc1ccccc1I 34a_100000739446_100000042594 [0,1,0,0,0,1|2,0,0]=4 9604 B15R1.131 CC(=O)OCCCOc1ccccc1I 7a_100000739446_100000042594 [0,1,0,0,0,1|2,0,0]=4 9605 B15R1.131 CC(=O)OCCCOc1ccccc1N 34a_100000185747_100000042594 [0,1,0,0,0,1|2,0,0]=4 9606 B15R1.131 CC(=O)OCCCOc1ccccc1N 7a_100000185747_100000042594 [0,1,0,0,0,1|2,0,0]=4 9607 B15R1.131 CC(=O)OCCCSc1ccccc1Br 62a_100000042594_100000695589 [0,1,0,0,0,1|2,0,0]=4 9608 B15R1.131 CC(=O)OCCCSc1ccccc1Br 62a_100000695589_100000042594 [0,1,0,0,0,1|2,0,0]=4 9609 B15R1.131 CC(=O)OCCCSc1ccccc1C 62a_100000042594_100000210755 [0,1,0,0,0,1|2,0,0]=4 9610 B15R1.131 CC(=O)OCCCSc1ccccc1C 62a_100000210755_100000042594 [0,1,0,0,0,1|2,0,0]=4 9611 B15R1.131 CC(=O)OCCCSc1ccccc1Cl 62a_100000042594_100000764095 [0,1,0,0,0,1|2,0,0]=4 9612 B15R1.131 CC(=O)OCCCSc1ccccc1Cl 62a_100000764095_100000042594 [0,1,0,0,0,1|2,0,0]=4 9613 B15R1.131 CC(=O)OCCCSc1ccccc1F 62a_100000042594_100011215700 [0,1,0,0,0,1|2,0,0]=4 9614 B15R1.131 CC(=O)OCCCSc1ccccc1F 62a_100011215700_100000042594 [0,1,0,0,0,1|2,0,0]=4 9615 B15R1.131 CC(=O)OCCCSc1ccccc1N 62a_100000042594_100000210017 [0,1,0,0,0,1|2,0,0]=4 9616 B15R1.131 CC(=O)OCCCSc1ccccc1N 62a_100000210017_100000042594 [0,1,0,0,0,1|2,0,0]=4 9617 B15R1.131 CC(=O)OCCCSc1ccccc1O 62a_100000042594_100000739446 [0,1,0,0,0,1|2,0,0]=4 9618 B15R1.131 CC(=O)OCCCSc1ccccc1O 62a_100000739446_100000042594 [0,1,0,0,0,1|2,0,0]=4 9619 B15R1.131 CC(=O)OCCNCc1ccccc1Br 34a_100000689332_100009814007 [0,1,0,0,0,1|2,0,0]=4 9620 B15R1.131 CC(=O)OCCNCc1ccccc1C 34a_100000174972_100009814007 [0,1,0,0,0,1|2,0,0]=4 9621 B15R1.131 CC(=O)OCCNCc1ccccc1Cl 34a_100000174879_100009814007 [0,1,0,0,0,1|2,0,0]=4 9622 B15R1.131 CC(=O)OCCNCc1ccccc1F 34a_100000174869_100009814007 [0,1,0,0,0,1|2,0,0]=4 9623 B15R1.131 CC(=O)OCCNCc1ccccc1O 34a_100000185550_100009814007 [0,1,0,0,0,1|2,0,0]=4 9624 B15R1.131 CC(=O)OCCOCc1ccccc1Br 34a_100000756307_100009814007 [0,1,0,0,0,1|2,0,0]=4 9625 B15R1.131 CC(=O)OCCOCc1ccccc1Br 7a_100000756307_100009814007 [0,1,0,0,0,1|2,0,0]=4 9626 B15R1.131 CC(=O)OCCOCc1ccccc1C 34a_100000698903_100009814007 [0,1,0,0,0,1|2,0,0]=4 9627 B15R1.131 CC(=O)OCCOCc1ccccc1C 7a_100000698903_100009814007 [0,1,0,0,0,1|2,0,0]=4 9628 B15R1.131 CC(=O)OCCOCc1ccccc1Cl 34a_100000210847_100009814007 [0,1,0,0,0,1|2,0,0]=4 9629 B15R1.131 CC(=O)OCCOCc1ccccc1Cl 7a_100000210847_100009814007 [0,1,0,0,0,1|2,0,0]=4 9630 B15R1.131 CC(=O)OCCOCc1ccccc1F 34a_100000211962_100009814007 [0,1,0,0,0,1|2,0,0]=4 9631 B15R1.131 CC(=O)OCCOCc1ccccc1F 7a_100000211962_100009814007 [0,1,0,0,0,1|2,0,0]=4 9632 B15R1.131 CC(=O)OCCOCc1ccccc1I 34a_100000187465_100009814007 [0,1,0,0,0,1|2,0,0]=4 9633 B15R1.131 CC(=O)OCCOCc1ccccc1I 7a_100000187465_100009814007 [0,1,0,0,0,1|2,0,0]=4 9634 B15R1.131 CC(=O)OCCOCc1ccccc1N 34a_100000212039_100009814007 [0,1,0,0,0,1|2,0,0]=4 9635 B15R1.131 CC(=O)OCCSCc1ccccc1Br 62a_100000184730_100009814007 [0,1,0,0,0,1|2,0,0]=4 9636 B15R1.131 CC(=O)OCCSCc1ccccc1Br 62a_100009814007_100000184730 [0,1,0,0,0,1|2,0,0]=4 9637 B15R1.131 CC(=O)OCCSCc1ccccc1C 62a_100000211839_100009814007 [0,1,0,0,0,1|2,0,0]=4 9638 B15R1.131 CC(=O)OCCSCc1ccccc1C 62a_100009814007_100000211839 [0,1,0,0,0,1|2,0,0]=4 9639 B15R1.131 CC(=O)OCCSCc1ccccc1Cl 62a_100000187162_100009814007 [0,1,0,0,0,1|2,0,0]=4 9640 B15R1.131 CC(=O)OCCSCc1ccccc1Cl 62a_100009814007_100000187162 [0,1,0,0,0,1|2,0,0]=4 9641 B15R1.131 CC(=O)OCCSCc1ccccc1F 62a_100000211605_100009814007 [0,1,0,0,0,1|2,0,0]=4 9642 B15R1.131 CC(=O)OCCSCc1ccccc1F 62a_100009814007_100000211605 [0,1,0,0,0,1|2,0,0]=4 9643 B15R1.131 CC(=O)OCCSCc1ccccc1I 62a_100009814007_100011216222 [0,1,0,0,0,1|2,0,0]=4 9644 B15R1.131 CC(=O)OCCSCc1ccccc1I 62a_100011216222_100009814007 [0,1,0,0,0,1|2,0,0]=4 9645 B15R1.131 CC(=O)OCNCCc1ccccc1Br 34a_100000747383_100009813279 [0,1,0,0,0,1|2,0,0]=4 9646 B15R1.131 CC(=O)OCNCCc1ccccc1C 34a_100000685071_100009813279 [0,1,0,0,0,1|2,0,0]=4 9647 B15R1.131 CC(=O)OCNCCc1ccccc1Cl 34a_100011207228_100009813279 [0,1,0,0,0,1|2,0,0]=4 9648 B15R1.131 CC(=O)OCNCCc1ccccc1F 34a_100000185272_100009813279 [0,1,0,0,0,1|2,0,0]=4 9649 B15R1.131 CC(=O)OCNCCc1ccccc1O 34a_100011207237_100009813279 [0,1,0,0,0,1|2,0,0]=4 9650 B15R1.131 CC(=O)OCOCCc1ccccc1Br 34a_100000731337_100009813279 [0,1,0,0,0,1|2,0,0]=4 9651 B15R1.131 CC(=O)OCOCCc1ccccc1C 34a_100011220023_100009813279 [0,1,0,0,0,1|2,0,0]=4 9652 B15R1.131 CC(=O)OCOCCc1ccccc1Cl 34a_100011215284_100009813279 [0,1,0,0,0,1|2,0,0]=4 9653 B15R1.131 CC(=O)OCOCCc1ccccc1F 34a_100000753711_100009813279 [0,1,0,0,0,1|2,0,0]=4 9654 B15R1.131 CC(=O)OCOCCc1ccccc1I 34a_100010255290_100009813279 [0,1,0,0,0,1|2,0,0]=4 9655 B15R1.131 CC(=O)OCOCCc1ccccc1N 34a_100011215289_100009813279 [0,1,0,0,0,1|2,0,0]=4 9656 B15R1.131 CC(=O)OCSCCc1ccccc1Br 62a_100000076356_100012161201 [0,1,0,0,0,1|2,0,0]=4 9657 B15R1.131 CC(=O)OCSCCc1ccccc1Br 62a_100012161201_100000076356 [0,1,0,0,0,1|2,0,0]=4 9658 B15R1.131 CC(=O)OCSCCc1ccccc1C 62a_100000076356_100011713688 [0,1,0,0,0,1|2,0,0]=4 9659 B15R1.131 CC(=O)OCSCCc1ccccc1C 62a_100011713688_100000076356 [0,1,0,0,0,1|2,0,0]=4 9660 B15R1.131 CC(=O)OCSCCc1ccccc1Cl 62a_100000076356_100011713703 [0,1,0,0,0,1|2,0,0]=4 9661 B15R1.131 CC(=O)OCSCCc1ccccc1Cl 62a_100011713703_100000076356 [0,1,0,0,0,1|2,0,0]=4 9662 B15R1.131 CC(=O)OCSCCc1ccccc1F 62a_100000076356_100011713696 [0,1,0,0,0,1|2,0,0]=4 9663 B15R1.131 CC(=O)OCSCCc1ccccc1F 62a_100011713696_100000076356 [0,1,0,0,0,1|2,0,0]=4 9664 B15R1.131 CC(=O)OCSCCc1ccccc1O 62a_100000076356_100000722297 [0,1,0,0,0,1|2,0,0]=4 9665 B15R1.131 CC(=O)OCSCCc1ccccc1O 62a_100000722297_100000076356 [0,1,0,0,0,1|2,0,0]=4 9666 B15R1.131 CC(=O)SCCCNc1ccccc1Br 34a_100000210017_100000038929 [0,1,0,0,0,1|2,0,0]=4 9667 B15R1.131 CC(=O)SCCCNc1ccccc1C 34a_100015192222_100000038929 [0,1,0,0,0,1|2,0,0]=4 9668 B15R1.131 CC(=O)SCCCNc1ccccc1Cl 34a_100000185783_100000038929 [0,1,0,0,0,1|2,0,0]=4 9669 B15R1.131 CC(=O)SCCCNc1ccccc1F 34a_100000210422_100000038929 [0,1,0,0,0,1|2,0,0]=4 9670 B15R1.131 CC(=O)SCCCNc1ccccc1I 34a_100000210053_100000038929 [0,1,0,0,0,1|2,0,0]=4 9671 B15R1.131 CC(=O)SCCCNc1ccccc1O 34a_100000185747_100000038929 [0,1,0,0,0,1|2,0,0]=4 9672 B15R1.131 CC(=O)SCCCOc1ccccc1Br 34a_100000181306_100000038929 [0,1,0,0,0,1|2,0,0]=4 9673 B15R1.131 CC(=O)SCCCOc1ccccc1Br 7a_100000181306_100000038929 [0,1,0,0,0,1|2,0,0]=4 9674 B15R1.131 CC(=O)SCCCOc1ccccc1C 34a_100000210338_100000038929 [0,1,0,0,0,1|2,0,0]=4 9675 B15R1.131 CC(=O)SCCCOc1ccccc1C 7a_100000210338_100000038929 [0,1,0,0,0,1|2,0,0]=4 9676 B15R1.131 CC(=O)SCCCOc1ccccc1Cl 34a_100000210172_100000038929 [0,1,0,0,0,1|2,0,0]=4 9677 B15R1.131 CC(=O)SCCCOc1ccccc1Cl 7a_100000210172_100000038929 [0,1,0,0,0,1|2,0,0]=4 9678 B15R1.131 CC(=O)SCCCOc1ccccc1F 34a_100000210171_100000038929 [0,1,0,0,0,1|2,0,0]=4 9679 B15R1.131 CC(=O)SCCCOc1ccccc1F 7a_100000210171_100000038929 [0,1,0,0,0,1|2,0,0]=4 9680 B15R1.131 CC(=O)SCCCOc1ccccc1I 34a_100000739446_100000038929 [0,1,0,0,0,1|2,0,0]=4 9681 B15R1.131 CC(=O)SCCCOc1ccccc1I 7a_100000739446_100000038929 [0,1,0,0,0,1|2,0,0]=4 9682 B15R1.131 CC(=O)SCCCOc1ccccc1N 34a_100000185747_100000038929 [0,1,0,0,0,1|2,0,0]=4 9683 B15R1.131 CC(=O)SCCCOc1ccccc1N 7a_100000185747_100000038929 [0,1,0,0,0,1|2,0,0]=4 9684 B15R1.131 CC(=O)SCCCSc1ccccc1Br 62a_100000038929_100000695589 [0,1,0,0,0,1|2,0,0]=4 9685 B15R1.131 CC(=O)SCCCSc1ccccc1Br 62a_100000695589_100000038929 [0,1,0,0,0,1|2,0,0]=4 9686 B15R1.131 CC(=O)SCCCSc1ccccc1C 62a_100000038929_100000210755 [0,1,0,0,0,1|2,0,0]=4 9687 B15R1.131 CC(=O)SCCCSc1ccccc1C 62a_100000210755_100000038929 [0,1,0,0,0,1|2,0,0]=4 9688 B15R1.131 CC(=O)SCCCSc1ccccc1Cl 62a_100000038929_100000764095 [0,1,0,0,0,1|2,0,0]=4 9689 B15R1.131 CC(=O)SCCCSc1ccccc1Cl 62a_100000764095_100000038929 [0,1,0,0,0,1|2,0,0]=4 9690 B15R1.131 CC(=O)SCCCSc1ccccc1F 62a_100000038929_100011215700 [0,1,0,0,0,1|2,0,0]=4 9691 B15R1.131 CC(=O)SCCCSc1ccccc1F 62a_100011215700_100000038929 [0,1,0,0,0,1|2,0,0]=4 9692 B15R1.131 CC(=O)SCCCSc1ccccc1N 62a_100000038929_100000210017 [0,1,0,0,0,1|2,0,0]=4 9693 B15R1.131 CC(=O)SCCCSc1ccccc1N 62a_100000210017_100000038929 [0,1,0,0,0,1|2,0,0]=4 9694 B15R1.131 CC(=O)SCCCSc1ccccc1O 62a_100000038929_100000739446 [0,1,0,0,0,1|2,0,0]=4 9695 B15R1.131 CC(=O)SCCCSc1ccccc1O 62a_100000739446_100000038929 [0,1,0,0,0,1|2,0,0]=4 9696 B15R1.131 CC(O)CCCNCc1ccccc1Br 2230a_100000689332_200000718107 [0,1,0,0,0,1|1,0,1]=4 9697 B15R1.131 CC(O)CCCNCc1ccccc1Br 34a_100000689332_200000718107 [0,1,0,0,0,1|1,0,1]=4 9698 B15R1.131 CC(O)CCCNCc1ccccc1Cl 2230a_100000174879_200000718107 [0,1,0,0,0,1|1,0,1]=4 9699 B15R1.131 CC(O)CCCNCc1ccccc1Cl 34a_100000174879_200000718107 [0,1,0,0,0,1|1,0,1]=4 9700 B15R1.131 CC(O)CCCNCc1ccccc1F 34a_100000174869_200000718107 [0,1,0,0,0,1|1,0,1]=4 9701 B15R1.131 CC(O)CCCNCc1ccccc1O 34a_100000185550_200000718107 [0,1,0,0,0,1|1,0,1]=4 9702 B15R1.131 CC(O)CCCOCc1ccccc1Br 34a_100000756307_200000718107 [0,1,0,0,0,1|1,0,1]=4 9703 B15R1.131 CC(O)CCCOCc1ccccc1Br 7a_100000756307_200000718107 [0,1,0,0,0,1|1,0,1]=4 9704 B15R1.131 CC(O)CCCOCc1ccccc1Cl 34a_100000210847_200000718107 [0,1,0,0,0,1|1,0,1]=4 9705 B15R1.131 CC(O)CCCOCc1ccccc1Cl 7a_100000210847_200000718107 [0,1,0,0,0,1|1,0,1]=4 9706 B15R1.131 CC(O)CCCOCc1ccccc1F 34a_100000211962_200000718107 [0,1,0,0,0,1|1,0,1]=4 9707 B15R1.131 CC(O)CCCOCc1ccccc1F 7a_100000211962_200000718107 [0,1,0,0,0,1|1,0,1]=4 9708 B15R1.131 CC(O)CCCOCc1ccccc1I 34a_100000187465_200000718107 [0,1,0,0,0,1|1,0,1]=4 9709 B15R1.131 CC(O)CCCOCc1ccccc1I 7a_100000187465_200000718107 [0,1,0,0,0,1|1,0,1]=4 9710 B15R1.131 CC(O)CCCOCc1ccccc1N 34a_100000212039_200000718107 [0,1,0,0,0,1|1,0,1]=4 9711 B15R1.131 CC(O)CCCSCc1ccccc1Br 62a_100000184730_200000718107 [0,1,0,0,0,1|1,0,1]=4 9712 B15R1.131 CC(O)CCCSCc1ccccc1Br 62a_200000718107_100000184730 [0,1,0,0,0,1|1,0,1]=4 9713 B15R1.131 CC(O)CCCSCc1ccccc1Cl 62a_100000187162_200000718107 [0,1,0,0,0,1|1,0,1]=4 9714 B15R1.131 CC(O)CCCSCc1ccccc1Cl 62a_200000718107_100000187162 [0,1,0,0,0,1|1,0,1]=4 9715 B15R1.131 CC(O)CCCSCc1ccccc1F 62a_100000211605_200000718107 [0,1,0,0,0,1|1,0,1]=4 9716 B15R1.131 CC(O)CCCSCc1ccccc1F 62a_200000718107_100000211605 [0,1,0,0,0,1|1,0,1]=4 9717 B15R1.131 CC(O)CCCSCc1ccccc1I 62a_100011216222_200000718107 [0,1,0,0,0,1|1,0,1]=4 9718 B15R1.131 CC(O)CCCSCc1ccccc1I 62a_200000718107_100011216222 [0,1,0,0,0,1|1,0,1]=4 9719 B15R1.131 CC(O)CCNCCc1ccccc1Br 2230a_100000747383_100012276601 [0,1,0,0,0,1|1,0,1]=4 9720 B15R1.131 CC(O)CCNCCc1ccccc1Br 2230a_200000755665_100012161201 [0,1,0,0,0,1|1,0,1]=4 9721 B15R1.131 CC(O)CCNCCc1ccccc1Br 34a_100000747383_100012276601 [0,1,0,0,0,1|1,0,1]=4 9722 B15R1.131 CC(O)CCNCCc1ccccc1Cl 2230a_100011207228_100012276601 [0,1,0,0,0,1|1,0,1]=4 9723 B15R1.131 CC(O)CCNCCc1ccccc1Cl 2230a_200000755665_100011713703 [0,1,0,0,0,1|1,0,1]=4 9724 B15R1.131 CC(O)CCNCCc1ccccc1Cl 270004a_200000755665_200011713468 [0,1,0,0,0,1|1,0,1]=4 9725 B15R1.131 CC(O)CCNCCc1ccccc1Cl 34a_100011207228_100012276601 [0,1,0,0,0,1|1,0,1]=4 9726 B15R1.131 CC(O)CCNCCc1ccccc1F 2230a_100000185272_100012276601 [0,1,0,0,0,1|1,0,1]=4 9727 B15R1.131 CC(O)CCNCCc1ccccc1F 2230a_200000755665_100011713696 [0,1,0,0,0,1|1,0,1]=4 9728 B15R1.131 CC(O)CCNCCc1ccccc1F 34a_100000185272_100012276601 [0,1,0,0,0,1|1,0,1]=4 9729 B15R1.131 CC(O)CCNCCc1ccccc1O 34a_100011207237_100012276601 [0,1,0,0,0,1|1,0,1]=4 9730 B15R1.131 CC(O)CCOCCc1ccccc1Br 34a_100000731337_100012276601 [0,1,0,0,0,1|1,0,1]=4 9731 B15R1.131 CC(O)CCOCCc1ccccc1Br 7a_100000731337_100012276601 [0,1,0,0,0,1|1,0,1]=4 9732 B15R1.131 CC(O)CCOCCc1ccccc1Cl 34a_100011215284_100012276601 [0,1,0,0,0,1|1,0,1]=4 9733 B15R1.131 CC(O)CCOCCc1ccccc1Cl 7a_100011215284_100012276601 [0,1,0,0,0,1|1,0,1]=4 9734 B15R1.131 CC(O)CCOCCc1ccccc1F 34a_100000753711_100012276601 [0,1,0,0,0,1|1,0,1]=4 9735 B15R1.131 CC(O)CCOCCc1ccccc1F 7a_100000753711_100012276601 [0,1,0,0,0,1|1,0,1]=4 9736 B15R1.131 CC(O)CCOCCc1ccccc1I 34a_100010255290_100012276601 [0,1,0,0,0,1|1,0,1]=4 9737 B15R1.131 CC(O)CCOCCc1ccccc1I 7a_100010255290_100012276601 [0,1,0,0,0,1|1,0,1]=4 9738 B15R1.131 CC(O)CCOCCc1ccccc1N 34a_100011215289_100012276601 [0,1,0,0,0,1|1,0,1]=4 9739 B15R1.131 CC(O)CCSCCc1ccccc1Br 62a_100012161201_100012276601 [0,1,0,0,0,1|1,0,1]=4 9740 B15R1.131 CC(O)CCSCCc1ccccc1Br 62a_100012276601_100012161201 [0,1,0,0,0,1|1,0,1]=4 9741 B15R1.131 CC(O)CCSCCc1ccccc1Cl 62a_100011713703_100012276601 [0,1,0,0,0,1|1,0,1]=4 9742 B15R1.131 CC(O)CCSCCc1ccccc1Cl 62a_100012276601_100011713703 [0,1,0,0,0,1|1,0,1]=4 9743 B15R1.131 CC(O)CCSCCc1ccccc1F 62a_100011713696_100012276601 [0,1,0,0,0,1|1,0,1]=4 9744 B15R1.131 CC(O)CCSCCc1ccccc1F 62a_100012276601_100011713696 [0,1,0,0,0,1|1,0,1]=4 9745 B15R1.131 CC(O)CCSCCc1ccccc1O 62a_100000722297_100012276601 [0,1,0,0,0,1|1,0,1]=4 9746 B15R1.131 CC(O)CCSCCc1ccccc1O 62a_100012276601_100000722297 [0,1,0,0,0,1|1,0,1]=4 9747 B15R1.131 CC(O)CNCCCc1ccccc1Br 2230a_100000210904_200011713681 [0,1,0,0,0,1|1,0,1]=4 9748 B15R1.131 CC(O)CNCCCc1ccccc1Br 34a_100000210904_200011713681 [0,1,0,0,0,1|1,0,1]=4 9749 B15R1.131 CC(O)CNCCCc1ccccc1F 2230a_100000724733_100011218427 [0,1,0,0,0,1|1,0,1]=4 9750 B15R1.131 CC(O)CNCCCc1ccccc1F 34a_100000724733_100011218427 [0,1,0,0,0,1|1,0,1]=4 9751 B15R1.131 CC(O)COCCCc1ccccc1Br 34a_100000699526_100011218427 [0,1,0,0,0,1|1,0,1]=4 9752 B15R1.131 CC(O)COCCCc1ccccc1Br 7a_100000699526_100011218427 [0,1,0,0,0,1|1,0,1]=4 9753 B15R1.131 CC(O)COCCCc1ccccc1Cl 34a_100011709251_100011218427 [0,1,0,0,0,1|1,0,1]=4 9754 B15R1.131 CC(O)COCCCc1ccccc1Cl 7a_100011709251_100011218427 [0,1,0,0,0,1|1,0,1]=4 9755 B15R1.131 CC(O)COCCCc1ccccc1F 34a_100011709249_100011218427 [0,1,0,0,0,1|1,0,1]=4 9756 B15R1.131 CC(O)COCCCc1ccccc1F 7a_100011709249_100011218427 [0,1,0,0,0,1|1,0,1]=4 9757 B15R1.131 CC(O)CSCCCc1ccccc1Br 62a_100011218427_200011713681 [0,1,0,0,0,1|1,0,1]=4 9758 B15R1.131 CC(O)CSCCCc1ccccc1Br 62a_200011713681_100011218427 [0,1,0,0,0,1|1,0,1]=4 9759 B15R1.131 CS(=O)CCCNCc1ccccc1Br 207a_200000753449_100000211189 [0,1,0,0,0,1|2,0,0]=4 9760 B15R1.131 CS(=O)CCCNCc1ccccc1Br 2230a_200000753449_100000184730 [0,1,0,0,0,1|2,0,0]=4 9761 B15R1.131 CS(=O)CCCNCc1ccccc1Br 270004a_200000753449_100000211189 [0,1,0,0,0,1|2,0,0]=4 9762 B15R1.131 CS(=O)CCCNCc1ccccc1Cl 207a_200000753449_100000210073 [0,1,0,0,0,1|2,0,0]=4 9763 B15R1.131 CS(=O)CCCNCc1ccccc1Cl 2230a_200000753449_100000187162 [0,1,0,0,0,1|2,0,0]=4 9764 B15R1.131 CS(=O)CCCNCc1ccccc1Cl 270004a_200000753449_100000210073 [0,1,0,0,0,1|2,0,0]=4 9765 B15R1.131 CS(=O)CCCNCc1ccccc1F 207a_200000753449_100000210811 [0,1,0,0,0,1|2,0,0]=4 9766 B15R1.131 CS(=O)CCCNCc1ccccc1F 2230a_200000753449_100000211605 [0,1,0,0,0,1|2,0,0]=4 9767 B15R1.131 CS(=O)CCCNCc1ccccc1F 270004a_200000753449_100000210811 [0,1,0,0,0,1|2,0,0]=4 9768 B15R1.131 CS(=O)CCCNCc1ccccc1I 207a_200000753449_100000010305 [0,1,0,0,0,1|2,0,0]=4 9769 B15R1.131 CS(=O)CCCNCc1ccccc1I 2230a_200000753449_100011215278 [0,1,0,0,0,1|2,0,0]=4 9770 B15R1.131 CS(=O)CCCNCc1ccccc1I 270004a_200000753449_100000010305 [0,1,0,0,0,1|2,0,0]=4 9771 B15R1.131 C[C@@H](O)CNCCCc1ccccc1F 2230a_100000724733_100009817552 [0,1,0,0,0,1|1,0,1]=4 9772 B15R1.131 C[C@@H](O)CNCCCc1ccccc1F 34a_100000724733_100009817552 [0,1,0,0,0,1|1,0,1]=4 9773 B15R1.131 C[C@@H](O)COCCCc1ccccc1Br 34a_100000699526_100009817552 [0,1,0,0,0,1|1,0,1]=4 9774 B15R1.131 C[C@@H](O)COCCCc1ccccc1Br 7a_100000699526_100009817552 [0,1,0,0,0,1|1,0,1]=4 9775 B15R1.131 C[C@@H](O)COCCCc1ccccc1Cl 34a_100011709251_100009817552 [0,1,0,0,0,1|1,0,1]=4 9776 B15R1.131 C[C@@H](O)COCCCc1ccccc1Cl 7a_100011709251_100009817552 [0,1,0,0,0,1|1,0,1]=4 9777 B15R1.131 C[C@@H](O)COCCCc1ccccc1F 34a_100011709249_100009817552 [0,1,0,0,0,1|1,0,1]=4 9778 B15R1.131 C[C@@H](O)COCCCc1ccccc1F 7a_100011709249_100009817552 [0,1,0,0,0,1|1,0,1]=4 9779 B15R1.131 C[C@@H](O)CSCCCc1ccccc1Br 62a_100009817552_200011713681 [0,1,0,0,0,1|1,0,1]=4 9780 B15R1.131 C[C@@H](O)CSCCCc1ccccc1Br 62a_200011713681_100009817552 [0,1,0,0,0,1|1,0,1]=4 9781 B15R1.131 Cc1ccccc1CCNCCC(=O)N 2230a_100000685071_100000744528 [0,1,0,0,0,1|1,0,0]=3 9782 B15R1.131 Cc1ccccc1CCNCCC(=O)N 34a_100000685071_100000731001 [0,1,0,0,0,1|1,0,0]=3 9783 B15R1.131 Cc1ccccc1CCNCCC(C)O 2230a_100000685071_100012276601 [0,1,0,0,0,1|1,0,1]=4 9784 B15R1.131 Cc1ccccc1CCNCCC(C)O 2230a_200000755665_100011713688 [0,1,0,0,0,1|1,0,1]=4 9785 B15R1.131 Cc1ccccc1CCNCCC(C)O 34a_100000685071_100012276601 [0,1,0,0,0,1|1,0,1]=4 9786 B15R1.131 Cc1ccccc1CCNOCC(=O)O 269956a_100000106656_100011713688 [0,1,0,0,0,1|1,0,0]=3 9787 B15R1.131 Cc1ccccc1CCOCCC(=O)N 34a_100000757172_100011713688 [0,1,0,0,0,1|1,0,0]=3 9788 B15R1.131 Cc1ccccc1CCOCCC(=O)N 34a_100011220023_100000731001 [0,1,0,0,0,1|1,0,0]=3 9789 B15R1.131 Cc1ccccc1CCOCCC(=O)N 7a_100000757172_100011713688 [0,1,0,0,0,1|1,0,0]=3 9790 B15R1.131 Cc1ccccc1CCOCCC(=O)N 7a_100011220023_100000744528 [0,1,0,0,0,1|1,0,0]=3 9791 B15R1.131 Cc1ccccc1CCOCCC(C)O 34a_100011220023_100012276601 [0,1,0,0,0,1|1,0,1]=4 9792 B15R1.131 Cc1ccccc1CCOCCC(C)O 7a_100011220023_100012276601 [0,1,0,0,0,1|1,0,1]=4 9793 B15R1.131 Cc1ccccc1CCSCCC(=O)N 62a_100000744528_100011713688 [0,1,0,0,0,1|1,0,0]=3 9794 B15R1.131 Cc1ccccc1CCSCCC(=O)N 62a_100011713688_100000744528 [0,1,0,0,0,1|1,0,0]=3 9795 B15R1.131 Cc1ccccc1CCSCCC(C)O 62a_100011713688_100012276601 [0,1,0,0,0,1|1,0,1]=4 9796 B15R1.131 Cc1ccccc1CCSCCC(C)O 62a_100012276601_100011713688 [0,1,0,0,0,1|1,0,1]=4 9797 B15R1.131 Cc1ccccc1CNCCCC(=O)N 34a_100000174972_100102525003 [0,1,0,0,0,1|1,0,0]=3 9798 B15R1.131 Cc1ccccc1CNCCCC(=O)N 34a_100000739312_100000211839 [0,1,0,0,0,1|1,0,0]=3 9799 B15R1.131 Cc1ccccc1CNCCCC(C)O 34a_100000174972_200000718107 [0,1,0,0,0,1|1,0,1]=4 9800 B15R1.131 Cc1ccccc1CNCCCS(=O)C 207a_200000753449_100000211143 [0,1,0,0,0,1|2,0,0]=4 9801 B15R1.131 Cc1ccccc1CNCCCS(=O)C 2230a_200000753449_100000211839 [0,1,0,0,0,1|2,0,0]=4 9802 B15R1.131 Cc1ccccc1CNCCCS(=O)C 270004a_200000753449_100000211143 [0,1,0,0,0,1|2,0,0]=4 9803 B15R1.131 Cc1ccccc1CNCCNC(=O)N 207a_100020590234_100000211143 [0,1,0,0,0,1|2,0,0]=4 9804 B15R1.131 Cc1ccccc1CNCCNC(=O)N 34a_100020590234_100000211839 [0,1,0,0,0,1|2,0,0]=4 9805 B15R1.131 Cc1ccccc1CNCCOC(=O)N 34a_100000174972_200011214921 [0,1,0,0,0,1|2,0,0]=4 9806 B15R1.131 Cc1ccccc1COCCCC(=O)N 34a_100000698903_100102525003 [0,1,0,0,0,1|1,0,0]=3 9807 B15R1.131 Cc1ccccc1COCCCC(=O)N 7a_100000698903_100102525003 [0,1,0,0,0,1|1,0,0]=3 9808 B15R1.131 Cc1ccccc1COCCCC(C)O 34a_100000698903_200000718107 [0,1,0,0,0,1|1,0,1]=4 9809 B15R1.131 Cc1ccccc1COCCCC(C)O 7a_100000698903_200000718107 [0,1,0,0,0,1|1,0,1]=4 9810 B15R1.131 Cc1ccccc1COCCC[N+](=O)[O-] 34a_200000037920_100000211839 [0,1,0,0,0,1|1,0,1]=4 9811 B15R1.131 Cc1ccccc1COCCNC(=O)N 34a_100000181757_100000211839 [0,1,0,0,0,1|2,0,0]=4 9812 B15R1.131 Cc1ccccc1COCCNC(=O)N 7a_100000698903_200000034859 [0,1,0,0,0,1|2,0,0]=4 9813 B15R1.131 Cc1ccccc1COCCOC(=O)N 34a_100000698903_200011214921 [0,1,0,0,0,1|2,0,0]=4 9814 B15R1.131 Cc1ccccc1COCCOC(=O)N 7a_100000698903_200011214921 [0,1,0,0,0,1|2,0,0]=4 9815 B15R1.131 Cc1ccccc1COCCOC(=O)N 7a_100000766696_100000211839 [0,1,0,0,0,1|2,0,0]=4 9816 B15R1.131 Cc1ccccc1CSCCCC(=O)N 62a_100000211839_100102525003 [0,1,0,0,0,1|1,0,0]=3 9817 B15R1.131 Cc1ccccc1CSCCCC(=O)N 62a_100102525003_100000211839 [0,1,0,0,0,1|1,0,0]=3 9818 B15R1.131 Cc1ccccc1CSCCCC(C)O 62a_100000211839_200000718107 [0,1,0,0,0,1|1,0,1]=4 9819 B15R1.131 Cc1ccccc1CSCCCC(C)O 62a_200000718107_100000211839 [0,1,0,0,0,1|1,0,1]=4 9820 B15R1.131 Cc1ccccc1CSCCNC(=O)N 62a_100000211839_200000034859 [0,1,0,0,0,1|2,0,0]=4 9821 B15R1.131 Cc1ccccc1CSCCNC(=O)N 62a_200000034859_100000211839 [0,1,0,0,0,1|2,0,0]=4 9822 B15R1.131 Cc1ccccc1CSCCOC(=O)N 62a_100000211839_200011214921 [0,1,0,0,0,1|2,0,0]=4 9823 B15R1.131 Cc1ccccc1CSCCOC(=O)N 62a_200011214921_100000211839 [0,1,0,0,0,1|2,0,0]=4 9824 B15R1.131 Cc1ccccc1NCCCCB(O)O 34a_100015192222_200009817182 [0,1,0,0,0,1|1,0,1]=4 9825 B15R1.131 Cc1ccccc1NCCOCC(=O)N 34a_100011233185_100000187820 [0,1,0,0,0,1|2,0,0]=4 9826 B15R1.131 Cc1ccccc1NCCOCC(=O)N 34a_100015192222_100000076697 [0,1,0,0,0,1|2,0,0]=4 9827 B15R1.131 Cc1ccccc1NCCOCC(=O)[O-] 34a_100011233185_100020667443 [0,1,0,0,0,1|1,0,1]=4 9828 B15R1.131 Cc1ccccc1OCCCCB(O)O 34a_100000210338_200009817182 [0,1,0,0,0,1|1,0,1]=4 9829 B15R1.131 Cc1ccccc1OCCCCB(O)O 7a_100000210338_200009817182 [0,1,0,0,0,1|1,0,1]=4 9830 B15R1.131 Cc1ccccc1OCCNCC(=O)N 2230a_100000711301_100000184434 [0,1,0,0,0,1|2,0,0]=4 9831 B15R1.131 Cc1ccccc1OCCNCC(=O)N 2230a_100000743344_100000747473 [0,1,0,0,0,1|2,0,0]=4 9832 B15R1.131 Cc1ccccc1OCCNCC(=O)N 34a_100000743344_100000187820 [0,1,0,0,0,1|2,0,0]=4 9833 B15R1.131 Cc1ccccc1OCCNCC(=O)O 269956a_100016091260_100000184434 [0,1,0,0,0,1|1,0,0]=3 9834 B15R1.131 Cc1ccccc1OCCNCC(=O)[O-] 34a_100000743344_100020667443 [0,1,0,0,0,1|1,0,1]=4 9835 B15R1.131 Cc1ccccc1OCCOCC(=O)N 34a_100000210338_100000076697 [0,1,0,0,0,1|2,0,0]=4 9836 B15R1.131 Cc1ccccc1OCCOCC(=O)N 7a_100000210338_100000076697 [0,1,0,0,0,1|2,0,0]=4 9837 B15R1.131 Cc1ccccc1OCCSCC(=O)N 62a_100000184434_100000747473 [0,1,0,0,0,1|2,0,0]=4 9838 B15R1.131 Cc1ccccc1OCCSCC(=O)N 62a_100000747473_100000184434 [0,1,0,0,0,1|2,0,0]=4 9839 B15R1.131 Cc1ccccc1OCCSCC(=O)[O-] 62a_100000184434_100020667443 [0,1,0,0,0,1|1,0,1]=4 9840 B15R1.131 Cc1ccccc1OCCSCC(=O)[O-] 62a_100020667443_100000184434 [0,1,0,0,0,1|1,0,1]=4 9841 B15R1.131 Cc1ccccc1SCCCCB(O)O 62a_100000210755_200009817182 [0,1,0,0,0,1|1,0,1]=4 9842 B15R1.131 Cc1ccccc1SCCCCB(O)O 62a_200009817182_100000210755 [0,1,0,0,0,1|1,0,1]=4 9843 B15R1.131 Cc1ccccc1SCCOCC(=O)N 62a_100000076697_100000210755 [0,1,0,0,0,1|2,0,0]=4 9844 B15R1.131 Cc1ccccc1SCCOCC(=O)N 62a_100000210755_100000076697 [0,1,0,0,0,1|2,0,0]=4 9845 B15R1.131 Cc1cccnc1CCOCCC(=O)N 34a_100011997706_100000731001 [0,1,0,0,0,1|2,0,0]=4 9846 B15R1.131 Cc1cccnc1CCOCCC(=O)N 7a_100011997706_100000744528 [0,1,0,0,0,1|2,0,0]=4 9847 B15R1.131 Cc1cccnc1CNCCCC(=O)N 34a_100000739312_100000696600 [0,1,0,0,0,1|2,0,0]=4 9848 B15R1.131 Cc1cccnc1CNCCCC(=O)N 34a_100011223789_100102525003 [0,1,0,0,0,1|2,0,0]=4 9849 B15R1.131 Cc1cccnc1COCCCC(=O)N 34a_100000698912_100102525003 [0,1,0,0,0,1|2,0,0]=4 9850 B15R1.131 Cc1cccnc1CSCCCC(=O)N 62a_100000696600_100102525003 [0,1,0,0,0,1|2,0,0]=4 9851 B15R1.131 Cc1cccnc1CSCCCC(=O)N 62a_100102525003_100000696600 [0,1,0,0,0,1|2,0,0]=4 9852 B15R1.131 Cc1ccncc1CNCCCC(=O)N 34a_100000739312_100000690890 [0,1,0,0,0,1|2,0,0]=4 9853 B15R1.131 Cc1ccncc1COCCCC(=O)N 34a_100011996381_100102525003 [0,1,0,0,0,1|2,0,0]=4 9854 B15R1.131 Cc1ccncc1CSCCCC(=O)N 62a_100000690890_100102525003 [0,1,0,0,0,1|2,0,0]=4 9855 B15R1.131 Cc1ccncc1CSCCCC(=O)N 62a_100102525003_100000690890 [0,1,0,0,0,1|2,0,0]=4 9856 B15R1.131 Cc1cnccc1CNCCCC(=O)N 34a_100000739312_100020672809 [0,1,0,0,0,1|2,0,0]=4 9857 B15R1.131 Cc1cnccc1COCCCC(=O)N 34a_100011997032_100102525003 [0,1,0,0,0,1|2,0,0]=4 9858 B15R1.131 Cc1cnccc1CSCCCC(=O)N 62a_100020672808_100102525003 [0,1,0,0,0,1|2,0,0]=4 9859 B15R1.131 Cc1cnccc1CSCCCC(=O)N 62a_100102525003_100020672808 [0,1,0,0,0,1|2,0,0]=4 9860 B15R1.131 Cc1ncccc1CNCCCC(=O)N 34a_100000739312_100000732876 [0,1,0,0,0,1|2,0,0]=4 9861 B15R1.131 Cc1ncccc1COCCCC(=O)N 34a_100000729262_100102525003 [0,1,0,0,0,1|2,0,0]=4 9862 B15R1.131 Cc1ncccc1COCCCC(=O)N 7a_100000729262_100102525003 [0,1,0,0,0,1|2,0,0]=4 9863 B15R1.131 Cc1ncccc1CSCCCC(=O)N 62a_100000732876_100102525003 [0,1,0,0,0,1|2,0,0]=4 9864 B15R1.131 Cc1ncccc1CSCCCC(=O)N 62a_100102525003_100000732876 [0,1,0,0,0,1|2,0,0]=4 9865 B15R1.131 NC(=O)CCCNCc1ccccc1Br 34a_100000689332_100102525003 [0,1,0,0,0,1|1,0,0]=3 9866 B15R1.131 NC(=O)CCCNCc1ccccc1Br 34a_100000739312_100000184730 [0,1,0,0,0,1|1,0,0]=3 9867 B15R1.131 NC(=O)CCCNCc1ccccc1Cl 34a_100000174879_100102525003 [0,1,0,0,0,1|1,0,0]=3 9868 B15R1.131 NC(=O)CCCNCc1ccccc1Cl 34a_100000739312_100000187162 [0,1,0,0,0,1|1,0,0]=3 9869 B15R1.131 NC(=O)CCCNCc1ccccc1F 34a_100000174869_100102525003 [0,1,0,0,0,1|1,0,0]=3 9870 B15R1.131 NC(=O)CCCNCc1ccccc1F 34a_100000739312_100000211605 [0,1,0,0,0,1|1,0,0]=3 9871 B15R1.131 NC(=O)CCCNCc1ccccc1I 34a_100000739312_100011215278 [0,1,0,0,0,1|1,0,0]=3 9872 B15R1.131 NC(=O)CCCNCc1ccccc1O 34a_100000185550_100102525003 [0,1,0,0,0,1|1,0,0]=3 9873 B15R1.131 NC(=O)CCCNCc1cccnc1Br 34a_100000739312_100010140945 [0,1,0,0,0,1|2,0,0]=4 9874 B15R1.131 NC(=O)CCCNCc1cccnc1Br 34a_100009818023_100102525003 [0,1,0,0,0,1|2,0,0]=4 9875 B15R1.131 NC(=O)CCCNCc1cccnc1Cl 34a_100000739312_100000045678 [0,1,0,0,0,1|2,0,0]=4 9876 B15R1.131 NC(=O)CCCNCc1cccnc1Cl 34a_100015189234_100102525003 [0,1,0,0,0,1|2,0,0]=4 9877 B15R1.131 NC(=O)CCCNCc1cccnc1F 34a_100000724633_100102525003 [0,1,0,0,0,1|2,0,0]=4 9878 B15R1.131 NC(=O)CCCNCc1cccnc1F 34a_100000739312_100000099810 [0,1,0,0,0,1|2,0,0]=4 9879 B15R1.131 NC(=O)CCCNCc1ccncc1F 34a_100011935246_100102525003 [0,1,0,0,0,1|2,0,0]=4 9880 B15R1.131 NC(=O)CCCNCc1ncccc1Br 34a_100000739312_100025702911 [0,1,0,0,0,1|2,0,0]=4 9881 B15R1.131 NC(=O)CCCNCc1ncccc1F 34a_100000690088_100102525003 [0,1,0,0,0,1|2,0,0]=4 9882 B15R1.131 NC(=O)CCCNCc1ncccc1F 34a_100000739312_100000104219 [0,1,0,0,0,1|2,0,0]=4 9883 B15R1.131 NC(=O)CCCNCc1ncccc1O 34a_100000739312_200020655725 [0,1,0,0,0,1|2,0,0]=4 9884 B15R1.131 NC(=O)CCCOCc1ccccc1Br 34a_100000756307_100102525003 [0,1,0,0,0,1|1,0,0]=3 9885 B15R1.131 NC(=O)CCCOCc1ccccc1Br 7a_100000756307_100102525003 [0,1,0,0,0,1|1,0,0]=3 9886 B15R1.131 NC(=O)CCCOCc1ccccc1Cl 34a_100000210847_100102525003 [0,1,0,0,0,1|1,0,0]=3 9887 B15R1.131 NC(=O)CCCOCc1ccccc1Cl 7a_100000210847_100102525003 [0,1,0,0,0,1|1,0,0]=3 9888 B15R1.131 NC(=O)CCCOCc1ccccc1F 34a_100000211962_100102525003 [0,1,0,0,0,1|1,0,0]=3 9889 B15R1.131 NC(=O)CCCOCc1ccccc1F 7a_100000211962_100102525003 [0,1,0,0,0,1|1,0,0]=3 9890 B15R1.131 NC(=O)CCCOCc1ccccc1I 34a_100000187465_100102525003 [0,1,0,0,0,1|1,0,0]=3 9891 B15R1.131 NC(=O)CCCOCc1ccccc1I 7a_100000187465_100102525003 [0,1,0,0,0,1|1,0,0]=3 9892 B15R1.131 NC(=O)CCCOCc1ccccc1N 34a_100000212039_100102525003 [0,1,0,0,0,1|1,0,0]=3 9893 B15R1.131 NC(=O)CCCOCc1cccnc1Br 34a_100000719692_100102525003 [0,1,0,0,0,1|2,0,0]=4 9894 B15R1.131 NC(=O)CCCOCc1cccnc1Br 7a_100000719692_100102525003 [0,1,0,0,0,1|2,0,0]=4 9895 B15R1.131 NC(=O)CCCOCc1cccnc1Cl 34a_100000748726_100102525003 [0,1,0,0,0,1|2,0,0]=4 9896 B15R1.131 NC(=O)CCCOCc1cccnc1Cl 7a_100000748726_100102525003 [0,1,0,0,0,1|2,0,0]=4 9897 B15R1.131 NC(=O)CCCOCc1cccnc1F 34a_100000079888_100102525003 [0,1,0,0,0,1|2,0,0]=4 9898 B15R1.131 NC(=O)CCCOCc1cccnc1F 7a_100000079888_100102525003 [0,1,0,0,0,1|2,0,0]=4 9899 B15R1.131 NC(=O)CCCOCc1ccncc1F 34a_100012172863_100102525003 [0,1,0,0,0,1|2,0,0]=4 9900 B15R1.131 NC(=O)CCCOCc1cnccc1Cl 34a_100000117392_100102525003 [0,1,0,0,0,1|2,0,0]=4 9901 B15R1.131 NC(=O)CCCOCc1ncccc1Br 34a_100011996772_100102525003 [0,1,0,0,0,1|2,0,0]=4 9902 B15R1.131 NC(=O)CCCOCc1ncccc1Cl 34a_100012002383_100102525003 [0,1,0,0,0,1|2,0,0]=4 9903 B15R1.131 NC(=O)CCCOCc1ncccc1F 34a_100011934865_100102525003 [0,1,0,0,0,1|2,0,0]=4 9904 B15R1.131 NC(=O)CCCOCc1ncccc1N 34a_114873767017_100102525003 [0,1,0,0,0,1|2,0,0]=4 9905 B15R1.131 NC(=O)CCCSCc1ccccc1Br 62a_100000184730_100102525003 [0,1,0,0,0,1|1,0,0]=3 9906 B15R1.131 NC(=O)CCCSCc1ccccc1Br 62a_100102525003_100000184730 [0,1,0,0,0,1|1,0,0]=3 9907 B15R1.131 NC(=O)CCCSCc1ccccc1Cl 62a_100000187162_100102525003 [0,1,0,0,0,1|1,0,0]=3 9908 B15R1.131 NC(=O)CCCSCc1ccccc1Cl 62a_100102525003_100000187162 [0,1,0,0,0,1|1,0,0]=3 9909 B15R1.131 NC(=O)CCCSCc1ccccc1F 62a_100000211605_100102525003 [0,1,0,0,0,1|1,0,0]=3 9910 B15R1.131 NC(=O)CCCSCc1ccccc1F 62a_100102525003_100000211605 [0,1,0,0,0,1|1,0,0]=3 9911 B15R1.131 NC(=O)CCCSCc1ccccc1I 62a_100011216222_100102525003 [0,1,0,0,0,1|1,0,0]=3 9912 B15R1.131 NC(=O)CCCSCc1ccccc1I 62a_100102525003_100011216222 [0,1,0,0,0,1|1,0,0]=3 9913 B15R1.131 NC(=O)CCCSCc1cccnc1Br 62a_100010140945_100102525003 [0,1,0,0,0,1|2,0,0]=4 9914 B15R1.131 NC(=O)CCCSCc1cccnc1Br 62a_100102525003_100010140945 [0,1,0,0,0,1|2,0,0]=4 9915 B15R1.131 NC(=O)CCCSCc1cccnc1Cl 62a_100000045678_100102525003 [0,1,0,0,0,1|2,0,0]=4 9916 B15R1.131 NC(=O)CCCSCc1cccnc1Cl 62a_100102525003_100000045678 [0,1,0,0,0,1|2,0,0]=4 9917 B15R1.131 NC(=O)CCCSCc1cccnc1F 62a_100000099810_100102525003 [0,1,0,0,0,1|2,0,0]=4 9918 B15R1.131 NC(=O)CCCSCc1cccnc1F 62a_100102525003_100000099810 [0,1,0,0,0,1|2,0,0]=4 9919 B15R1.131 NC(=O)CCCSCc1ccncc1Cl 62a_100000763264_100102525003 [0,1,0,0,0,1|2,0,0]=4 9920 B15R1.131 NC(=O)CCCSCc1ccncc1Cl 62a_100102525003_100000763264 [0,1,0,0,0,1|2,0,0]=4 9921 B15R1.131 NC(=O)CCCSCc1ncccc1Br 62a_100025702911_100102525003 [0,1,0,0,0,1|2,0,0]=4 9922 B15R1.131 NC(=O)CCCSCc1ncccc1Br 62a_100102525003_100025702911 [0,1,0,0,0,1|2,0,0]=4 9923 B15R1.131 NC(=O)CCCSCc1ncccc1Cl 62a_100000099807_100102525003 [0,1,0,0,0,1|2,0,0]=4 9924 B15R1.131 NC(=O)CCCSCc1ncccc1Cl 62a_100102525003_100000099807 [0,1,0,0,0,1|2,0,0]=4 9925 B15R1.131 NC(=O)CCCSCc1ncccc1F 62a_100000104219_100102525003 [0,1,0,0,0,1|2,0,0]=4 9926 B15R1.131 NC(=O)CCCSCc1ncccc1F 62a_100102525003_100000104219 [0,1,0,0,0,1|2,0,0]=4 9927 B15R1.131 NC(=O)CCCSCc1ncccc1O 62a_100102525003_200020655725 [0,1,0,0,0,1|2,0,0]=4 9928 B15R1.131 NC(=O)CCCSCc1ncccc1O 62a_200020655725_100102525003 [0,1,0,0,0,1|2,0,0]=4 9929 B15R1.131 NC(=O)CCNCCc1ccccc1Br 2230a_100000747383_100000744528 [0,1,0,0,0,1|1,0,0]=3 9930 B15R1.131 NC(=O)CCNCCc1ccccc1Br 34a_100000747383_100000731001 [0,1,0,0,0,1|1,0,0]=3 9931 B15R1.131 NC(=O)CCNCCc1ccccc1Cl 2230a_100011207228_100000744528 [0,1,0,0,0,1|1,0,0]=3 9932 B15R1.131 NC(=O)CCNCCc1ccccc1Cl 34a_100011207228_100000731001 [0,1,0,0,0,1|1,0,0]=3 9933 B15R1.131 NC(=O)CCNCCc1ccccc1F 2230a_100000185272_100000744528 [0,1,0,0,0,1|1,0,0]=3 9934 B15R1.131 NC(=O)CCNCCc1ccccc1F 34a_100000185272_100000731001 [0,1,0,0,0,1|1,0,0]=3 9935 B15R1.131 NC(=O)CCNCCc1ccccc1O 34a_100011207237_100000731001 [0,1,0,0,0,1|1,0,0]=3 9936 B15R1.131 NC(=O)CCNCCn1ccccc1=O 2230a_100000687133_100000744528 [0,1,0,0,0,1|2,0,0]=4 9937 B15R1.131 NC(=O)CCOCCc1ccccc1Br 34a_100000731337_100000731001 [0,1,0,0,0,1|1,0,0]=3 9938 B15R1.131 NC(=O)CCOCCc1ccccc1Br 34a_100000757172_100012161201 [0,1,0,0,0,1|1,0,0]=3 9939 B15R1.131 NC(=O)CCOCCc1ccccc1Br 7a_100000731337_100000744528 [0,1,0,0,0,1|1,0,0]=3 9940 B15R1.131 NC(=O)CCOCCc1ccccc1Br 7a_100000757172_100012161201 [0,1,0,0,0,1|1,0,0]=3 9941 B15R1.131 NC(=O)CCOCCc1ccccc1Cl 34a_100000757172_100011713703 [0,1,0,0,0,1|1,0,0]=3 9942 B15R1.131 NC(=O)CCOCCc1ccccc1Cl 34a_100011215284_100000731001 [0,1,0,0,0,1|1,0,0]=3 9943 B15R1.131 NC(=O)CCOCCc1ccccc1Cl 7a_100000757172_100011713703 [0,1,0,0,0,1|1,0,0]=3 9944 B15R1.131 NC(=O)CCOCCc1ccccc1Cl 7a_100011215284_100000744528 [0,1,0,0,0,1|1,0,0]=3 9945 B15R1.131 NC(=O)CCOCCc1ccccc1F 34a_100000753711_100000731001 [0,1,0,0,0,1|1,0,0]=3 9946 B15R1.131 NC(=O)CCOCCc1ccccc1F 34a_100000757172_100000720011 [0,1,0,0,0,1|1,0,0]=3 9947 B15R1.131 NC(=O)CCOCCc1ccccc1F 7a_100000753711_100000744528 [0,1,0,0,0,1|1,0,0]=3 9948 B15R1.131 NC(=O)CCOCCc1ccccc1F 7a_100000757172_100000720011 [0,1,0,0,0,1|1,0,0]=3 9949 B15R1.131 NC(=O)CCOCCc1ccccc1I 34a_100010255290_100000731001 [0,1,0,0,0,1|1,0,0]=3 9950 B15R1.131 NC(=O)CCOCCc1ccccc1I 7a_100010255290_100000744528 [0,1,0,0,0,1|1,0,0]=3 9951 B15R1.131 NC(=O)CCOCCc1ccccc1N 34a_100011215289_100000731001 [0,1,0,0,0,1|1,0,0]=3 9952 B15R1.131 NC(=O)CCOCCc1ccccc1O 34a_100000757172_100000722297 [0,1,0,0,0,1|1,0,0]=3 9953 B15R1.131 NC(=O)CCOCCc1ccccc1O 7a_100000757172_100000722297 [0,1,0,0,0,1|1,0,0]=3 9954 B15R1.131 NC(=O)CCSCCc1ccccc1Br 62a_100000744528_100012161201 [0,1,0,0,0,1|1,0,0]=3 9955 B15R1.131 NC(=O)CCSCCc1ccccc1Br 62a_100012161201_100000744528 [0,1,0,0,0,1|1,0,0]=3 9956 B15R1.131 NC(=O)CCSCCc1ccccc1Cl 62a_100000744528_100011713703 [0,1,0,0,0,1|1,0,0]=3 9957 B15R1.131 NC(=O)CCSCCc1ccccc1Cl 62a_100011713703_100000744528 [0,1,0,0,0,1|1,0,0]=3 9958 B15R1.131 NC(=O)CCSCCc1ccccc1F 62a_100000744528_100011713696 [0,1,0,0,0,1|1,0,0]=3 9959 B15R1.131 NC(=O)CCSCCc1ccccc1F 62a_100011713696_100000744528 [0,1,0,0,0,1|1,0,0]=3 9960 B15R1.131 NC(=O)CCSCCc1ccccc1O 62a_100000722297_100000744528 [0,1,0,0,0,1|1,0,0]=3 9961 B15R1.131 NC(=O)CCSCCc1ccccc1O 62a_100000744528_100000722297 [0,1,0,0,0,1|1,0,0]=3 9962 B15R1.131 NC(=O)CNCCCc1ccccc1Br 2230a_100000711301_200011713681 [0,1,0,0,0,1|1,0,0]=3 9963 B15R1.131 NC(=O)CNCCCc1ccccc1F 2230a_100000724733_100000747473 [0,1,0,0,0,1|1,0,0]=3 9964 B15R1.131 NC(=O)CNCCCc1ccccc1F 34a_100000724733_100000187820 [0,1,0,0,0,1|1,0,0]=3 9965 B15R1.131 NC(=O)CNCCOc1ccccc1Br 2230a_100000711301_100000695877 [0,1,0,0,0,1|2,0,0]=4 9966 B15R1.131 NC(=O)CNCCOc1ccccc1Br 2230a_100000744007_100000747473 [0,1,0,0,0,1|2,0,0]=4 9967 B15R1.131 NC(=O)CNCCOc1ccccc1Br 34a_100000744007_100000187820 [0,1,0,0,0,1|2,0,0]=4 9968 B15R1.131 NC(=O)CNCCOc1ccccc1Cl 2230a_100000174932_100000747473 [0,1,0,0,0,1|2,0,0]=4 9969 B15R1.131 NC(=O)CNCCOc1ccccc1Cl 34a_100000174932_100000187820 [0,1,0,0,0,1|2,0,0]=4 9970 B15R1.131 NC(=O)CNCCOc1ccccc1F 2230a_100000683764_100000747473 [0,1,0,0,0,1|2,0,0]=4 9971 B15R1.131 NC(=O)CNCCOc1ccccc1F 2230a_100000711301_100000183290 [0,1,0,0,0,1|2,0,0]=4 9972 B15R1.131 NC(=O)CNCCOc1ccccc1F 34a_100000683764_100000187820 [0,1,0,0,0,1|2,0,0]=4 9973 B15R1.131 NC(=O)COCCCc1ccccc1Br 34a_100000699526_100000187820 [0,1,0,0,0,1|1,0,0]=3 9974 B15R1.131 NC(=O)COCCCc1ccccc1Br 7a_100000699526_100000187820 [0,1,0,0,0,1|1,0,0]=3 9975 B15R1.131 NC(=O)COCCCc1ccccc1Cl 34a_100011709251_100000187820 [0,1,0,0,0,1|1,0,0]=3 9976 B15R1.131 NC(=O)COCCCc1ccccc1Cl 7a_100011709251_100000187820 [0,1,0,0,0,1|1,0,0]=3 9977 B15R1.131 NC(=O)COCCCc1ccccc1F 34a_100011709249_100000187820 [0,1,0,0,0,1|1,0,0]=3 9978 B15R1.131 NC(=O)COCCCc1ccccc1F 7a_100011709249_100000187820 [0,1,0,0,0,1|1,0,0]=3 9979 B15R1.131 NC(=O)COCCNc1ccccc1Br 34a_100000210017_100000076697 [0,1,0,0,0,1|2,0,0]=4 9980 B15R1.131 NC(=O)COCCNc1ccccc1Cl 34a_100000185783_100000076697 [0,1,0,0,0,1|2,0,0]=4 9981 B15R1.131 NC(=O)COCCNc1ccccc1F 34a_100000210422_100000076697 [0,1,0,0,0,1|2,0,0]=4 9982 B15R1.131 NC(=O)COCCNc1ccccc1I 34a_100000210053_100000076697 [0,1,0,0,0,1|2,0,0]=4 9983 B15R1.131 NC(=O)COCCNc1ccccc1N 34a_100000683943_100000187820 [0,1,0,0,0,1|2,0,0]=4 9984 B15R1.131 NC(=O)COCCNc1ccccc1O 34a_100000185747_100000076697 [0,1,0,0,0,1|2,0,0]=4 9985 B15R1.131 NC(=O)COCCOc1ccccc1Br 34a_100000181306_100000076697 [0,1,0,0,0,1|2,0,0]=4 9986 B15R1.131 NC(=O)COCCOc1ccccc1Br 34a_100000230753_100000187820 [0,1,0,0,0,1|2,0,0]=4 9987 B15R1.131 NC(=O)COCCOc1ccccc1Br 7a_100000181306_100000076697 [0,1,0,0,0,1|2,0,0]=4 9988 B15R1.131 NC(=O)COCCOc1ccccc1Br 7a_100000230753_100000187820 [0,1,0,0,0,1|2,0,0]=4 9989 B15R1.131 NC(=O)COCCOc1ccccc1Cl 34a_100000210172_100000076697 [0,1,0,0,0,1|2,0,0]=4 9990 B15R1.131 NC(=O)COCCOc1ccccc1Cl 34a_200000230518_100000187820 [0,1,0,0,0,1|2,0,0]=4 9991 B15R1.131 NC(=O)COCCOc1ccccc1Cl 7a_100000210172_100000076697 [0,1,0,0,0,1|2,0,0]=4 9992 B15R1.131 NC(=O)COCCOc1ccccc1Cl 7a_200000230518_100000187820 [0,1,0,0,0,1|2,0,0]=4 9993 B15R1.131 NC(=O)COCCOc1ccccc1F 34a_100000210171_100000076697 [0,1,0,0,0,1|2,0,0]=4 9994 B15R1.131 NC(=O)COCCOc1ccccc1F 34a_100000756447_100000187820 [0,1,0,0,0,1|2,0,0]=4 9995 B15R1.131 NC(=O)COCCOc1ccccc1F 7a_100000210171_100000076697 [0,1,0,0,0,1|2,0,0]=4 9996 B15R1.131 NC(=O)COCCOc1ccccc1F 7a_100000756447_100000187820 [0,1,0,0,0,1|2,0,0]=4 9997 B15R1.131 NC(=O)COCCOc1ccccc1I 34a_100000739446_100000076697 [0,1,0,0,0,1|2,0,0]=4 9998 B15R1.131 NC(=O)COCCOc1ccccc1I 7a_100000739446_100000076697 [0,1,0,0,0,1|2,0,0]=4 9999 B15R1.131 NC(=O)COCCOc1ccccc1N 34a_100000185747_100000076697 [0,1,0,0,0,1|2,0,0]=4 10000 B15R1.131 NC(=O)COCCOc1ccccc1N 34a_100132302172_100000187820 [0,1,0,0,0,1|2,0,0]=4 10001 B15R1.131 NC(=O)COCCOc1ccccc1N 7a_100000185747_100000076697 [0,1,0,0,0,1|2,0,0]=4 10002 B15R1.131 NC(=O)COCCSc1ccccc1Br 34a_200000230852_100000187820 [0,1,0,0,0,1|2,0,0]=4 10003 B15R1.131 NC(=O)COCCSc1ccccc1Br 62a_100000076697_100000695589 [0,1,0,0,0,1|2,0,0]=4 10004 B15R1.131 NC(=O)COCCSc1ccccc1Br 62a_100000695589_100000076697 [0,1,0,0,0,1|2,0,0]=4 10005 B15R1.131 NC(=O)COCCSc1ccccc1Br 7a_200000230852_100000187820 [0,1,0,0,0,1|2,0,0]=4 10006 B15R1.131 NC(=O)COCCSc1ccccc1Cl 34a_200000230572_100000187820 [0,1,0,0,0,1|2,0,0]=4 10007 B15R1.131 NC(=O)COCCSc1ccccc1Cl 62a_100000076697_100000764095 [0,1,0,0,0,1|2,0,0]=4 10008 B15R1.131 NC(=O)COCCSc1ccccc1Cl 62a_100000764095_100000076697 [0,1,0,0,0,1|2,0,0]=4 10009 B15R1.131 NC(=O)COCCSc1ccccc1Cl 7a_200000230572_100000187820 [0,1,0,0,0,1|2,0,0]=4 10010 B15R1.131 NC(=O)COCCSc1ccccc1F 34a_200000230732_100000187820 [0,1,0,0,0,1|2,0,0]=4 10011 B15R1.131 NC(=O)COCCSc1ccccc1F 62a_100000076697_100011215700 [0,1,0,0,0,1|2,0,0]=4 10012 B15R1.131 NC(=O)COCCSc1ccccc1F 62a_100011215700_100000076697 [0,1,0,0,0,1|2,0,0]=4 10013 B15R1.131 NC(=O)COCCSc1ccccc1F 7a_200000230732_100000187820 [0,1,0,0,0,1|2,0,0]=4 10014 B15R1.131 NC(=O)COCCSc1ccccc1N 62a_100000076697_100000210017 [0,1,0,0,0,1|2,0,0]=4 10015 B15R1.131 NC(=O)COCCSc1ccccc1N 62a_100000210017_100000076697 [0,1,0,0,0,1|2,0,0]=4 10016 B15R1.131 NC(=O)COCCSc1ccccc1O 62a_100000076697_100000739446 [0,1,0,0,0,1|2,0,0]=4 10017 B15R1.131 NC(=O)COCCSc1ccccc1O 62a_100000739446_100000076697 [0,1,0,0,0,1|2,0,0]=4 10018 B15R1.131 NC(=O)CSCCCc1ccccc1Br 62a_100000747473_200011713681 [0,1,0,0,0,1|1,0,0]=3 10019 B15R1.131 NC(=O)CSCCCc1ccccc1Br 62a_200011713681_100000747473 [0,1,0,0,0,1|1,0,0]=3 10020 B15R1.131 NC(=O)CSCCOc1ccccc1Br 62a_100000695877_100000747473 [0,1,0,0,0,1|2,0,0]=4 10021 B15R1.131 NC(=O)CSCCOc1ccccc1Br 62a_100000747473_100000695877 [0,1,0,0,0,1|2,0,0]=4 10022 B15R1.131 NC(=O)CSCCOc1ccccc1F 62a_100000183290_100000747473 [0,1,0,0,0,1|2,0,0]=4 10023 B15R1.131 NC(=O)CSCCOc1ccccc1F 62a_100000747473_100000183290 [0,1,0,0,0,1|2,0,0]=4 10024 B15R1.131 NC(=O)NCCNCc1ccccc1Br 207a_100020590234_100000211189 [0,1,0,0,0,1|2,0,0]=4 10025 B15R1.131 NC(=O)NCCNCc1ccccc1Br 2230a_100000689332_200000034859 [0,1,0,0,0,1|2,0,0]=4 10026 B15R1.131 NC(=O)NCCNCc1ccccc1Br 34a_100020590234_100000184730 [0,1,0,0,0,1|2,0,0]=4 10027 B15R1.131 NC(=O)NCCNCc1ccccc1Cl 207a_100020590234_100000210073 [0,1,0,0,0,1|2,0,0]=4 10028 B15R1.131 NC(=O)NCCNCc1ccccc1Cl 2230a_100000174879_200000034859 [0,1,0,0,0,1|2,0,0]=4 10029 B15R1.131 NC(=O)NCCNCc1ccccc1Cl 34a_100020590234_100000187162 [0,1,0,0,0,1|2,0,0]=4 10030 B15R1.131 NC(=O)NCCNCc1ccccc1F 207a_100020590234_100000210811 [0,1,0,0,0,1|2,0,0]=4 10031 B15R1.131 NC(=O)NCCNCc1ccccc1F 34a_100020590234_100000211605 [0,1,0,0,0,1|2,0,0]=4 10032 B15R1.131 NC(=O)NCCNCc1ccccc1I 207a_100020590234_100000010305 [0,1,0,0,0,1|2,0,0]=4 10033 B15R1.131 NC(=O)NCCNCc1ccccc1I 34a_100020590234_100011215278 [0,1,0,0,0,1|2,0,0]=4 10034 B15R1.131 NC(=O)NCCOCc1ccccc1Br 34a_100000181757_100000184730 [0,1,0,0,0,1|2,0,0]=4 10035 B15R1.131 NC(=O)NCCOCc1ccccc1Br 7a_100000756307_200000034859 [0,1,0,0,0,1|2,0,0]=4 10036 B15R1.131 NC(=O)NCCOCc1ccccc1Cl 34a_100000181757_100000187162 [0,1,0,0,0,1|2,0,0]=4 10037 B15R1.131 NC(=O)NCCOCc1ccccc1Cl 7a_100000210847_200000034859 [0,1,0,0,0,1|2,0,0]=4 10038 B15R1.131 NC(=O)NCCOCc1ccccc1F 34a_100000181757_100000211605 [0,1,0,0,0,1|2,0,0]=4 10039 B15R1.131 NC(=O)NCCOCc1ccccc1F 7a_100000211962_200000034859 [0,1,0,0,0,1|2,0,0]=4 10040 B15R1.131 NC(=O)NCCOCc1ccccc1I 34a_100000181757_100011215278 [0,1,0,0,0,1|2,0,0]=4 10041 B15R1.131 NC(=O)NCCOCc1ccccc1I 7a_100000187465_200000034859 [0,1,0,0,0,1|2,0,0]=4 10042 B15R1.131 NC(=O)NCCSCc1ccccc1Br 62a_100000184730_200000034859 [0,1,0,0,0,1|2,0,0]=4 10043 B15R1.131 NC(=O)NCCSCc1ccccc1Br 62a_200000034859_100000184730 [0,1,0,0,0,1|2,0,0]=4 10044 B15R1.131 NC(=O)NCCSCc1ccccc1Cl 62a_100000187162_200000034859 [0,1,0,0,0,1|2,0,0]=4 10045 B15R1.131 NC(=O)NCCSCc1ccccc1Cl 62a_200000034859_100000187162 [0,1,0,0,0,1|2,0,0]=4 10046 B15R1.131 NC(=O)NCCSCc1ccccc1F 62a_100000211605_200000034859 [0,1,0,0,0,1|2,0,0]=4 10047 B15R1.131 NC(=O)NCCSCc1ccccc1F 62a_200000034859_100000211605 [0,1,0,0,0,1|2,0,0]=4 10048 B15R1.131 NC(=O)NCCSCc1ccccc1I 62a_100011216222_200000034859 [0,1,0,0,0,1|2,0,0]=4 10049 B15R1.131 NC(=O)NCCSCc1ccccc1I 62a_200000034859_100011216222 [0,1,0,0,0,1|2,0,0]=4 10050 B15R1.131 NC(=O)OCCNCc1ccccc1Br 34a_100000689332_200011214921 [0,1,0,0,0,1|2,0,0]=4 10051 B15R1.131 NC(=O)OCCNCc1ccccc1Cl 34a_100000174879_200011214921 [0,1,0,0,0,1|2,0,0]=4 10052 B15R1.131 NC(=O)OCCNCc1ccccc1F 34a_100000174869_200011214921 [0,1,0,0,0,1|2,0,0]=4 10053 B15R1.131 NC(=O)OCCNCc1ccccc1O 34a_100000185550_200011214921 [0,1,0,0,0,1|2,0,0]=4 10054 B15R1.131 NC(=O)OCCOCc1ccccc1Br 34a_100000756307_200011214921 [0,1,0,0,0,1|2,0,0]=4 10055 B15R1.131 NC(=O)OCCOCc1ccccc1Br 7a_100000756307_200011214921 [0,1,0,0,0,1|2,0,0]=4 10056 B15R1.131 NC(=O)OCCOCc1ccccc1Br 7a_100000766696_100000184730 [0,1,0,0,0,1|2,0,0]=4 10057 B15R1.131 NC(=O)OCCOCc1ccccc1Cl 34a_100000210847_200011214921 [0,1,0,0,0,1|2,0,0]=4 10058 B15R1.131 NC(=O)OCCOCc1ccccc1Cl 7a_100000210847_200011214921 [0,1,0,0,0,1|2,0,0]=4 10059 B15R1.131 NC(=O)OCCOCc1ccccc1Cl 7a_100000766696_100000187162 [0,1,0,0,0,1|2,0,0]=4 10060 B15R1.131 NC(=O)OCCOCc1ccccc1F 34a_100000211962_200011214921 [0,1,0,0,0,1|2,0,0]=4 10061 B15R1.131 NC(=O)OCCOCc1ccccc1F 7a_100000211962_200011214921 [0,1,0,0,0,1|2,0,0]=4 10062 B15R1.131 NC(=O)OCCOCc1ccccc1F 7a_100000766696_100000211605 [0,1,0,0,0,1|2,0,0]=4 10063 B15R1.131 NC(=O)OCCOCc1ccccc1I 34a_100000187465_200011214921 [0,1,0,0,0,1|2,0,0]=4 10064 B15R1.131 NC(=O)OCCOCc1ccccc1I 7a_100000187465_200011214921 [0,1,0,0,0,1|2,0,0]=4 10065 B15R1.131 NC(=O)OCCOCc1ccccc1I 7a_100000766696_100011215278 [0,1,0,0,0,1|2,0,0]=4 10066 B15R1.131 NC(=O)OCCOCc1ccccc1N 34a_100000212039_200011214921 [0,1,0,0,0,1|2,0,0]=4 10067 B15R1.131 NC(=O)OCCSCc1ccccc1Br 62a_100000184730_200011214921 [0,1,0,0,0,1|2,0,0]=4 10068 B15R1.131 NC(=O)OCCSCc1ccccc1Br 62a_200011214921_100000184730 [0,1,0,0,0,1|2,0,0]=4 10069 B15R1.131 NC(=O)OCCSCc1ccccc1Cl 62a_100000187162_200011214921 [0,1,0,0,0,1|2,0,0]=4 10070 B15R1.131 NC(=O)OCCSCc1ccccc1Cl 62a_200011214921_100000187162 [0,1,0,0,0,1|2,0,0]=4 10071 B15R1.131 NC(=O)OCCSCc1ccccc1F 62a_100000211605_200011214921 [0,1,0,0,0,1|2,0,0]=4 10072 B15R1.131 NC(=O)OCCSCc1ccccc1F 62a_200011214921_100000211605 [0,1,0,0,0,1|2,0,0]=4 10073 B15R1.131 NC(=O)OCCSCc1ccccc1I 62a_100011216222_200011214921 [0,1,0,0,0,1|2,0,0]=4 10074 B15R1.131 NC(=O)OCCSCc1ccccc1I 62a_200011214921_100011216222 [0,1,0,0,0,1|2,0,0]=4 10075 B15R1.131 Nc1ccccc1NCCOCC(=O)[O-] 34a_100000683943_100020667443 [0,1,0,0,0,1|1,0,1]=4 10076 B15R1.131 Nc1ccccc1OCCCCB(O)O 34a_100000185747_200009817182 [0,1,0,0,0,1|1,0,1]=4 10077 B15R1.131 Nc1ccccc1OCCCCB(O)O 7a_100000185747_200009817182 [0,1,0,0,0,1|1,0,1]=4 10078 B15R1.131 Nc1ccccc1OCCOCC(=O)[O-] 34a_100132302172_100020667443 [0,1,0,0,0,1|1,0,1]=4 10079 B15R1.131 Nc1ccccc1SCCCCB(O)O 62a_100000210017_200009817182 [0,1,0,0,0,1|1,0,1]=4 10080 B15R1.131 Nc1ccccc1SCCCCB(O)O 62a_200009817182_100000210017 [0,1,0,0,0,1|1,0,1]=4 10081 B15R1.131 O=C(O)CNCC#Cc1ccccc1Br 269956a_100016091260_100010706765 [0,1,0,0,0,1|0,0,2]=4 10082 B15R1.131 O=C(O)CNCC#Cc1ccccc1F 269956a_100016091260_100010404167 [0,1,0,0,0,1|0,0,2]=4 10083 B15R1.131 O=C(O)CNCCCc1ccccc1Br 269956a_100016091260_200011713681 [0,1,0,0,0,1|0,0,0]=2 10084 B15R1.131 O=C(O)CNCCOc1ccccc1Br 269956a_100016091260_100000695877 [0,1,0,0,0,1|1,0,0]=3 10085 B15R1.131 O=C(O)CNCCOc1ccccc1F 269956a_100016091260_100000183290 [0,1,0,0,0,1|1,0,0]=3 10086 B15R1.131 O=C(O)CONCCc1ccccc1Br 269956a_100000106656_100012161201 [0,1,0,0,0,1|1,0,0]=3 10087 B15R1.131 O=C(O)CONCCc1ccccc1Cl 269956a_100000106656_100011713703 [0,1,0,0,0,1|1,0,0]=3 10088 B15R1.131 O=C(O)CONCCc1ccccc1F 269956a_100000106656_100011713696 [0,1,0,0,0,1|1,0,0]=3 10089 B15R1.131 O=C(O)CONCCc1ccccc1O 269956a_100000106656_100000722297 [0,1,0,0,0,1|1,0,0]=3 10090 B15R1.131 O=C([O-])CNCCCc1ccccc1F 34a_100000724733_100020667443 [0,1,0,0,0,1|0,0,1]=3 10091 B15R1.131 O=C([O-])CNCCOc1ccccc1Br 34a_100000744007_100020667443 [0,1,0,0,0,1|1,0,1]=4 10092 B15R1.131 O=C([O-])CNCCOc1ccccc1Cl 34a_100000174932_100020667443 [0,1,0,0,0,1|1,0,1]=4 10093 B15R1.131 O=C([O-])CNCCOc1ccccc1F 34a_100000683764_100020667443 [0,1,0,0,0,1|1,0,1]=4 10094 B15R1.131 O=C([O-])COCCCc1ccccc1Br 34a_100000699526_100020667443 [0,1,0,0,0,1|0,0,1]=3 10095 B15R1.131 O=C([O-])COCCCc1ccccc1Cl 34a_100011709251_100020667443 [0,1,0,0,0,1|0,0,1]=3 10096 B15R1.131 O=C([O-])COCCCc1ccccc1F 34a_100011709249_100020667443 [0,1,0,0,0,1|0,0,1]=3 10097 B15R1.131 O=C([O-])COCCOc1ccccc1Br 34a_100000230753_100020667443 [0,1,0,0,0,1|1,0,1]=4 10098 B15R1.131 O=C([O-])COCCOc1ccccc1Cl 34a_200000230518_100020667443 [0,1,0,0,0,1|1,0,1]=4 10099 B15R1.131 O=C([O-])COCCOc1ccccc1F 34a_100000756447_100020667443 [0,1,0,0,0,1|1,0,1]=4 10100 B15R1.131 O=C([O-])COCCSc1ccccc1Br 34a_200000230852_100020667443 [0,1,0,0,0,1|1,0,1]=4 10101 B15R1.131 O=C([O-])COCCSc1ccccc1Cl 34a_200000230572_100020667443 [0,1,0,0,0,1|1,0,1]=4 10102 B15R1.131 O=C([O-])COCCSc1ccccc1F 34a_200000230732_100020667443 [0,1,0,0,0,1|1,0,1]=4 10103 B15R1.131 O=C([O-])CSCCCc1ccccc1Br 62a_100020667443_200011713681 [0,1,0,0,0,1|0,0,1]=3 10104 B15R1.131 O=C([O-])CSCCCc1ccccc1Br 62a_200011713681_100020667443 [0,1,0,0,0,1|0,0,1]=3 10105 B15R1.131 O=C([O-])CSCCOc1ccccc1Br 62a_100000695877_100020667443 [0,1,0,0,0,1|1,0,1]=4 10106 B15R1.131 O=C([O-])CSCCOc1ccccc1Br 62a_100020667443_100000695877 [0,1,0,0,0,1|1,0,1]=4 10107 B15R1.131 O=C([O-])CSCCOc1ccccc1F 62a_100000183290_100020667443 [0,1,0,0,0,1|1,0,1]=4 10108 B15R1.131 O=C([O-])CSCCOc1ccccc1F 62a_100020667443_100000183290 [0,1,0,0,0,1|1,0,1]=4 10109 B15R1.131 O=[N+]([O-])CCCOCc1ccccc1Br 34a_200000037920_100000184730 [0,1,0,0,0,1|1,0,1]=4 10110 B15R1.131 O=[N+]([O-])CCCOCc1ccccc1Cl 34a_200000037920_100000187162 [0,1,0,0,0,1|1,0,1]=4 10111 B15R1.131 O=[N+]([O-])CCCOCc1ccccc1F 34a_200000037920_100000211605 [0,1,0,0,0,1|1,0,1]=4 10112 B15R1.131 O=[N+]([O-])CCCOCc1ccccc1I 34a_200000037920_100011215278 [0,1,0,0,0,1|1,0,1]=4 10113 B15R1.131 O=[N+]([O-])CNCCCc1ccccc1F 34a_100000724733_100000761209 [0,1,0,0,0,1|1,0,1]=4 10114 B15R1.131 O=[N+]([O-])COCCCc1ccccc1Br 34a_100000699526_100000761209 [0,1,0,0,0,1|1,0,1]=4 10115 B15R1.131 O=[N+]([O-])COCCCc1ccccc1Cl 34a_100011709251_100000761209 [0,1,0,0,0,1|1,0,1]=4 10116 B15R1.131 O=[N+]([O-])COCCCc1ccccc1F 34a_100011709249_100000761209 [0,1,0,0,0,1|1,0,1]=4 10117 B15R1.131 O=[N+]([O-])CSCCCc1ccccc1Br 62a_200011713681_100000761209 [0,1,0,0,0,1|1,0,1]=4 10118 B15R1.131 OB(O)CCCCNc1ccccc1Br 34a_100000210017_200009817182 [0,1,0,0,0,1|1,0,1]=4 10119 B15R1.131 OB(O)CCCCNc1ccccc1Cl 34a_100000185783_200009817182 [0,1,0,0,0,1|1,0,1]=4 10120 B15R1.131 OB(O)CCCCNc1ccccc1F 34a_100000210422_200009817182 [0,1,0,0,0,1|1,0,1]=4 10121 B15R1.131 OB(O)CCCCNc1ccccc1I 34a_100000210053_200009817182 [0,1,0,0,0,1|1,0,1]=4 10122 B15R1.131 OB(O)CCCCNc1ccccc1O 34a_100000185747_200009817182 [0,1,0,0,0,1|1,0,1]=4 10123 B15R1.131 OB(O)CCCCOc1ccccc1Br 34a_100000181306_200009817182 [0,1,0,0,0,1|1,0,1]=4 10124 B15R1.131 OB(O)CCCCOc1ccccc1Br 7a_100000181306_200009817182 [0,1,0,0,0,1|1,0,1]=4 10125 B15R1.131 OB(O)CCCCOc1ccccc1Cl 34a_100000210172_200009817182 [0,1,0,0,0,1|1,0,1]=4 10126 B15R1.131 OB(O)CCCCOc1ccccc1Cl 7a_100000210172_200009817182 [0,1,0,0,0,1|1,0,1]=4 10127 B15R1.131 OB(O)CCCCOc1ccccc1F 34a_100000210171_200009817182 [0,1,0,0,0,1|1,0,1]=4 10128 B15R1.131 OB(O)CCCCOc1ccccc1F 7a_100000210171_200009817182 [0,1,0,0,0,1|1,0,1]=4 10129 B15R1.131 OB(O)CCCCOc1ccccc1I 34a_100000739446_200009817182 [0,1,0,0,0,1|1,0,1]=4 10130 B15R1.131 OB(O)CCCCOc1ccccc1I 7a_100000739446_200009817182 [0,1,0,0,0,1|1,0,1]=4 10131 B15R1.131 OB(O)CCCCSc1ccccc1Br 62a_100000695589_200009817182 [0,1,0,0,0,1|1,0,1]=4 10132 B15R1.131 OB(O)CCCCSc1ccccc1Br 62a_200009817182_100000695589 [0,1,0,0,0,1|1,0,1]=4 10133 B15R1.131 OB(O)CCCCSc1ccccc1Cl 62a_100000764095_200009817182 [0,1,0,0,0,1|1,0,1]=4 10134 B15R1.131 OB(O)CCCCSc1ccccc1Cl 62a_200009817182_100000764095 [0,1,0,0,0,1|1,0,1]=4 10135 B15R1.131 OB(O)CCCCSc1ccccc1F 62a_100011215700_200009817182 [0,1,0,0,0,1|1,0,1]=4 10136 B15R1.131 OB(O)CCCCSc1ccccc1F 62a_200009817182_100011215700 [0,1,0,0,0,1|1,0,1]=4 10137 B15R1.131 OB(O)CCCCSc1ccccc1O 62a_100000739446_200009817182 [0,1,0,0,0,1|1,0,1]=4 10138 B15R1.131 OB(O)CCCCSc1ccccc1O 62a_200009817182_100000739446 [0,1,0,0,0,1|1,0,1]=4 10139 B15R1.497 C=C(Br)CCOCC(C)c1ccccc1 34a_100009813270_100000756946 [0,1,0,0,0,1|2,0,0]=4 10140 B15R1.497 C=C(Br)CCOCC(O)c1ccccc1 34a_100009813270_100000185958 [0,1,0,0,0,1|2,0,0]=4 10141 B15R1.497 C=C(Br)CCOC[C@@H](O)c1ccccc1 34a_100009813270_100011933945 [0,1,0,0,0,1|2,0,0]=4 10142 B15R1.497 C=C(C)CCNCC(C)c1ccccc1 2230a_100000701038_100000730704 [0,1,0,0,0,1|2,0,0]=4 10143 B15R1.497 C=C(C)CCNCC(C)c1ccccc1 34a_100000701038_100000730704 [0,1,0,0,0,1|2,0,0]=4 10144 B15R1.497 C=C(C)CCNCC(O)c1ccccc1 2230a_100000210709_100000730704 [0,1,0,0,0,1|2,0,0]=4 10145 B15R1.497 C=C(C)CCOCC(C)c1ccccc1 34a_100000764851_100000756946 [0,1,0,0,0,1|2,0,0]=4 10146 B15R1.497 C=C(C)CCOCC(C)c1ccccc1 34a_100011215166_100000730704 [0,1,0,0,0,1|2,0,0]=4 10147 B15R1.497 C=C(C)CCOCC(C)c1ccccc1 7a_100011215166_100000730704 [0,1,0,0,0,1|2,0,0]=4 10148 B15R1.497 C=C(C)CCOCC(O)c1ccccc1 34a_100000764851_100000185958 [0,1,0,0,0,1|2,0,0]=4 10149 B15R1.497 C=C(C)CCOC[C@@H](N)c1ccccc1 34a_100000751927_100000730704 [0,1,0,0,0,1|2,0,0]=4 10150 B15R1.497 C=C(C)CCOC[C@@H](O)c1ccccc1 34a_100000764851_100011933945 [0,1,0,0,0,1|2,0,0]=4 10151 B15R1.497 C=C(C)CCSCC(C)c1ccccc1 62a_100000730704_100000756946 [0,1,0,0,0,1|2,0,0]=4 10152 B15R1.497 C=C(C)CCSCC(C)c1ccccc1 62a_100000756946_100000730704 [0,1,0,0,0,1|2,0,0]=4 10153 B15R1.497 C=C(C)CCSCC(O)c1ccccc1 62a_100000185958_100000730704 [0,1,0,0,0,1|2,0,0]=4 10154 B15R1.497 C=C(C)CCSCC(O)c1ccccc1 62a_100000730704_100000185958 [0,1,0,0,0,1|2,0,0]=4 10155 B15R1.497 C=C(C)CCSC[C@@H](O)c1ccccc1 62a_100000730704_100011933945 [0,1,0,0,0,1|2,0,0]=4 10156 B15R1.497 C=C(C)CCSC[C@@H](O)c1ccccc1 62a_100011933945_100000730704 [0,1,0,0,0,1|2,0,0]=4 10157 B15R1.497 C=C(C)CNCCC(O)c1ccccc1 2230a_100000763605_100000748629 [0,1,0,0,0,1|2,0,0]=4 10158 B15R1.497 C=C(C)COCC[C@@H](O)c1ccccc1 34a_100000210245_100000729684 [0,1,0,0,0,1|2,0,0]=4 10159 B15R1.497 C=C(C)COCC[C@H](N)c1ccccc1 34a_100025705951_100000748629 [0,1,0,0,0,1|2,0,0]=4 10160 B15R1.497 C=C(C)CSCC[C@@H](O)c1ccccc1 62a_100000729684_100000211660 [0,1,0,0,0,1|2,0,0]=4 10161 B15R1.497 C=C(C)CSCC[C@@H](O)c1ccccc1 62a_100000748629_100000729684 [0,1,0,0,0,1|2,0,0]=4 10162 B15R1.497 C=C(F)CNCCC(O)c1ccccc1 2230a_100000763605_100009893438 [0,1,0,0,0,1|2,0,0]=4 10163 B15R1.497 C=C(F)COCC[C@@H](O)c1ccccc1 34a_200010262243_100000729684 [0,1,0,0,0,1|2,0,0]=4 10164 B15R1.497 C=C(F)COCC[C@H](N)c1ccccc1 34a_100025705951_100009893438 [0,1,0,0,0,1|2,0,0]=4 10165 B15R1.497 C=C(F)CSCC[C@@H](O)c1ccccc1 62a_100000042424_100000729684 [0,1,0,0,0,1|2,0,0]=4 10166 B15R1.497 C=C(F)CSCC[C@@H](O)c1ccccc1 62a_100000729684_100000042424 [0,1,0,0,0,1|2,0,0]=4 10167 B15R1.497 CC(=O)CCCCC(=O)c1ccccc1 1458a_100000185807_100000735457 [0,1,0,0,0,1|1,0,0]=3 10168 B15R1.497 CC(=O)CCCCN(C)c1ccccc1 269982a_100000210012_100000735457 [0,1,0,0,0,1|1,0,0]=3 10169 B15R1.497 CC(=O)CCCCN(C)c1ccccc1 34a_100000210012_100009817362 [0,1,0,0,0,1|1,0,0]=3 10170 B15R1.497 CC(=O)CCCNC(=O)c1ccccc1 1458a_100000194758_200000210301 [0,1,0,0,0,1|1,0,1]=4 10171 B15R1.497 CC(=O)CCCOC(=O)c1ccccc1 1458a_100000070787_200009892979 [0,1,0,0,0,1|1,0,1]=4 10172 B15R1.497 CC(=O)CCCOC(C)c1ccccc1 34a_100000759063_100000211855 [0,1,0,0,0,1|1,0,0]=3 10173 B15R1.497 CC(=O)CCCOC(C)c1ccccc1 7a_100000759063_100000230085 [0,1,0,0,0,1|1,0,0]=3 10174 B15R1.497 CC(=O)CCCO[C@H](C)c1ccccc1 34a_100000761318_100000685027 [0,1,0,0,0,1|1,0,0]=3 10175 B15R1.497 CC(=O)CCCO[C@H](C)c1ccccc1 7a_100000761318_100011215641 [0,1,0,0,0,1|1,0,0]=3 10176 B15R1.497 CC(=O)CCCSC(C)c1ccccc1 62a_100000230085_100011215641 [0,1,0,0,0,1|1,0,0]=3 10177 B15R1.497 CC(=O)CCCSC(C)c1ccccc1 62a_100011215641_100000230085 [0,1,0,0,0,1|1,0,0]=3 10178 B15R1.497 CC(=O)CCOCC(=O)c1ccccc1 7a_100000759926_100000211460 [0,1,0,0,0,1|1,0,1]=4 10179 B15R1.497 CC(=O)CCOCC(C)c1ccccc1 34a_100000759926_100000756946 [0,1,0,0,0,1|1,0,0]=3 10180 B15R1.497 CC(=O)CCOCC(C)c1ccccc1 7a_100000759926_100000756946 [0,1,0,0,0,1|1,0,0]=3 10181 B15R1.497 CC(=O)CCOCC(C)c1ccccc1 7a_100011215166_100000053229 [0,1,0,0,0,1|1,0,0]=3 10182 B15R1.497 CC(=O)CCOCC(O)c1ccccc1 34a_100000759926_100000185958 [0,1,0,0,0,1|1,0,0]=3 10183 B15R1.497 CC(=O)CCOCC(O)c1ccccc1 7a_100000759926_100000185958 [0,1,0,0,0,1|1,0,0]=3 10184 B15R1.497 CC(=O)CCOC[C@@H](O)c1ccccc1 34a_100000759926_100011933945 [0,1,0,0,0,1|1,0,0]=3 10185 B15R1.497 CC(=O)CCOC[C@@H](O)c1ccccc1 7a_100000759926_100011933945 [0,1,0,0,0,1|1,0,0]=3 10186 B15R1.497 CC(=O)CCSCC(=O)c1ccccc1 62a_100000053229_100000211460 [0,1,0,0,0,1|1,0,1]=4 10187 B15R1.497 CC(=O)CCSCC(=O)c1ccccc1 62a_100000211460_100000053229 [0,1,0,0,0,1|1,0,1]=4 10188 B15R1.497 CC(=O)CCSCC(C)c1ccccc1 62a_100000053229_100000756946 [0,1,0,0,0,1|1,0,0]=3 10189 B15R1.497 CC(=O)CCSCC(C)c1ccccc1 62a_100000756946_100000053229 [0,1,0,0,0,1|1,0,0]=3 10190 B15R1.497 CC(=O)CCSCC(O)c1ccccc1 62a_100000053229_100000185958 [0,1,0,0,0,1|1,0,0]=3 10191 B15R1.497 CC(=O)CCSCC(O)c1ccccc1 62a_100000185958_100000053229 [0,1,0,0,0,1|1,0,0]=3 10192 B15R1.497 CC(=O)CCSCS(=O)c1ccccc1 62a_100000053229_100000031784 [0,1,0,0,0,1|2,0,0]=4 10193 B15R1.497 CC(=O)CCSC[C@@H](O)c1ccccc1 62a_100000053229_100011933945 [0,1,0,0,0,1|1,0,0]=3 10194 B15R1.497 CC(=O)CCSC[C@@H](O)c1ccccc1 62a_100011933945_100000053229 [0,1,0,0,0,1|1,0,0]=3 10195 B15R1.497 CC(=O)COCC[C@@H](O)c1ccccc1 34a_100000211253_100000729684 [0,1,0,0,0,1|1,0,0]=3 10196 B15R1.497 CC(=O)NCCCN(C)c1ccccc1 11a_100000211881_100015343762 [0,1,0,0,0,1|2,0,0]=4 10197 B15R1.497 CC(=O)NCCCN(C)c1ccccc1 240690a_100000211881_100015343762 [0,1,0,0,0,1|2,0,0]=4 10198 B15R1.497 CC(=O)NCCCN(C)c1ccccc1 527a_100000211881_100103153847 [0,1,0,0,0,1|2,0,0]=4 10199 B15R1.497 CC(=O)NCCNC(C)c1ccccc1 2230a_100000209853_100000230085 [0,1,0,0,0,1|2,0,0]=4 10200 B15R1.497 CC(=O)NCCNC(C)c1ccccc1 269862a_100000209853_100000185851 [0,1,0,0,0,1|2,0,0]=4 10201 B15R1.497 CC(=O)NCCN[C@H](C)c1ccccc1 2230a_100000751104_100000189650 [0,1,0,0,0,1|2,0,0]=4 10202 B15R1.497 CC(=O)NCCOC(C)c1ccccc1 34a_100000158858_100000211855 [0,1,0,0,0,1|2,0,0]=4 10203 B15R1.497 CC(=O)NCCO[C@H](C)c1ccccc1 7a_100000761318_100000189650 [0,1,0,0,0,1|2,0,0]=4 10204 B15R1.497 CC(=O)NCCSC(C)c1ccccc1 62a_100000189650_100000230085 [0,1,0,0,0,1|2,0,0]=4 10205 B15R1.497 CC(=O)NCCSC(C)c1ccccc1 62a_100000230085_100000189650 [0,1,0,0,0,1|2,0,0]=4 10206 B15R1.497 CC(=O)OCCCC(=O)c1ccccc1 1458a_100000185807_100000042594 [0,1,0,0,0,1|1,0,1]=4 10207 B15R1.497 CC(=O)OCCCN(C)c1ccccc1 269982a_100000210012_100000042594 [0,1,0,0,0,1|2,0,0]=4 10208 B15R1.497 CC(=O)OCCCN(C)c1ccccc1 34a_100000210012_100000042594 [0,1,0,0,0,1|2,0,0]=4 10209 B15R1.497 CC(=O)OCCO[C@H](C)c1ccccc1 34a_100000761318_100009814007 [0,1,0,0,0,1|2,0,0]=4 10210 B15R1.497 CC(=O)OCCO[C@H](C)c1ccccc1 7a_100000761318_100009814007 [0,1,0,0,0,1|2,0,0]=4 10211 B15R1.497 CC(=O)OCCSC(C)c1ccccc1 62a_100000230085_100009814007 [0,1,0,0,0,1|2,0,0]=4 10212 B15R1.497 CC(=O)OCCSC(C)c1ccccc1 62a_100009814007_100000230085 [0,1,0,0,0,1|2,0,0]=4 10213 B15R1.497 CC(=O)OCNCC(C)c1ccccc1 34a_100000701038_100009813279 [0,1,0,0,0,1|2,0,0]=4 10214 B15R1.497 CC(=O)OCOCC(C)c1ccccc1 34a_100011215166_100009813279 [0,1,0,0,0,1|2,0,0]=4 10215 B15R1.497 CC(=O)OCOC[C@@H](N)c1ccccc1 34a_100000751927_100009813279 [0,1,0,0,0,1|2,0,0]=4 10216 B15R1.497 CC(=O)OCSCC(C)c1ccccc1 62a_100000076356_100000756946 [0,1,0,0,0,1|2,0,0]=4 10217 B15R1.497 CC(=O)OCSCC(C)c1ccccc1 62a_100000756946_100000076356 [0,1,0,0,0,1|2,0,0]=4 10218 B15R1.497 CC(=O)OCSCC(O)c1ccccc1 62a_100000076356_100000185958 [0,1,0,0,0,1|2,0,0]=4 10219 B15R1.497 CC(=O)OCSCC(O)c1ccccc1 62a_100000185958_100000076356 [0,1,0,0,0,1|2,0,0]=4 10220 B15R1.497 CC(=O)OCSC[C@@H](O)c1ccccc1 62a_100000076356_100011933945 [0,1,0,0,0,1|2,0,0]=4 10221 B15R1.497 CC(=O)OCSC[C@@H](O)c1ccccc1 62a_100011933945_100000076356 [0,1,0,0,0,1|2,0,0]=4 10222 B15R1.497 CC(=O)SCCCC(=O)c1ccccc1 1458a_100000185807_100000038929 [0,1,0,0,0,1|1,0,1]=4 10223 B15R1.497 CC(=O)SCCCN(C)c1ccccc1 2230a_100000210012_100000038929 [0,1,0,0,0,1|2,0,0]=4 10224 B15R1.497 CC(=O)SCCCN(C)c1ccccc1 269982a_100000210012_100000038929 [0,1,0,0,0,1|2,0,0]=4 10225 B15R1.497 CC(=O)SCCCN(C)c1ccccc1 34a_100000210012_100000038929 [0,1,0,0,0,1|2,0,0]=4 10226 B15R1.497 CC(=O)SCCNC(C)c1ccccc1 269862a_100020647217_100000185851 [0,1,0,0,0,1|2,0,0]=4 10227 B15R1.497 CC(CNCCC(=O)N)c1ccccc1 2230a_100000701038_100000744528 [0,1,0,0,0,1|1,0,0]=3 10228 B15R1.497 CC(CNCCC(=O)N)c1ccccc1 34a_100000701038_100000731001 [0,1,0,0,0,1|1,0,0]=3 10229 B15R1.497 CC(CNOCC(=O)O)c1ccccc1 269956a_100000106656_100000756946 [0,1,0,0,0,1|1,0,0]=3 10230 B15R1.497 CC(COCCC(=O)N)c1ccccc1 34a_100000757172_100000756946 [0,1,0,0,0,1|1,0,0]=3 10231 B15R1.497 CC(COCCC(=O)N)c1ccccc1 34a_100011215166_100000731001 [0,1,0,0,0,1|1,0,0]=3 10232 B15R1.497 CC(COCCC(=O)N)c1ccccc1 7a_100000757172_100000756946 [0,1,0,0,0,1|1,0,0]=3 10233 B15R1.497 CC(COCCC(=O)N)c1ccccc1 7a_100011215166_100000744528 [0,1,0,0,0,1|1,0,0]=3 10234 B15R1.497 CC(CSCCC(=O)N)c1ccccc1 62a_100000744528_100000756946 [0,1,0,0,0,1|1,0,0]=3 10235 B15R1.497 CC(CSCCC(=O)N)c1ccccc1 62a_100000756946_100000744528 [0,1,0,0,0,1|1,0,0]=3 10236 B15R1.497 CC(NCCCC(=O)N)c1ccccc1 269862a_100000739312_100000185851 [0,1,0,0,0,1|1,0,0]=3 10237 B15R1.497 CC(NCCCC(=O)N)c1ccccc1 34a_100000739312_100000211855 [0,1,0,0,0,1|1,0,0]=3 10238 B15R1.497 CC(NCCCC(=O)N)c1ccccn1 269862a_100000739312_100000210467 [0,1,0,0,0,1|2,0,0]=4 10239 B15R1.497 CC(NCCCC(=O)N)c1cccnc1 269862a_100000739312_100000210468 [0,1,0,0,0,1|2,0,0]=4 10240 B15R1.497 CC(NCCCC(=O)N)c1ccncc1 269862a_100000739312_100000185792 [0,1,0,0,0,1|2,0,0]=4 10241 B15R1.497 CC(NCCCS(=O)C)c1ccccc1 2230a_200000753449_100000230085 [0,1,0,0,0,1|2,0,0]=4 10242 B15R1.497 CC(NCCNC(=O)N)c1ccccc1 269862a_100020590234_100000185851 [0,1,0,0,0,1|2,0,0]=4 10243 B15R1.497 CC(NCCNC(=O)N)c1ccccc1 34a_100020590234_100000211855 [0,1,0,0,0,1|2,0,0]=4 10244 B15R1.497 CC(O)CCCN[C@H](C)c1ccccc1 2230a_100000751104_200000718107 [0,1,0,0,0,1|1,0,1]=4 10245 B15R1.497 CC(O)CCCO[C@H](C)c1ccccc1 34a_100000761318_200000718107 [0,1,0,0,0,1|1,0,1]=4 10246 B15R1.497 CC(O)CCCO[C@H](C)c1ccccc1 7a_100000761318_200000718107 [0,1,0,0,0,1|1,0,1]=4 10247 B15R1.497 CC(O)CCCSC(C)c1ccccc1 62a_100000230085_200000718107 [0,1,0,0,0,1|1,0,1]=4 10248 B15R1.497 CC(O)CCCSC(C)c1ccccc1 62a_200000718107_100000230085 [0,1,0,0,0,1|1,0,1]=4 10249 B15R1.497 CC(O)CCNCC(C)c1ccccc1 2230a_100000701038_100012276601 [0,1,0,0,0,1|1,0,1]=4 10250 B15R1.497 CC(O)CCNCC(C)c1ccccc1 2230a_200000755665_100000756946 [0,1,0,0,0,1|1,0,1]=4 10251 B15R1.497 CC(O)CCNCC(C)c1ccccc1 270004a_200000755665_100000212034 [0,1,0,0,0,1|1,0,1]=4 10252 B15R1.497 CC(O)CCNCC(C)c1ccccc1 34a_100000701038_100012276601 [0,1,0,0,0,1|1,0,1]=4 10253 B15R1.497 CC(O)CCNCC(O)c1ccccc1 2230a_100000210709_100012276601 [0,1,0,0,0,1|1,0,1]=4 10254 B15R1.497 CC(O)CCNCC(O)c1ccccc1 2230a_200000755665_100000185958 [0,1,0,0,0,1|1,0,1]=4 10255 B15R1.497 CC(O)CCNC[C@@H](O)c1ccccc1 2230a_200000755665_100011933945 [0,1,0,0,0,1|1,0,1]=4 10256 B15R1.497 CC(O)CCOCC(C)c1ccccc1 34a_100011215166_100012276601 [0,1,0,0,0,1|1,0,1]=4 10257 B15R1.497 CC(O)CCOCC(C)c1ccccc1 7a_100011215166_100012276601 [0,1,0,0,0,1|1,0,1]=4 10258 B15R1.497 CC(O)CCOC[C@@H](N)c1ccccc1 34a_100000751927_100012276601 [0,1,0,0,0,1|1,0,1]=4 10259 B15R1.497 CC(O)CCSCC(C)c1ccccc1 62a_100000756946_100012276601 [0,1,0,0,0,1|1,0,1]=4 10260 B15R1.497 CC(O)CCSCC(C)c1ccccc1 62a_100012276601_100000756946 [0,1,0,0,0,1|1,0,1]=4 10261 B15R1.497 CC(O)CCSCC(O)c1ccccc1 62a_100000185958_100012276601 [0,1,0,0,0,1|1,0,1]=4 10262 B15R1.497 CC(O)CCSCC(O)c1ccccc1 62a_100012276601_100000185958 [0,1,0,0,0,1|1,0,1]=4 10263 B15R1.497 CC(O)CCSC[C@@H](O)c1ccccc1 62a_100011933945_100012276601 [0,1,0,0,0,1|1,0,1]=4 10264 B15R1.497 CC(O)CCSC[C@@H](O)c1ccccc1 62a_100012276601_100011933945 [0,1,0,0,0,1|1,0,1]=4 10265 B15R1.497 CC(O)CNCCC(C)c1ccccc1 270004a_100000210904_100000189432 [0,1,0,0,0,1|1,0,1]=4 10266 B15R1.497 CC(O)CNCCC(O)c1ccccc1 2230a_100000763605_100011218427 [0,1,0,0,0,1|1,0,1]=4 10267 B15R1.497 CC(O)CNCC[C@@H](O)c1ccccc1 2230a_100000210904_100000729684 [0,1,0,0,0,1|1,0,1]=4 10268 B15R1.497 CC(O)CNCC[C@@H](O)c1ccccc1 34a_100000210904_100000729684 [0,1,0,0,0,1|1,0,1]=4 10269 B15R1.497 CC(O)COCC[C@H](N)c1ccccc1 34a_100025705951_100011218427 [0,1,0,0,0,1|1,0,1]=4 10270 B15R1.497 CC(O)CSCC[C@@H](O)c1ccccc1 62a_100000729684_100011218427 [0,1,0,0,0,1|1,0,1]=4 10271 B15R1.497 CC(O)CSCC[C@@H](O)c1ccccc1 62a_100011218427_100000729684 [0,1,0,0,0,1|1,0,1]=4 10272 B15R1.497 CC(OCCC[N+](=O)[O-])c1ccccc1 34a_200000037920_100000211855 [0,1,0,0,0,1|1,0,1]=4 10273 B15R1.497 CC(OCCNC(=O)N)c1ccccc1 34a_100000181757_100000211855 [0,1,0,0,0,1|2,0,0]=4 10274 B15R1.497 CC(OCCOC(=O)N)c1ccccc1 7a_100000766696_100000230085 [0,1,0,0,0,1|2,0,0]=4 10275 B15R1.497 CC(SCCCC(=O)N)c1ccccc1 62a_100000230085_100102525003 [0,1,0,0,0,1|1,0,0]=3 10276 B15R1.497 CC(SCCCC(=O)N)c1ccccc1 62a_100102525003_100000230085 [0,1,0,0,0,1|1,0,0]=3 10277 B15R1.497 CC(SCCNC(=O)N)c1ccccc1 62a_100000230085_200000034859 [0,1,0,0,0,1|2,0,0]=4 10278 B15R1.497 CC(SCCNC(=O)N)c1ccccc1 62a_200000034859_100000230085 [0,1,0,0,0,1|2,0,0]=4 10279 B15R1.497 CC(SCCOC(=O)N)c1ccccc1 62a_100000230085_200011214921 [0,1,0,0,0,1|2,0,0]=4 10280 B15R1.497 CC(SCCOC(=O)N)c1ccccc1 62a_200011214921_100000230085 [0,1,0,0,0,1|2,0,0]=4 10281 B15R1.497 CN(CCCCB(O)O)c1ccccc1 2230a_100000210012_200009817182 [0,1,0,0,0,1|1,0,1]=4 10282 B15R1.497 CN(CCCCB(O)O)c1ccccc1 269982a_100000210012_200009817182 [0,1,0,0,0,1|1,0,1]=4 10283 B15R1.497 CN(CCCCB(O)O)c1ccccc1 34a_100000210012_200009817182 [0,1,0,0,0,1|1,0,1]=4 10284 B15R1.497 CN(CCOCC(=O)N)c1ccccc1 2230a_100000210012_100000076697 [0,1,0,0,0,1|2,0,0]=4 10285 B15R1.497 CN(CCOCC(=O)N)c1ccccc1 269982a_100000210012_100000076697 [0,1,0,0,0,1|2,0,0]=4 10286 B15R1.497 CN(CCOCC(=O)N)c1ccccc1 34a_100000210012_100000076697 [0,1,0,0,0,1|2,0,0]=4 10287 B15R1.497 C[C@@H](NCCNC(=O)N)c1ccccc1 2230a_100000751104_200000034859 [0,1,0,0,0,1|2,0,0]=4 10288 B15R1.497 C[C@@H](O)CNCCC(O)c1ccccc1 2230a_100000763605_100009817552 [0,1,0,0,0,1|1,0,1]=4 10289 B15R1.497 C[C@@H](O)COCC[C@H](N)c1ccccc1 34a_100025705951_100009817552 [0,1,0,0,0,1|1,0,1]=4 10290 B15R1.497 C[C@@H](O)CSCC[C@@H](O)c1ccccc1 62a_100000729684_100009817552 [0,1,0,0,0,1|1,0,1]=4 10291 B15R1.497 C[C@@H](O)CSCC[C@@H](O)c1ccccc1 62a_100009817552_100000729684 [0,1,0,0,0,1|1,0,1]=4 10292 B15R1.497 C[C@@H](OCCCC(=O)N)c1ccccc1 34a_100000761318_100102525003 [0,1,0,0,0,1|1,0,0]=3 10293 B15R1.497 C[C@@H](OCCCC(=O)N)c1ccccc1 7a_100000761318_100102525003 [0,1,0,0,0,1|1,0,0]=3 10294 B15R1.497 C[C@@H](OCCNC(=O)N)c1ccccc1 7a_100000761318_200000034859 [0,1,0,0,0,1|2,0,0]=4 10295 B15R1.497 C[C@@H](OCCOC(=O)N)c1ccccc1 34a_100000761318_200011214921 [0,1,0,0,0,1|2,0,0]=4 10296 B15R1.497 C[C@@H](OCCOC(=O)N)c1ccccc1 7a_100000761318_200011214921 [0,1,0,0,0,1|2,0,0]=4 10297 B15R1.497 NC(=O)CCCNC(=O)c1ccccc1 240690a_100000739312_100000185807 [0,1,0,0,0,1|1,0,1]=4 10298 B15R1.497 NC(=O)CCCNC(=O)c1ccccc1 527a_100000739312_100000185807 [0,1,0,0,0,1|1,0,1]=4 10299 B15R1.497 NC(=O)CCNCC(O)c1ccccc1 2230a_100000210709_100000744528 [0,1,0,0,0,1|1,0,0]=3 10300 B15R1.497 NC(=O)CCNCC(O)c1ccccn1 2230a_100000691469_100000744528 [0,1,0,0,0,1|2,0,0]=4 10301 B15R1.497 NC(=O)CCNCC(O)c1cccnc1 2230a_100020605170_100000744528 [0,1,0,0,0,1|2,0,0]=4 10302 B15R1.497 NC(=O)CCOCC(=O)c1ccccc1 7a_100000757172_100000211460 [0,1,0,0,0,1|1,0,1]=4 10303 B15R1.497 NC(=O)CCOCC(O)c1ccccc1 34a_100000757172_100000185958 [0,1,0,0,0,1|1,0,0]=3 10304 B15R1.497 NC(=O)CCOCC(O)c1ccccc1 7a_100000757172_100000185958 [0,1,0,0,0,1|1,0,0]=3 10305 B15R1.497 NC(=O)CCOC[C@@H](N)c1ccccc1 34a_100000751927_100000731001 [0,1,0,0,0,1|1,0,0]=3 10306 B15R1.497 NC(=O)CCOC[C@@H](N)c1ccncc1 34a_100138412524_100000731001 [0,1,0,0,0,1|2,0,0]=4 10307 B15R1.497 NC(=O)CCOC[C@@H](O)c1ccccc1 34a_100000757172_100011933945 [0,1,0,0,0,1|1,0,0]=3 10308 B15R1.497 NC(=O)CCOC[C@@H](O)c1ccccc1 7a_100000757172_100011933945 [0,1,0,0,0,1|1,0,0]=3 10309 B15R1.497 NC(=O)CCSCC(=O)c1ccccc1 62a_100000211460_100000744528 [0,1,0,0,0,1|1,0,1]=4 10310 B15R1.497 NC(=O)CCSCC(=O)c1ccccc1 62a_100000744528_100000211460 [0,1,0,0,0,1|1,0,1]=4 10311 B15R1.497 NC(=O)CCSCC(O)c1ccccc1 62a_100000185958_100000744528 [0,1,0,0,0,1|1,0,0]=3 10312 B15R1.497 NC(=O)CCSCC(O)c1ccccc1 62a_100000744528_100000185958 [0,1,0,0,0,1|1,0,0]=3 10313 B15R1.497 NC(=O)CCSCS(=O)c1ccccc1 62a_100000744528_100000031784 [0,1,0,0,0,1|2,0,0]=4 10314 B15R1.497 NC(=O)CCSC[C@@H](O)c1ccccc1 62a_100000744528_100011933945 [0,1,0,0,0,1|1,0,0]=3 10315 B15R1.497 NC(=O)CCSC[C@@H](O)c1ccccc1 62a_100011933945_100000744528 [0,1,0,0,0,1|1,0,0]=3 10316 B15R1.497 NC(=O)CNCCC(=O)c1ccccc1 2230a_100000711301_100000750707 [0,1,0,0,0,1|1,0,1]=4 10317 B15R1.497 NC(=O)CNCCC(O)c1ccccc1 2230a_100000763605_100000747473 [0,1,0,0,0,1|1,0,0]=3 10318 B15R1.497 NC(=O)CNCCS(=O)c1ccccc1 2230a_100000711301_100000740319 [0,1,0,0,0,1|2,0,0]=4 10319 B15R1.497 NC(=O)CNCC[C@@H](O)c1ccccc1 2230a_100000711301_100000729684 [0,1,0,0,0,1|1,0,0]=3 10320 B15R1.497 NC(=O)COCCC(=O)c1ccccc1 1458a_100000185807_100000076697 [0,1,0,0,0,1|1,0,1]=4 10321 B15R1.497 NC(=O)COCC[C@H](N)c1ccccc1 34a_100025705951_100000187820 [0,1,0,0,0,1|1,0,0]=3 10322 B15R1.497 NC(=O)CSCCC(=O)c1ccccc1 62a_100000747473_100000750707 [0,1,0,0,0,1|1,0,1]=4 10323 B15R1.497 NC(=O)CSCCC(=O)c1ccccc1 62a_100000750707_100000747473 [0,1,0,0,0,1|1,0,1]=4 10324 B15R1.497 NC(=O)CSCCS(=O)c1ccccc1 62a_100000747473_100000740319 [0,1,0,0,0,1|2,0,0]=4 10325 B15R1.497 NC(=O)CSCC[C@@H](O)c1ccccc1 62a_100000729684_100000747473 [0,1,0,0,0,1|1,0,0]=3 10326 B15R1.497 NC(=O)CSCC[C@@H](O)c1ccccc1 62a_100000747473_100000729684 [0,1,0,0,0,1|1,0,0]=3 10327 B15R1.497 N[C@@H](CCOCC(=O)[O-])c1ccccc1 34a_100025705951_100020667443 [0,1,0,0,0,1|0,0,1]=3 10328 B15R1.497 N[C@@H](CCOC[N+](=O)[O-])c1ccccc1 34a_100025705951_100000761209 [0,1,0,0,0,1|1,0,1]=4 10329 B15R1.497 O=C(CCCCB(O)O)c1ccccc1 1458a_100000185807_200009817182 [0,1,0,0,0,1|1,0,1]=4 10330 B15R1.497 O=C(O)CNCCC(=O)c1ccccc1 269956a_100016091260_100000750707 [0,1,0,0,0,1|0,0,1]=3 10331 B15R1.497 O=C(O)CNCCS(=O)c1ccccc1 269956a_100016091260_100000740319 [0,1,0,0,0,1|1,0,0]=3 10332 B15R1.497 O=C(O)CNCC[C@@H](O)c1ccccc1 269956a_100016091260_100000729684 [0,1,0,0,0,1|0,0,0]=2 10333 B15R1.497 O=C(O)CNCOC(=O)c1ccccc1 269956a_100016091260_100000073877 [0,1,0,0,0,1|1,0,1]=4 10334 B15R1.497 O=C(O)CONCC(=O)c1ccccc1 269956a_100000106656_100000211460 [0,1,0,0,0,1|1,0,1]=4 10335 B15R1.497 O=C(O)CONCC(O)c1ccccc1 269956a_100000106656_100000185958 [0,1,0,0,0,1|1,0,0]=3 10336 B15R1.497 O=C(O)CONCS(=O)c1ccccc1 269956a_100000106656_100000031784 [0,1,0,0,0,1|2,0,0]=4 10337 B15R1.497 O=C(O)CONC[C@@H](O)c1ccccc1 269956a_100000106656_100011933945 [0,1,0,0,0,1|1,0,0]=3 10338 B15R1.497 O=C([O-])CSCCC(=O)c1ccccc1 62a_100000750707_100020667443 [0,1,0,0,0,1|0,0,2]=4 10339 B15R1.497 O=C([O-])CSCCC(=O)c1ccccc1 62a_100020667443_100000750707 [0,1,0,0,0,1|0,0,2]=4 10340 B15R1.497 O=C([O-])CSCCS(=O)c1ccccc1 62a_100020667443_100000740319 [0,1,0,0,0,1|1,0,1]=4 10341 B15R1.497 O=C([O-])CSCC[C@@H](O)c1ccccc1 62a_100000729684_100020667443 [0,1,0,0,0,1|0,0,1]=3 10342 B15R1.497 O=C([O-])CSCC[C@@H](O)c1ccccc1 62a_100020667443_100000729684 [0,1,0,0,0,1|0,0,1]=3 10343 B15R1.497 O=[N+]([O-])CSCC[C@@H](O)c1ccccc1 62a_100000729684_100000761209 [0,1,0,0,0,1|1,0,1]=4 10344 B15R1.497 [13CH3]C(=O)CCCNC(=O)c1ccccc1 1458a_100000194758_200025704644 [0,1,0,0,0,1|1,0,1]=4 10345 B15R1.871 C=C(Br)CCOCCc1ccc(cc1)Br 34a_100009813270_100011740612 [0,1,0,0,0,1|2,0,0]=4 10346 B15R1.871 C=C(Br)CCOCCc1ccc(cc1)C 34a_100009813270_100011713686 [0,1,0,0,0,1|2,0,0]=4 10347 B15R1.871 C=C(Br)CCOCCc1ccc(cc1)Cl 34a_100009813270_100011713675 [0,1,0,0,0,1|2,0,0]=4 10348 B15R1.871 C=C(Br)CCOCCc1ccc(cc1)F 34a_100009813270_100011217392 [0,1,0,0,0,1|2,0,0]=4 10349 B15R1.871 C=C(C)CCNCCc1ccc(cc1)Br 2230a_100000755846_100000730704 [0,1,0,0,0,1|2,0,0]=4 10350 B15R1.871 C=C(C)CCNCCc1ccc(cc1)Br 34a_100000755846_100000730704 [0,1,0,0,0,1|2,0,0]=4 10351 B15R1.871 C=C(C)CCNCCc1ccc(cc1)C 2230a_100000705350_100000730704 [0,1,0,0,0,1|2,0,0]=4 10352 B15R1.871 C=C(C)CCNCCc1ccc(cc1)C 34a_100000705350_100000730704 [0,1,0,0,0,1|2,0,0]=4 10353 B15R1.871 C=C(C)CCNCCc1ccc(cc1)Cl 2230a_100000185265_100000730704 [0,1,0,0,0,1|2,0,0]=4 10354 B15R1.871 C=C(C)CCNCCc1ccc(cc1)Cl 34a_100000185265_100000730704 [0,1,0,0,0,1|2,0,0]=4 10355 B15R1.871 C=C(C)CCNCCc1ccc(cc1)F 2230a_100000199005_100000730704 [0,1,0,0,0,1|2,0,0]=4 10356 B15R1.871 C=C(C)CCNCCc1ccc(cc1)F 34a_100000199005_100000730704 [0,1,0,0,0,1|2,0,0]=4 10357 B15R1.871 C=C(C)CCNCCc1ccc(cc1)O 34a_100000743037_100000730704 [0,1,0,0,0,1|2,0,0]=4 10358 B15R1.871 C=C(C)CCOCCc1ccc(cc1)Br 34a_100000764851_100011740612 [0,1,0,0,0,1|2,0,0]=4 10359 B15R1.871 C=C(C)CCOCCc1ccc(cc1)Br 34a_100000766406_100000730704 [0,1,0,0,0,1|2,0,0]=4 10360 B15R1.871 C=C(C)CCOCCc1ccc(cc1)Br 7a_100000766406_100000730704 [0,1,0,0,0,1|2,0,0]=4 10361 B15R1.871 C=C(C)CCOCCc1ccc(cc1)C 34a_100000756670_100000730704 [0,1,0,0,0,1|2,0,0]=4 10362 B15R1.871 C=C(C)CCOCCc1ccc(cc1)C 34a_100000764851_100011713686 [0,1,0,0,0,1|2,0,0]=4 10363 B15R1.871 C=C(C)CCOCCc1ccc(cc1)C 7a_100000756670_100000730704 [0,1,0,0,0,1|2,0,0]=4 10364 B15R1.871 C=C(C)CCOCCc1ccc(cc1)Cl 34a_100000764851_100011713675 [0,1,0,0,0,1|2,0,0]=4 10365 B15R1.871 C=C(C)CCOCCc1ccc(cc1)Cl 34a_100011219627_100000730704 [0,1,0,0,0,1|2,0,0]=4 10366 B15R1.871 C=C(C)CCOCCc1ccc(cc1)Cl 7a_100011219627_100000730704 [0,1,0,0,0,1|2,0,0]=4 10367 B15R1.871 C=C(C)CCOCCc1ccc(cc1)F 34a_100000754732_100000730704 [0,1,0,0,0,1|2,0,0]=4 10368 B15R1.871 C=C(C)CCOCCc1ccc(cc1)F 34a_100000764851_100011217392 [0,1,0,0,0,1|2,0,0]=4 10369 B15R1.871 C=C(C)CCOCCc1ccc(cc1)F 7a_100000754732_100000730704 [0,1,0,0,0,1|2,0,0]=4 10370 B15R1.871 C=C(C)CCOCCc1ccc(cc1)I 34a_100012291149_100000730704 [0,1,0,0,0,1|2,0,0]=4 10371 B15R1.871 C=C(C)CCOCCc1ccc(cc1)I 7a_100012291149_100000730704 [0,1,0,0,0,1|2,0,0]=4 10372 B15R1.871 C=C(C)CCOCCc1ccc(cc1)N 34a_100011204434_100000730704 [0,1,0,0,0,1|2,0,0]=4 10373 B15R1.871 C=C(C)CCSCCc1ccc(cc1)Br 62a_100000730704_100011740612 [0,1,0,0,0,1|2,0,0]=4 10374 B15R1.871 C=C(C)CCSCCc1ccc(cc1)Br 62a_100011740612_100000730704 [0,1,0,0,0,1|2,0,0]=4 10375 B15R1.871 C=C(C)CCSCCc1ccc(cc1)C 62a_100000730704_100011713686 [0,1,0,0,0,1|2,0,0]=4 10376 B15R1.871 C=C(C)CCSCCc1ccc(cc1)C 62a_100011713686_100000730704 [0,1,0,0,0,1|2,0,0]=4 10377 B15R1.871 C=C(C)CCSCCc1ccc(cc1)Cl 62a_100000730704_100011713675 [0,1,0,0,0,1|2,0,0]=4 10378 B15R1.871 C=C(C)CCSCCc1ccc(cc1)Cl 62a_100011713675_100000730704 [0,1,0,0,0,1|2,0,0]=4 10379 B15R1.871 C=C(C)CCSCCc1ccc(cc1)F 62a_100000730704_100011217392 [0,1,0,0,0,1|2,0,0]=4 10380 B15R1.871 C=C(C)CCSCCc1ccc(cc1)F 62a_100011217392_100000730704 [0,1,0,0,0,1|2,0,0]=4 10381 B15R1.871 C=C(C)CCSCCc1ccc(cc1)O 62a_100000730704_100009816426 [0,1,0,0,0,1|2,0,0]=4 10382 B15R1.871 C=C(C)CCSCCc1ccc(cc1)O 62a_100009816426_100000730704 [0,1,0,0,0,1|2,0,0]=4 10383 B15R1.871 C=C(C)CNCCCc1ccc(cc1)Br 2230a_100011297623_100000748629 [0,1,0,0,0,1|2,0,0]=4 10384 B15R1.871 C=C(C)CNCCCc1ccc(cc1)Br 34a_100011297623_100000748629 [0,1,0,0,0,1|2,0,0]=4 10385 B15R1.871 C=C(C)CNCCCc1ccc(cc1)C 2230a_100011236272_100000748629 [0,1,0,0,0,1|2,0,0]=4 10386 B15R1.871 C=C(C)CNCCCc1ccc(cc1)C 34a_100011236272_100000748629 [0,1,0,0,0,1|2,0,0]=4 10387 B15R1.871 C=C(C)CNCCCc1ccc(cc1)Cl 2230a_100000748451_100000748629 [0,1,0,0,0,1|2,0,0]=4 10388 B15R1.871 C=C(C)CNCCCc1ccc(cc1)Cl 34a_100000748451_100000748629 [0,1,0,0,0,1|2,0,0]=4 10389 B15R1.871 C=C(C)CNCCCc1ccc(cc1)F 2230a_100025745824_100000748629 [0,1,0,0,0,1|2,0,0]=4 10390 B15R1.871 C=C(C)CNCCCc1ccc(cc1)F 34a_100025745824_100000748629 [0,1,0,0,0,1|2,0,0]=4 10391 B15R1.871 C=C(C)COCCCc1ccc(cc1)Br 34a_100000210245_100011713682 [0,1,0,0,0,1|2,0,0]=4 10392 B15R1.871 C=C(C)COCCCc1ccc(cc1)Br 34a_100011709247_100000748629 [0,1,0,0,0,1|2,0,0]=4 10393 B15R1.871 C=C(C)COCCCc1ccc(cc1)Br 7a_100011709247_100000748629 [0,1,0,0,0,1|2,0,0]=4 10394 B15R1.871 C=C(C)COCCCc1ccc(cc1)C 34a_100000189427_100000748629 [0,1,0,0,0,1|2,0,0]=4 10395 B15R1.871 C=C(C)COCCCc1ccc(cc1)C 7a_100000189427_100000748629 [0,1,0,0,0,1|2,0,0]=4 10396 B15R1.871 C=C(C)COCCCc1ccc(cc1)Cl 34a_100000210245_100000759440 [0,1,0,0,0,1|2,0,0]=4 10397 B15R1.871 C=C(C)COCCCc1ccc(cc1)Cl 34a_100011217485_100000748629 [0,1,0,0,0,1|2,0,0]=4 10398 B15R1.871 C=C(C)COCCCc1ccc(cc1)Cl 7a_100011217485_100000748629 [0,1,0,0,0,1|2,0,0]=4 10399 B15R1.871 C=C(C)COCCCc1ccc(cc1)F 34a_100000210245_200011713563 [0,1,0,0,0,1|2,0,0]=4 10400 B15R1.871 C=C(C)COCCCc1ccc(cc1)F 34a_100000757351_100000748629 [0,1,0,0,0,1|2,0,0]=4 10401 B15R1.871 C=C(C)COCCCc1ccc(cc1)F 7a_100000757351_100000748629 [0,1,0,0,0,1|2,0,0]=4 10402 B15R1.871 C=C(C)CSCCCc1ccc(cc1)Br 62a_100000748629_100011713682 [0,1,0,0,0,1|2,0,0]=4 10403 B15R1.871 C=C(C)CSCCCc1ccc(cc1)Br 62a_100011713682_100000211660 [0,1,0,0,0,1|2,0,0]=4 10404 B15R1.871 C=C(C)CSCCCc1ccc(cc1)Cl 62a_100000748629_100000759440 [0,1,0,0,0,1|2,0,0]=4 10405 B15R1.871 C=C(C)CSCCCc1ccc(cc1)Cl 62a_100000759440_100000211660 [0,1,0,0,0,1|2,0,0]=4 10406 B15R1.871 C=C(C)CSCCCc1ccc(cc1)F 62a_100000748629_200011713563 [0,1,0,0,0,1|2,0,0]=4 10407 B15R1.871 C=C(C)CSCCCc1ccc(cc1)F 62a_200011713563_100000211660 [0,1,0,0,0,1|2,0,0]=4 10408 B15R1.871 C=C(F)CNCCCc1ccc(cc1)Br 2230a_100011297623_100009893438 [0,1,0,0,0,1|2,0,0]=4 10409 B15R1.871 C=C(F)CNCCCc1ccc(cc1)Br 34a_100011297623_100009893438 [0,1,0,0,0,1|2,0,0]=4 10410 B15R1.871 C=C(F)CNCCCc1ccc(cc1)C 2230a_100011236272_100009893438 [0,1,0,0,0,1|2,0,0]=4 10411 B15R1.871 C=C(F)CNCCCc1ccc(cc1)C 34a_100011236272_100009893438 [0,1,0,0,0,1|2,0,0]=4 10412 B15R1.871 C=C(F)CNCCCc1ccc(cc1)Cl 2230a_100000748451_100009893438 [0,1,0,0,0,1|2,0,0]=4 10413 B15R1.871 C=C(F)CNCCCc1ccc(cc1)Cl 34a_100000748451_100009893438 [0,1,0,0,0,1|2,0,0]=4 10414 B15R1.871 C=C(F)CNCCCc1ccc(cc1)F 2230a_100025745824_100009893438 [0,1,0,0,0,1|2,0,0]=4 10415 B15R1.871 C=C(F)CNCCCc1ccc(cc1)F 34a_100025745824_100009893438 [0,1,0,0,0,1|2,0,0]=4 10416 B15R1.871 C=C(F)COCCCc1ccc(cc1)Br 34a_100011709247_100009893438 [0,1,0,0,0,1|2,0,0]=4 10417 B15R1.871 C=C(F)COCCCc1ccc(cc1)Br 34a_200010262243_100011713682 [0,1,0,0,0,1|2,0,0]=4 10418 B15R1.871 C=C(F)COCCCc1ccc(cc1)Br 7a_100011709247_100000042424 [0,1,0,0,0,1|2,0,0]=4 10419 B15R1.871 C=C(F)COCCCc1ccc(cc1)C 34a_100000189427_100009893438 [0,1,0,0,0,1|2,0,0]=4 10420 B15R1.871 C=C(F)COCCCc1ccc(cc1)C 7a_100000189427_100000042424 [0,1,0,0,0,1|2,0,0]=4 10421 B15R1.871 C=C(F)COCCCc1ccc(cc1)Cl 34a_100011217485_100009893438 [0,1,0,0,0,1|2,0,0]=4 10422 B15R1.871 C=C(F)COCCCc1ccc(cc1)Cl 34a_200010262243_100000759440 [0,1,0,0,0,1|2,0,0]=4 10423 B15R1.871 C=C(F)COCCCc1ccc(cc1)Cl 7a_100011217485_100000042424 [0,1,0,0,0,1|2,0,0]=4 10424 B15R1.871 C=C(F)COCCCc1ccc(cc1)F 34a_100000757351_100009893438 [0,1,0,0,0,1|2,0,0]=4 10425 B15R1.871 C=C(F)COCCCc1ccc(cc1)F 34a_200010262243_200011713563 [0,1,0,0,0,1|2,0,0]=4 10426 B15R1.871 C=C(F)COCCCc1ccc(cc1)F 7a_100000757351_100000042424 [0,1,0,0,0,1|2,0,0]=4 10427 B15R1.871 C=C(F)CSCCCc1ccc(cc1)Br 62a_100000042424_100011713682 [0,1,0,0,0,1|2,0,0]=4 10428 B15R1.871 C=C(F)CSCCCc1ccc(cc1)Br 62a_100011713682_100000042424 [0,1,0,0,0,1|2,0,0]=4 10429 B15R1.871 C=C(F)CSCCCc1ccc(cc1)Cl 62a_100000042424_100000759440 [0,1,0,0,0,1|2,0,0]=4 10430 B15R1.871 C=C(F)CSCCCc1ccc(cc1)Cl 62a_100000759440_100000042424 [0,1,0,0,0,1|2,0,0]=4 10431 B15R1.871 C=C(F)CSCCCc1ccc(cc1)F 62a_100000042424_200011713563 [0,1,0,0,0,1|2,0,0]=4 10432 B15R1.871 C=C(F)CSCCCc1ccc(cc1)F 62a_200011713563_100000042424 [0,1,0,0,0,1|2,0,0]=4 10433 B15R1.871 CC(=O)CCCCNc1ccc(cc1)Br 34a_100000210018_100009817362 [0,1,0,0,0,1|1,0,0]=3 10434 B15R1.871 CC(=O)CCCCNc1ccc(cc1)C 34a_100000124888_100009817362 [0,1,0,0,0,1|1,0,0]=3 10435 B15R1.871 CC(=O)CCCCNc1ccc(cc1)Cl 34a_100000210052_100009817362 [0,1,0,0,0,1|1,0,0]=3 10436 B15R1.871 CC(=O)CCCCNc1ccc(cc1)F 34a_100000185862_100009817362 [0,1,0,0,0,1|1,0,0]=3 10437 B15R1.871 CC(=O)CCCCNc1ccc(cc1)I 34a_100000185761_100009817362 [0,1,0,0,0,1|1,0,0]=3 10438 B15R1.871 CC(=O)CCCCNc1ccc(cc1)O 34a_100000185829_100009817362 [0,1,0,0,0,1|1,0,0]=3 10439 B15R1.871 CC(=O)CCCCOc1ccc(=O)[nH]c1 34a_100000075641_100009817362 [0,1,0,0,0,1|2,0,0]=4 10440 B15R1.871 CC(=O)CCCCOc1ccc(cc1)Br 1458a_100000070787_100011270094 [0,1,0,0,0,1|1,0,0]=3 10441 B15R1.871 CC(=O)CCCCOc1ccc(cc1)Br 1458a_100000753589_200000210301 [0,1,0,0,0,1|1,0,0]=3 10442 B15R1.871 CC(=O)CCCCOc1ccc(cc1)Br 34a_100000185759_100009817362 [0,1,0,0,0,1|1,0,0]=3 10443 B15R1.871 CC(=O)CCCCOc1ccc(cc1)Br 7a_100000185759_100000735457 [0,1,0,0,0,1|1,0,0]=3 10444 B15R1.871 CC(=O)CCCCOc1ccc(cc1)C 34a_100000210336_100009817362 [0,1,0,0,0,1|1,0,0]=3 10445 B15R1.871 CC(=O)CCCCOc1ccc(cc1)C 7a_100000210336_100000735457 [0,1,0,0,0,1|1,0,0]=3 10446 B15R1.871 CC(=O)CCCCOc1ccc(cc1)Cl 1458a_100000070787_100011270096 [0,1,0,0,0,1|1,0,0]=3 10447 B15R1.871 CC(=O)CCCCOc1ccc(cc1)Cl 34a_100000210216_100009817362 [0,1,0,0,0,1|1,0,0]=3 10448 B15R1.871 CC(=O)CCCCOc1ccc(cc1)Cl 7a_100000210216_100000735457 [0,1,0,0,0,1|1,0,0]=3 10449 B15R1.871 CC(=O)CCCCOc1ccc(cc1)F 1458a_200011217909_200000210301 [0,1,0,0,0,1|1,0,0]=3 10450 B15R1.871 CC(=O)CCCCOc1ccc(cc1)F 34a_100000210339_100009817362 [0,1,0,0,0,1|1,0,0]=3 10451 B15R1.871 CC(=O)CCCCOc1ccc(cc1)I 34a_100000212066_100009817362 [0,1,0,0,0,1|1,0,0]=3 10452 B15R1.871 CC(=O)CCCCOc1ccc(cc1)I 7a_100000212066_100000735457 [0,1,0,0,0,1|1,0,0]=3 10453 B15R1.871 CC(=O)CCCCOc1ccc(cc1)N 34a_100000185829_100009817362 [0,1,0,0,0,1|1,0,0]=3 10454 B15R1.871 CC(=O)CCCCOc1ccc(cn1)C 34a_100000759353_100009817362 [0,1,0,0,0,1|2,0,0]=4 10455 B15R1.871 CC(=O)CCCCOc1ccc(cn1)Cl 34a_100011215309_100009817362 [0,1,0,0,0,1|2,0,0]=4 10456 B15R1.871 CC(=O)CCCCOc1ccc(cn1)F 34a_100000742473_100009817362 [0,1,0,0,0,1|2,0,0]=4 10457 B15R1.871 CC(=O)CCCCOc1ccc(cn1)N 34a_100000729260_100009817362 [0,1,0,0,0,1|2,0,0]=4 10458 B15R1.871 CC(=O)CCCCOc1ccc(nc1)Br 34a_100000685995_100009817362 [0,1,0,0,0,1|2,0,0]=4 10459 B15R1.871 CC(=O)CCCCOc1ccc(nc1)Br 7a_100000685995_100000735457 [0,1,0,0,0,1|2,0,0]=4 10460 B15R1.871 CC(=O)CCCCOc1ccc(nc1)C 34a_100000745506_100009817362 [0,1,0,0,0,1|2,0,0]=4 10461 B15R1.871 CC(=O)CCCCOc1ccc(nc1)C 7a_100000745506_100000735457 [0,1,0,0,0,1|2,0,0]=4 10462 B15R1.871 CC(=O)CCCCOc1ccc(nc1)Cl 34a_100000744096_100009817362 [0,1,0,0,0,1|2,0,0]=4 10463 B15R1.871 CC(=O)CCCCOc1ccc(nc1)Cl 7a_100000744096_100000735457 [0,1,0,0,0,1|2,0,0]=4 10464 B15R1.871 CC(=O)CCCCOc1ccc(nc1)F 34a_100000688820_100009817362 [0,1,0,0,0,1|2,0,0]=4 10465 B15R1.871 CC(=O)CCCCOc1ccc(nc1)F 7a_100000688820_100000735457 [0,1,0,0,0,1|2,0,0]=4 10466 B15R1.871 CC(=O)CCCCOc1ccc(nc1)I 34a_100000687607_100009817362 [0,1,0,0,0,1|2,0,0]=4 10467 B15R1.871 CC(=O)CCCCOc1ccc(nc1)I 7a_100000687607_100000735457 [0,1,0,0,0,1|2,0,0]=4 10468 B15R1.871 CC(=O)CCCCOc1ccc(nc1)N 34a_100015188713_100009817362 [0,1,0,0,0,1|2,0,0]=4 10469 B15R1.871 CC(=O)CCCCOc1ccc(nc1)N 7a_100015188713_100000735457 [0,1,0,0,0,1|2,0,0]=4 10470 B15R1.871 CC(=O)CCCCSc1cc[n+](cc1)[O-] 62a_100000735457_100000039755 [0,1,0,0,0,1|2,0,0]=4 10471 B15R1.871 CC(=O)CCCCSc1ccc(=O)[nH]c1 62a_100000212171_100000735457 [0,1,0,0,0,1|2,0,0]=4 10472 B15R1.871 CC(=O)CCCCSc1ccc(=O)[nH]c1 62a_100000735457_100000212171 [0,1,0,0,0,1|2,0,0]=4 10473 B15R1.871 CC(=O)CCCCSc1ccc(cc1)Br 62a_100000735457_100000752885 [0,1,0,0,0,1|1,0,0]=3 10474 B15R1.871 CC(=O)CCCCSc1ccc(cc1)Br 62a_100000752885_100000735457 [0,1,0,0,0,1|1,0,0]=3 10475 B15R1.871 CC(=O)CCCCSc1ccc(cc1)C 62a_100000186775_100000735457 [0,1,0,0,0,1|1,0,0]=3 10476 B15R1.871 CC(=O)CCCCSc1ccc(cc1)C 62a_100000735457_100000186775 [0,1,0,0,0,1|1,0,0]=3 10477 B15R1.871 CC(=O)CCCCSc1ccc(cc1)Cl 62a_100000735457_100000755918 [0,1,0,0,0,1|1,0,0]=3 10478 B15R1.871 CC(=O)CCCCSc1ccc(cc1)Cl 62a_100000755918_100000735457 [0,1,0,0,0,1|1,0,0]=3 10479 B15R1.871 CC(=O)CCCCSc1ccc(cc1)F 62a_100000211213_100000735457 [0,1,0,0,0,1|1,0,0]=3 10480 B15R1.871 CC(=O)CCCCSc1ccc(cc1)F 62a_100000735457_100000211213 [0,1,0,0,0,1|1,0,0]=3 10481 B15R1.871 CC(=O)CCCCSc1ccc(cc1)N 62a_100000185761_100000735457 [0,1,0,0,0,1|1,0,0]=3 10482 B15R1.871 CC(=O)CCCCSc1ccc(cc1)N 62a_100000735457_100000185761 [0,1,0,0,0,1|1,0,0]=3 10483 B15R1.871 CC(=O)CCCCSc1ccc(cc1)O 62a_100000735457_100000185759 [0,1,0,0,0,1|1,0,0]=3 10484 B15R1.871 CC(=O)CCCCSc1ccc(cn1)Br 62a_100000686858_100000735457 [0,1,0,0,0,1|2,0,0]=4 10485 B15R1.871 CC(=O)CCCCSc1ccc(cn1)Br 62a_100000735457_100000686858 [0,1,0,0,0,1|2,0,0]=4 10486 B15R1.871 CC(=O)CCCCSc1ccc(cn1)C 62a_100000735457_100000754016 [0,1,0,0,0,1|2,0,0]=4 10487 B15R1.871 CC(=O)CCCCSc1ccc(cn1)C 62a_100011192072_100000735457 [0,1,0,0,0,1|2,0,0]=4 10488 B15R1.871 CC(=O)CCCCSc1ccc(cn1)Cl 62a_100000735457_100011356976 [0,1,0,0,0,1|2,0,0]=4 10489 B15R1.871 CC(=O)CCCCSc1ccc(cn1)Cl 62a_100011356976_100000735457 [0,1,0,0,0,1|2,0,0]=4 10490 B15R1.871 CC(=O)CCCCSc1ccc(cn1)F 62a_100000735457_100000744514 [0,1,0,0,0,1|2,0,0]=4 10491 B15R1.871 CC(=O)CCCCSc1ccc(cn1)F 62a_100000744514_100000735457 [0,1,0,0,0,1|2,0,0]=4 10492 B15R1.871 CC(=O)CCCCSc1ccc(cn1)N 62a_100000735457_100000737798 [0,1,0,0,0,1|2,0,0]=4 10493 B15R1.871 CC(=O)CCCCSc1ccc(cn1)N 62a_100000737798_100000735457 [0,1,0,0,0,1|2,0,0]=4 10494 B15R1.871 CC(=O)CCCCSc1ccc(cn1)O 62a_100000685995_100000735457 [0,1,0,0,0,1|2,0,0]=4 10495 B15R1.871 CC(=O)CCCCSc1ccc(cn1)O 62a_100000735457_100000744096 [0,1,0,0,0,1|2,0,0]=4 10496 B15R1.871 CC(=O)CCCCSc1ccc(nc1)Br 62a_100000735457_100009814638 [0,1,0,0,0,1|2,0,0]=4 10497 B15R1.871 CC(=O)CCCCSc1ccc(nc1)Br 62a_100009814638_100000735457 [0,1,0,0,0,1|2,0,0]=4 10498 B15R1.871 CC(=O)CCCCSc1ccc(nc1)C 62a_100000735457_100000751577 [0,1,0,0,0,1|2,0,0]=4 10499 B15R1.871 CC(=O)CCCCSc1ccc(nc1)C 62a_100000751577_100000735457 [0,1,0,0,0,1|2,0,0]=4 10500 B15R1.871 CC(=O)CCCCSc1ccc(nc1)Cl 62a_100000034144_100000735457 [0,1,0,0,0,1|2,0,0]=4 10501 B15R1.871 CC(=O)CCCCSc1ccc(nc1)Cl 62a_100000735457_100000034144 [0,1,0,0,0,1|2,0,0]=4 10502 B15R1.871 CC(=O)CCCCSc1ccc(nc1)F 62a_100000042367_100000735457 [0,1,0,0,0,1|2,0,0]=4 10503 B15R1.871 CC(=O)CCCCSc1ccc(nc1)F 62a_100000735457_100000042367 [0,1,0,0,0,1|2,0,0]=4 10504 B15R1.871 CC(=O)CCCCSc1ccc(nc1)N 62a_100000187370_100000735457 [0,1,0,0,0,1|2,0,0]=4 10505 B15R1.871 CC(=O)CCCCSc1ccc(nc1)N 62a_100000735457_100000187370 [0,1,0,0,0,1|2,0,0]=4 10506 B15R1.871 CC(=O)CCCNCc1ccc(cc1)Br 34a_100000174875_100000685027 [0,1,0,0,0,1|1,0,0]=3 10507 B15R1.871 CC(=O)CCCNCc1ccc(cc1)C 34a_100000174908_100000685027 [0,1,0,0,0,1|1,0,0]=3 10508 B15R1.871 CC(=O)CCCNCc1ccc(cc1)Cl 34a_100000174871_100000685027 [0,1,0,0,0,1|1,0,0]=3 10509 B15R1.871 CC(=O)CCCNCc1ccc(cc1)F 34a_100000174882_100000685027 [0,1,0,0,0,1|1,0,0]=3 10510 B15R1.871 CC(=O)CCCNCc1ccc(cc1)I 34a_100016989417_100000685027 [0,1,0,0,0,1|1,0,0]=3 10511 B15R1.871 CC(=O)CCCNCc1ccc(cc1)O 34a_100000185549_100000685027 [0,1,0,0,0,1|1,0,0]=3 10512 B15R1.871 CC(=O)CCCNCc1ccc(cn1)Br 34a_100015188789_100000685027 [0,1,0,0,0,1|2,0,0]=4 10513 B15R1.871 CC(=O)CCCNCc1ccc(cn1)C 34a_100015187455_100000685027 [0,1,0,0,0,1|2,0,0]=4 10514 B15R1.871 CC(=O)CCCNCc1ccc(cn1)Cl 34a_100000697193_100000685027 [0,1,0,0,0,1|2,0,0]=4 10515 B15R1.871 CC(=O)CCCNCc1ccc(cn1)F 34a_100020620131_100000685027 [0,1,0,0,0,1|2,0,0]=4 10516 B15R1.871 CC(=O)CCCNCc1ccc(nc1)Br 34a_100009817727_100000685027 [0,1,0,0,0,1|2,0,0]=4 10517 B15R1.871 CC(=O)CCCNCc1ccc(nc1)C 34a_100000740942_100000685027 [0,1,0,0,0,1|2,0,0]=4 10518 B15R1.871 CC(=O)CCCNCc1ccc(nc1)Cl 34a_100000735879_100000685027 [0,1,0,0,0,1|2,0,0]=4 10519 B15R1.871 CC(=O)CCCNCc1ccc(nc1)F 34a_100000101913_100000685027 [0,1,0,0,0,1|2,0,0]=4 10520 B15R1.871 CC(=O)CCCOCc1cc[n+](cc1)C 34a_100009831711_100000685027 [0,1,0,0,0,1|2,0,0]=4 10521 B15R1.871 CC(=O)CCCOCc1cc[n+](cc1)[O-] 34a_100000031831_100000685027 [0,1,0,0,0,1|2,0,0]=4 10522 B15R1.871 CC(=O)CCCOCc1cc[n+](cc1)[O-] 7a_100000031831_100011215641 [0,1,0,0,0,1|2,0,0]=4 10523 B15R1.871 CC(=O)CCCOCc1ccc(=O)[nH]c1 34a_100011999846_100000685027 [0,1,0,0,0,1|2,0,0]=4 10524 B15R1.871 CC(=O)CCCOCc1ccc(cc1)Br 34a_100000695286_100000685027 [0,1,0,0,0,1|1,0,0]=3 10525 B15R1.871 CC(=O)CCCOCc1ccc(cc1)Br 34a_100000759063_100000189115 [0,1,0,0,0,1|1,0,0]=3 10526 B15R1.871 CC(=O)CCCOCc1ccc(cc1)Br 7a_100000759063_100011217064 [0,1,0,0,0,1|1,0,0]=3 10527 B15R1.871 CC(=O)CCCOCc1ccc(cc1)C 34a_100000759063_100000210814 [0,1,0,0,0,1|1,0,0]=3 10528 B15R1.871 CC(=O)CCCOCc1ccc(cc1)C 34a_100011215236_100000685027 [0,1,0,0,0,1|1,0,0]=3 10529 B15R1.871 CC(=O)CCCOCc1ccc(cc1)C 7a_100000759063_100000210814 [0,1,0,0,0,1|1,0,0]=3 10530 B15R1.871 CC(=O)CCCOCc1ccc(cc1)C 7a_100011215236_100011215641 [0,1,0,0,0,1|1,0,0]=3 10531 B15R1.871 CC(=O)CCCOCc1ccc(cc1)Cl 34a_100000211118_100000685027 [0,1,0,0,0,1|1,0,0]=3 10532 B15R1.871 CC(=O)CCCOCc1ccc(cc1)Cl 34a_100000759063_100000694040 [0,1,0,0,0,1|1,0,0]=3 10533 B15R1.871 CC(=O)CCCOCc1ccc(cc1)Cl 7a_100000211118_100011215641 [0,1,0,0,0,1|1,0,0]=3 10534 B15R1.871 CC(=O)CCCOCc1ccc(cc1)Cl 7a_100000759063_100000187161 [0,1,0,0,0,1|1,0,0]=3 10535 B15R1.871 CC(=O)CCCOCc1ccc(cc1)F 34a_100000210977_100000685027 [0,1,0,0,0,1|1,0,0]=3 10536 B15R1.871 CC(=O)CCCOCc1ccc(cc1)F 34a_100000759063_100000198546 [0,1,0,0,0,1|1,0,0]=3 10537 B15R1.871 CC(=O)CCCOCc1ccc(cc1)F 7a_100000210977_100011215641 [0,1,0,0,0,1|1,0,0]=3 10538 B15R1.871 CC(=O)CCCOCc1ccc(cc1)F 7a_100000759063_100000198546 [0,1,0,0,0,1|1,0,0]=3 10539 B15R1.871 CC(=O)CCCOCc1ccc(cc1)I 34a_100000690907_100000685027 [0,1,0,0,0,1|1,0,0]=3 10540 B15R1.871 CC(=O)CCCOCc1ccc(cc1)I 34a_100000759063_100000189116 [0,1,0,0,0,1|1,0,0]=3 10541 B15R1.871 CC(=O)CCCOCc1ccc(cc1)I 7a_100000690907_100011215641 [0,1,0,0,0,1|1,0,0]=3 10542 B15R1.871 CC(=O)CCCOCc1ccc(cc1)I 7a_100000759063_100000189116 [0,1,0,0,0,1|1,0,0]=3 10543 B15R1.871 CC(=O)CCCOCc1ccc(cc1)N 34a_100011215238_100000685027 [0,1,0,0,0,1|1,0,0]=3 10544 B15R1.871 CC(=O)CCCOCc1ccc(cn1)Br 34a_100000754261_100000685027 [0,1,0,0,0,1|2,0,0]=4 10545 B15R1.871 CC(=O)CCCOCc1ccc(cn1)Br 34a_100000759063_100000702658 [0,1,0,0,0,1|2,0,0]=4 10546 B15R1.871 CC(=O)CCCOCc1ccc(cn1)Br 7a_100000759063_100000702658 [0,1,0,0,0,1|2,0,0]=4 10547 B15R1.871 CC(=O)CCCOCc1ccc(cn1)C 34a_100000759063_100000691093 [0,1,0,0,0,1|2,0,0]=4 10548 B15R1.871 CC(=O)CCCOCc1ccc(cn1)C 34a_100012001401_100000685027 [0,1,0,0,0,1|2,0,0]=4 10549 B15R1.871 CC(=O)CCCOCc1ccc(cn1)C 7a_100000759063_100000691093 [0,1,0,0,0,1|2,0,0]=4 10550 B15R1.871 CC(=O)CCCOCc1ccc(cn1)Cl 34a_100000703999_100000685027 [0,1,0,0,0,1|2,0,0]=4 10551 B15R1.871 CC(=O)CCCOCc1ccc(cn1)Cl 34a_100000759063_100012066911 [0,1,0,0,0,1|2,0,0]=4 10552 B15R1.871 CC(=O)CCCOCc1ccc(cn1)Cl 7a_100000759063_100012066911 [0,1,0,0,0,1|2,0,0]=4 10553 B15R1.871 CC(=O)CCCOCc1ccc(cn1)F 34a_100000759063_100000703193 [0,1,0,0,0,1|2,0,0]=4 10554 B15R1.871 CC(=O)CCCOCc1ccc(cn1)F 34a_100011999454_100000685027 [0,1,0,0,0,1|2,0,0]=4 10555 B15R1.871 CC(=O)CCCOCc1ccc(cn1)F 7a_100000759063_100000703193 [0,1,0,0,0,1|2,0,0]=4 10556 B15R1.871 CC(=O)CCCOCc1ccc(cn1)N 34a_100011998161_100000685027 [0,1,0,0,0,1|2,0,0]=4 10557 B15R1.871 CC(=O)CCCOCc1ccc(nc1)Br 34a_100000759063_100009831999 [0,1,0,0,0,1|2,0,0]=4 10558 B15R1.871 CC(=O)CCCOCc1ccc(nc1)Br 34a_100009816760_100000685027 [0,1,0,0,0,1|2,0,0]=4 10559 B15R1.871 CC(=O)CCCOCc1ccc(nc1)Br 7a_100000759063_100009831999 [0,1,0,0,0,1|2,0,0]=4 10560 B15R1.871 CC(=O)CCCOCc1ccc(nc1)Br 7a_100009816760_100011215641 [0,1,0,0,0,1|2,0,0]=4 10561 B15R1.871 CC(=O)CCCOCc1ccc(nc1)C 34a_100000759063_100016987292 [0,1,0,0,0,1|2,0,0]=4 10562 B15R1.871 CC(=O)CCCOCc1ccc(nc1)C 34a_100011248133_100000685027 [0,1,0,0,0,1|2,0,0]=4 10563 B15R1.871 CC(=O)CCCOCc1ccc(nc1)C 7a_100000759063_100016987292 [0,1,0,0,0,1|2,0,0]=4 10564 B15R1.871 CC(=O)CCCOCc1ccc(nc1)Cl 34a_100000755211_100000685027 [0,1,0,0,0,1|2,0,0]=4 10565 B15R1.871 CC(=O)CCCOCc1ccc(nc1)Cl 34a_100000759063_100000735431 [0,1,0,0,0,1|2,0,0]=4 10566 B15R1.871 CC(=O)CCCOCc1ccc(nc1)Cl 7a_100000755211_100011215641 [0,1,0,0,0,1|2,0,0]=4 10567 B15R1.871 CC(=O)CCCOCc1ccc(nc1)Cl 7a_100000759063_100000735431 [0,1,0,0,0,1|2,0,0]=4 10568 B15R1.871 CC(=O)CCCOCc1ccc(nc1)F 34a_100000079959_100000685027 [0,1,0,0,0,1|2,0,0]=4 10569 B15R1.871 CC(=O)CCCOCc1ccc(nc1)F 34a_100000759063_100000099788 [0,1,0,0,0,1|2,0,0]=4 10570 B15R1.871 CC(=O)CCCOCc1ccc(nc1)F 7a_100000759063_100009820150 [0,1,0,0,0,1|2,0,0]=4 10571 B15R1.871 CC(=O)CCCOCc1ccc(nc1)N 34a_100000704267_100000685027 [0,1,0,0,0,1|2,0,0]=4 10572 B15R1.871 CC(=O)CCCSCc1ccc(cc1)Br 62a_100000189115_100011215641 [0,1,0,0,0,1|1,0,0]=3 10573 B15R1.871 CC(=O)CCCSCc1ccc(cc1)Br 62a_100011215641_100000189115 [0,1,0,0,0,1|1,0,0]=3 10574 B15R1.871 CC(=O)CCCSCc1ccc(cc1)C 62a_100000210814_100011215641 [0,1,0,0,0,1|1,0,0]=3 10575 B15R1.871 CC(=O)CCCSCc1ccc(cc1)C 62a_100011215641_100000210814 [0,1,0,0,0,1|1,0,0]=3 10576 B15R1.871 CC(=O)CCCSCc1ccc(cc1)Cl 62a_100000187161_100011215641 [0,1,0,0,0,1|1,0,0]=3 10577 B15R1.871 CC(=O)CCCSCc1ccc(cc1)Cl 62a_100011215641_100000187161 [0,1,0,0,0,1|1,0,0]=3 10578 B15R1.871 CC(=O)CCCSCc1ccc(cc1)F 62a_100000198546_100011215641 [0,1,0,0,0,1|1,0,0]=3 10579 B15R1.871 CC(=O)CCCSCc1ccc(cc1)F 62a_100011215641_100000187164 [0,1,0,0,0,1|1,0,0]=3 10580 B15R1.871 CC(=O)CCCSCc1ccc(cc1)I 62a_100000189116_100011215641 [0,1,0,0,0,1|1,0,0]=3 10581 B15R1.871 CC(=O)CCCSCc1ccc(cc1)I 62a_100011215641_100000189116 [0,1,0,0,0,1|1,0,0]=3 10582 B15R1.871 CC(=O)CCCSCc1ccc(cn1)Br 62a_100000702658_100011215641 [0,1,0,0,0,1|2,0,0]=4 10583 B15R1.871 CC(=O)CCCSCc1ccc(cn1)Br 62a_100011215641_100000702658 [0,1,0,0,0,1|2,0,0]=4 10584 B15R1.871 CC(=O)CCCSCc1ccc(cn1)C 62a_100000691093_100011215641 [0,1,0,0,0,1|2,0,0]=4 10585 B15R1.871 CC(=O)CCCSCc1ccc(cn1)C 62a_100011215641_100000691093 [0,1,0,0,0,1|2,0,0]=4 10586 B15R1.871 CC(=O)CCCSCc1ccc(cn1)Cl 62a_100011215641_100000697101 [0,1,0,0,0,1|2,0,0]=4 10587 B15R1.871 CC(=O)CCCSCc1ccc(cn1)Cl 62a_100012066911_100011215641 [0,1,0,0,0,1|2,0,0]=4 10588 B15R1.871 CC(=O)CCCSCc1ccc(cn1)F 62a_100000703193_100011215641 [0,1,0,0,0,1|2,0,0]=4 10589 B15R1.871 CC(=O)CCCSCc1ccc(cn1)F 62a_100011215641_100000703193 [0,1,0,0,0,1|2,0,0]=4 10590 B15R1.871 CC(=O)CCCSCc1ccc(nc1)Br 62a_100009831999_100011215641 [0,1,0,0,0,1|2,0,0]=4 10591 B15R1.871 CC(=O)CCCSCc1ccc(nc1)Br 62a_100011215641_100009831999 [0,1,0,0,0,1|2,0,0]=4 10592 B15R1.871 CC(=O)CCCSCc1ccc(nc1)C 62a_100011215641_100016987292 [0,1,0,0,0,1|2,0,0]=4 10593 B15R1.871 CC(=O)CCCSCc1ccc(nc1)C 62a_100016987292_100011215641 [0,1,0,0,0,1|2,0,0]=4 10594 B15R1.871 CC(=O)CCCSCc1ccc(nc1)Cl 62a_100000735431_100011215641 [0,1,0,0,0,1|2,0,0]=4 10595 B15R1.871 CC(=O)CCCSCc1ccc(nc1)Cl 62a_100011215641_100000735431 [0,1,0,0,0,1|2,0,0]=4 10596 B15R1.871 CC(=O)CCCSCc1ccc(nc1)F 62a_100009820150_100011215641 [0,1,0,0,0,1|2,0,0]=4 10597 B15R1.871 CC(=O)CCCSCc1ccc(nc1)F 62a_100011215641_100000099788 [0,1,0,0,0,1|2,0,0]=4 10598 B15R1.871 CC(=O)CCOCCc1ccc(cc1)Br 34a_100000759926_100011740612 [0,1,0,0,0,1|1,0,0]=3 10599 B15R1.871 CC(=O)CCOCCc1ccc(cc1)Br 7a_100000759926_100011740612 [0,1,0,0,0,1|1,0,0]=3 10600 B15R1.871 CC(=O)CCOCCc1ccc(cc1)Br 7a_100000766406_100000053229 [0,1,0,0,0,1|1,0,0]=3 10601 B15R1.871 CC(=O)CCOCCc1ccc(cc1)C 34a_100000759926_100011713686 [0,1,0,0,0,1|1,0,0]=3 10602 B15R1.871 CC(=O)CCOCCc1ccc(cc1)C 7a_100000756670_100000053229 [0,1,0,0,0,1|1,0,0]=3 10603 B15R1.871 CC(=O)CCOCCc1ccc(cc1)C 7a_100000759926_100011713686 [0,1,0,0,0,1|1,0,0]=3 10604 B15R1.871 CC(=O)CCOCCc1ccc(cc1)Cl 34a_100000759926_100011713675 [0,1,0,0,0,1|1,0,0]=3 10605 B15R1.871 CC(=O)CCOCCc1ccc(cc1)Cl 7a_100000759926_100011713675 [0,1,0,0,0,1|1,0,0]=3 10606 B15R1.871 CC(=O)CCOCCc1ccc(cc1)Cl 7a_100011219627_100000053229 [0,1,0,0,0,1|1,0,0]=3 10607 B15R1.871 CC(=O)CCOCCc1ccc(cc1)F 34a_100000759926_100011217392 [0,1,0,0,0,1|1,0,0]=3 10608 B15R1.871 CC(=O)CCOCCc1ccc(cc1)F 7a_100000754732_100000053229 [0,1,0,0,0,1|1,0,0]=3 10609 B15R1.871 CC(=O)CCOCCc1ccc(cc1)F 7a_100000759926_100011217392 [0,1,0,0,0,1|1,0,0]=3 10610 B15R1.871 CC(=O)CCOCCc1ccc(cc1)I 7a_100012291149_100000053229 [0,1,0,0,0,1|1,0,0]=3 10611 B15R1.871 CC(=O)CCOCCc1ccc(cc1)O 7a_100000759926_100009816426 [0,1,0,0,0,1|1,0,0]=3 10612 B15R1.871 CC(=O)CCOCCc1ccc(nc1)Cl 7a_100009880866_100000053229 [0,1,0,0,0,1|2,0,0]=4 10613 B15R1.871 CC(=O)CCSCCc1ccc(cc1)Br 62a_100000053229_100011740612 [0,1,0,0,0,1|1,0,0]=3 10614 B15R1.871 CC(=O)CCSCCc1ccc(cc1)Br 62a_100011740612_100000053229 [0,1,0,0,0,1|1,0,0]=3 10615 B15R1.871 CC(=O)CCSCCc1ccc(cc1)C 62a_100000053229_100011713686 [0,1,0,0,0,1|1,0,0]=3 10616 B15R1.871 CC(=O)CCSCCc1ccc(cc1)C 62a_100011713686_100000053229 [0,1,0,0,0,1|1,0,0]=3 10617 B15R1.871 CC(=O)CCSCCc1ccc(cc1)Cl 62a_100000053229_100011713675 [0,1,0,0,0,1|1,0,0]=3 10618 B15R1.871 CC(=O)CCSCCc1ccc(cc1)Cl 62a_100011713675_100000053229 [0,1,0,0,0,1|1,0,0]=3 10619 B15R1.871 CC(=O)CCSCCc1ccc(cc1)F 62a_100000053229_100011217392 [0,1,0,0,0,1|1,0,0]=3 10620 B15R1.871 CC(=O)CCSCCc1ccc(cc1)F 62a_100011217392_100000053229 [0,1,0,0,0,1|1,0,0]=3 10621 B15R1.871 CC(=O)CCSCCc1ccc(cc1)O 62a_100000053229_100009816426 [0,1,0,0,0,1|1,0,0]=3 10622 B15R1.871 CC(=O)CCSCCc1ccc(cc1)O 62a_100009816426_100000053229 [0,1,0,0,0,1|1,0,0]=3 10623 B15R1.871 CC(=O)COCCCc1ccc(cc1)Br 34a_100000211253_100011713682 [0,1,0,0,0,1|1,0,0]=3 10624 B15R1.871 CC(=O)COCCCc1ccc(cc1)Cl 34a_100000211253_100000759440 [0,1,0,0,0,1|1,0,0]=3 10625 B15R1.871 CC(=O)COCCCc1ccc(cc1)F 34a_100000211253_200011713563 [0,1,0,0,0,1|1,0,0]=3 10626 B15R1.871 CC(=O)COCCOc1ccc(cc1)Br 34a_100000211253_100000183278 [0,1,0,0,0,1|2,0,0]=4 10627 B15R1.871 CC(=O)COCCOc1ccc(cc1)C 34a_100000211253_100000183172 [0,1,0,0,0,1|2,0,0]=4 10628 B15R1.871 CC(=O)COCCOc1ccc(cc1)Cl 34a_100000211253_100000184122 [0,1,0,0,0,1|2,0,0]=4 10629 B15R1.871 CC(=O)COCCOc1ccc(cc1)F 34a_100000211253_100000184936 [0,1,0,0,0,1|2,0,0]=4 10630 B15R1.871 CC(=O)NCCCCc1ccc(cc1)Cl 11a_100160821348_100015343762 [0,1,0,0,0,1|1,0,0]=3 10631 B15R1.871 CC(=O)NCCCCc1ccc(cc1)Cl 1626a_100160821348_100015343762 [0,1,0,0,0,1|1,0,0]=3 10632 B15R1.871 CC(=O)NCCCCc1ccc(cc1)Cl 240690a_100160821348_100015343762 [0,1,0,0,0,1|1,0,0]=3 10633 B15R1.871 CC(=O)NCCCCc1ccc(cc1)Cl 527a_100160821348_100103153847 [0,1,0,0,0,1|1,0,0]=3 10634 B15R1.871 CC(=O)NCCCOc1ccc(cc1)C 11a_100000747266_100015343762 [0,1,0,0,0,1|2,0,0]=4 10635 B15R1.871 CC(=O)NCCCOc1ccc(cc1)C 1626a_100000747266_100015343762 [0,1,0,0,0,1|2,0,0]=4 10636 B15R1.871 CC(=O)NCCCOc1ccc(cc1)C 240690a_100000747266_100015343762 [0,1,0,0,0,1|2,0,0]=4 10637 B15R1.871 CC(=O)NCCCOc1ccc(cc1)C 527a_100000747266_100103153847 [0,1,0,0,0,1|2,0,0]=4 10638 B15R1.871 CC(=O)NCCCOc1ccc(cc1)Cl 11a_200011199081_100015343762 [0,1,0,0,0,1|2,0,0]=4 10639 B15R1.871 CC(=O)NCCCOc1ccc(cc1)Cl 1626a_200011199081_100015343762 [0,1,0,0,0,1|2,0,0]=4 10640 B15R1.871 CC(=O)NCCCOc1ccc(cc1)Cl 240690a_200011199081_100015343762 [0,1,0,0,0,1|2,0,0]=4 10641 B15R1.871 CC(=O)NCCCOc1ccc(cc1)Cl 527a_200011199081_100103153847 [0,1,0,0,0,1|2,0,0]=4 10642 B15R1.871 CC(=O)NCCCOc1ccc(cc1)F 11a_100000747263_100015343762 [0,1,0,0,0,1|2,0,0]=4 10643 B15R1.871 CC(=O)NCCCOc1ccc(cc1)F 1626a_100000747263_100015343762 [0,1,0,0,0,1|2,0,0]=4 10644 B15R1.871 CC(=O)NCCCOc1ccc(cc1)F 240690a_100000747263_100015343762 [0,1,0,0,0,1|2,0,0]=4 10645 B15R1.871 CC(=O)NCCCOc1ccc(cc1)F 527a_100000747263_100103153847 [0,1,0,0,0,1|2,0,0]=4 10646 B15R1.871 CC(=O)NCCCSc1ccc(cc1)Cl 11a_100000189518_100015343762 [0,1,0,0,0,1|2,0,0]=4 10647 B15R1.871 CC(=O)NCCCSc1ccc(cc1)Cl 240690a_100000189518_100015343762 [0,1,0,0,0,1|2,0,0]=4 10648 B15R1.871 CC(=O)NCCCSc1ccc(cc1)Cl 527a_100000189518_100103153847 [0,1,0,0,0,1|2,0,0]=4 10649 B15R1.871 CC(=O)NCCCSc1ccc(cc1)F 11a_100000683907_100015343762 [0,1,0,0,0,1|2,0,0]=4 10650 B15R1.871 CC(=O)NCCCSc1ccc(cc1)F 240690a_100000683907_100015343762 [0,1,0,0,0,1|2,0,0]=4 10651 B15R1.871 CC(=O)NCCCSc1ccc(cc1)F 527a_100000683907_100103153847 [0,1,0,0,0,1|2,0,0]=4 10652 B15R1.871 CC(=O)NCCNCc1ccc(cc1)Br 207a_100000209853_100000186029 [0,1,0,0,0,1|2,0,0]=4 10653 B15R1.871 CC(=O)NCCNCc1ccc(cc1)Br 2230a_100000174875_100000189650 [0,1,0,0,0,1|2,0,0]=4 10654 B15R1.871 CC(=O)NCCNCc1ccc(cc1)Br 2230a_100000209853_100011217064 [0,1,0,0,0,1|2,0,0]=4 10655 B15R1.871 CC(=O)NCCNCc1ccc(cc1)C 207a_100000209853_100000211033 [0,1,0,0,0,1|2,0,0]=4 10656 B15R1.871 CC(=O)NCCNCc1ccc(cc1)C 2230a_100000174908_100000189650 [0,1,0,0,0,1|2,0,0]=4 10657 B15R1.871 CC(=O)NCCNCc1ccc(cc1)C 2230a_100000209853_100000210814 [0,1,0,0,0,1|2,0,0]=4 10658 B15R1.871 CC(=O)NCCNCc1ccc(cc1)Cl 207a_100000209853_100000189385 [0,1,0,0,0,1|2,0,0]=4 10659 B15R1.871 CC(=O)NCCNCc1ccc(cc1)Cl 2230a_100000174871_100000189650 [0,1,0,0,0,1|2,0,0]=4 10660 B15R1.871 CC(=O)NCCNCc1ccc(cc1)Cl 2230a_100000209853_100000694040 [0,1,0,0,0,1|2,0,0]=4 10661 B15R1.871 CC(=O)NCCNCc1ccc(cc1)F 207a_100000209853_100000210084 [0,1,0,0,0,1|2,0,0]=4 10662 B15R1.871 CC(=O)NCCNCc1ccc(cc1)F 2230a_100000174882_100000189650 [0,1,0,0,0,1|2,0,0]=4 10663 B15R1.871 CC(=O)NCCNCc1ccc(cc1)F 2230a_100000209853_100000198546 [0,1,0,0,0,1|2,0,0]=4 10664 B15R1.871 CC(=O)NCCNCc1ccc(cc1)I 207a_100000209853_100000188517 [0,1,0,0,0,1|2,0,0]=4 10665 B15R1.871 CC(=O)NCCNCc1ccc(cc1)I 2230a_100000209853_100000189116 [0,1,0,0,0,1|2,0,0]=4 10666 B15R1.871 CC(=O)NCCNCc1ccc(cc1)I 2230a_100016989417_100000189650 [0,1,0,0,0,1|2,0,0]=4 10667 B15R1.871 CC(=O)NCCOCc1ccc(cc1)Br 34a_100000158858_100000189115 [0,1,0,0,0,1|2,0,0]=4 10668 B15R1.871 CC(=O)NCCOCc1ccc(cc1)C 34a_100000158858_100000210814 [0,1,0,0,0,1|2,0,0]=4 10669 B15R1.871 CC(=O)NCCOCc1ccc(cc1)C 7a_100011215236_100000189650 [0,1,0,0,0,1|2,0,0]=4 10670 B15R1.871 CC(=O)NCCOCc1ccc(cc1)Cl 11a_100000189180_100015343762 [0,1,0,0,0,1|2,0,0]=4 10671 B15R1.871 CC(=O)NCCOCc1ccc(cc1)Cl 1626a_100000189180_100015343762 [0,1,0,0,0,1|2,0,0]=4 10672 B15R1.871 CC(=O)NCCOCc1ccc(cc1)Cl 240690a_100000189180_100015343762 [0,1,0,0,0,1|2,0,0]=4 10673 B15R1.871 CC(=O)NCCOCc1ccc(cc1)Cl 34a_100000158858_100000694040 [0,1,0,0,0,1|2,0,0]=4 10674 B15R1.871 CC(=O)NCCOCc1ccc(cc1)Cl 527a_100000189180_100103153847 [0,1,0,0,0,1|2,0,0]=4 10675 B15R1.871 CC(=O)NCCOCc1ccc(cc1)Cl 7a_100000211118_100000189650 [0,1,0,0,0,1|2,0,0]=4 10676 B15R1.871 CC(=O)NCCOCc1ccc(cc1)F 34a_100000158858_100000198546 [0,1,0,0,0,1|2,0,0]=4 10677 B15R1.871 CC(=O)NCCOCc1ccc(cc1)F 7a_100000210977_100000189650 [0,1,0,0,0,1|2,0,0]=4 10678 B15R1.871 CC(=O)NCCOCc1ccc(cc1)I 34a_100000158858_100000189116 [0,1,0,0,0,1|2,0,0]=4 10679 B15R1.871 CC(=O)NCCOCc1ccc(cc1)I 7a_100000690907_100000189650 [0,1,0,0,0,1|2,0,0]=4 10680 B15R1.871 CC(=O)NCCSCc1ccc(cc1)Br 62a_100000189115_100000189650 [0,1,0,0,0,1|2,0,0]=4 10681 B15R1.871 CC(=O)NCCSCc1ccc(cc1)Br 62a_100000189650_100000189115 [0,1,0,0,0,1|2,0,0]=4 10682 B15R1.871 CC(=O)NCCSCc1ccc(cc1)C 62a_100000189650_100000210814 [0,1,0,0,0,1|2,0,0]=4 10683 B15R1.871 CC(=O)NCCSCc1ccc(cc1)C 62a_100000210814_100000189650 [0,1,0,0,0,1|2,0,0]=4 10684 B15R1.871 CC(=O)NCCSCc1ccc(cc1)Cl 11a_100000739548_100015343762 [0,1,0,0,0,1|2,0,0]=4 10685 B15R1.871 CC(=O)NCCSCc1ccc(cc1)Cl 240690a_100000739548_100015343762 [0,1,0,0,0,1|2,0,0]=4 10686 B15R1.871 CC(=O)NCCSCc1ccc(cc1)Cl 527a_100000739548_100103153847 [0,1,0,0,0,1|2,0,0]=4 10687 B15R1.871 CC(=O)NCCSCc1ccc(cc1)Cl 62a_100000187161_100000189650 [0,1,0,0,0,1|2,0,0]=4 10688 B15R1.871 CC(=O)NCCSCc1ccc(cc1)Cl 62a_100000189650_100000187161 [0,1,0,0,0,1|2,0,0]=4 10689 B15R1.871 CC(=O)NCCSCc1ccc(cc1)F 11a_100020610864_100015343762 [0,1,0,0,0,1|2,0,0]=4 10690 B15R1.871 CC(=O)NCCSCc1ccc(cc1)F 240690a_100020610864_100015343762 [0,1,0,0,0,1|2,0,0]=4 10691 B15R1.871 CC(=O)NCCSCc1ccc(cc1)F 527a_100020610864_100103153847 [0,1,0,0,0,1|2,0,0]=4 10692 B15R1.871 CC(=O)NCCSCc1ccc(cc1)F 62a_100000189650_100000187164 [0,1,0,0,0,1|2,0,0]=4 10693 B15R1.871 CC(=O)NCCSCc1ccc(cc1)F 62a_100000198546_100000189650 [0,1,0,0,0,1|2,0,0]=4 10694 B15R1.871 CC(=O)NCCSCc1ccc(cc1)I 62a_100000189116_100000189650 [0,1,0,0,0,1|2,0,0]=4 10695 B15R1.871 CC(=O)NCCSCc1ccc(cc1)I 62a_100000189650_100000189116 [0,1,0,0,0,1|2,0,0]=4 10696 B15R1.871 CC(=O)OCCCNc1ccc(cc1)Br 34a_100000210018_100000042594 [0,1,0,0,0,1|2,0,0]=4 10697 B15R1.871 CC(=O)OCCCNc1ccc(cc1)C 34a_100000124888_100000042594 [0,1,0,0,0,1|2,0,0]=4 10698 B15R1.871 CC(=O)OCCCNc1ccc(cc1)Cl 34a_100000210052_100000042594 [0,1,0,0,0,1|2,0,0]=4 10699 B15R1.871 CC(=O)OCCCNc1ccc(cc1)F 34a_100000185862_100000042594 [0,1,0,0,0,1|2,0,0]=4 10700 B15R1.871 CC(=O)OCCCNc1ccc(cc1)I 34a_100000185761_100000042594 [0,1,0,0,0,1|2,0,0]=4 10701 B15R1.871 CC(=O)OCCCNc1ccc(cc1)O 34a_100000185829_100000042594 [0,1,0,0,0,1|2,0,0]=4 10702 B15R1.871 CC(=O)OCCCOc1ccc(cc1)Br 34a_100000185759_100000042594 [0,1,0,0,0,1|2,0,0]=4 10703 B15R1.871 CC(=O)OCCCOc1ccc(cc1)Br 7a_100000185759_100000042594 [0,1,0,0,0,1|2,0,0]=4 10704 B15R1.871 CC(=O)OCCCOc1ccc(cc1)C 34a_100000210336_100000042594 [0,1,0,0,0,1|2,0,0]=4 10705 B15R1.871 CC(=O)OCCCOc1ccc(cc1)C 7a_100000210336_100000042594 [0,1,0,0,0,1|2,0,0]=4 10706 B15R1.871 CC(=O)OCCCOc1ccc(cc1)Cl 34a_100000210216_100000042594 [0,1,0,0,0,1|2,0,0]=4 10707 B15R1.871 CC(=O)OCCCOc1ccc(cc1)Cl 7a_100000210216_100000042594 [0,1,0,0,0,1|2,0,0]=4 10708 B15R1.871 CC(=O)OCCCOc1ccc(cc1)F 34a_100000210339_100000042594 [0,1,0,0,0,1|2,0,0]=4 10709 B15R1.871 CC(=O)OCCCOc1ccc(cc1)I 34a_100000212066_100000042594 [0,1,0,0,0,1|2,0,0]=4 10710 B15R1.871 CC(=O)OCCCOc1ccc(cc1)I 7a_100000212066_100000042594 [0,1,0,0,0,1|2,0,0]=4 10711 B15R1.871 CC(=O)OCCCOc1ccc(cc1)N 34a_100000185829_100000042594 [0,1,0,0,0,1|2,0,0]=4 10712 B15R1.871 CC(=O)OCCCOc1ccc(cc1)O 271570a_203496583355_200009822517 [0,1,0,0,0,1|2,0,0]=4 10713 B15R1.871 CC(=O)OCCCSc1ccc(cc1)Br 62a_100000042594_100000752885 [0,1,0,0,0,1|2,0,0]=4 10714 B15R1.871 CC(=O)OCCCSc1ccc(cc1)Br 62a_100000752885_100000042594 [0,1,0,0,0,1|2,0,0]=4 10715 B15R1.871 CC(=O)OCCCSc1ccc(cc1)C 62a_100000042594_100000186775 [0,1,0,0,0,1|2,0,0]=4 10716 B15R1.871 CC(=O)OCCCSc1ccc(cc1)C 62a_100000186775_100000042594 [0,1,0,0,0,1|2,0,0]=4 10717 B15R1.871 CC(=O)OCCCSc1ccc(cc1)Cl 62a_100000042594_100000755918 [0,1,0,0,0,1|2,0,0]=4 10718 B15R1.871 CC(=O)OCCCSc1ccc(cc1)Cl 62a_100000755918_100000042594 [0,1,0,0,0,1|2,0,0]=4 10719 B15R1.871 CC(=O)OCCCSc1ccc(cc1)F 62a_100000042594_100000211213 [0,1,0,0,0,1|2,0,0]=4 10720 B15R1.871 CC(=O)OCCCSc1ccc(cc1)F 62a_100000211213_100000042594 [0,1,0,0,0,1|2,0,0]=4 10721 B15R1.871 CC(=O)OCCCSc1ccc(cc1)N 62a_100000042594_100000185761 [0,1,0,0,0,1|2,0,0]=4 10722 B15R1.871 CC(=O)OCCCSc1ccc(cc1)N 62a_100000185761_100000042594 [0,1,0,0,0,1|2,0,0]=4 10723 B15R1.871 CC(=O)OCCCSc1ccc(cc1)O 62a_100000042594_100000185759 [0,1,0,0,0,1|2,0,0]=4 10724 B15R1.871 CC(=O)OCCNCc1ccc(cc1)Br 34a_100000174875_100009814007 [0,1,0,0,0,1|2,0,0]=4 10725 B15R1.871 CC(=O)OCCNCc1ccc(cc1)C 34a_100000174908_100009814007 [0,1,0,0,0,1|2,0,0]=4 10726 B15R1.871 CC(=O)OCCNCc1ccc(cc1)Cl 34a_100000174871_100009814007 [0,1,0,0,0,1|2,0,0]=4 10727 B15R1.871 CC(=O)OCCNCc1ccc(cc1)F 34a_100000174882_100009814007 [0,1,0,0,0,1|2,0,0]=4 10728 B15R1.871 CC(=O)OCCNCc1ccc(cc1)I 34a_100016989417_100009814007 [0,1,0,0,0,1|2,0,0]=4 10729 B15R1.871 CC(=O)OCCNCc1ccc(cc1)O 34a_100000185549_100009814007 [0,1,0,0,0,1|2,0,0]=4 10730 B15R1.871 CC(=O)OCCOCc1ccc(cc1)Br 34a_100000695286_100009814007 [0,1,0,0,0,1|2,0,0]=4 10731 B15R1.871 CC(=O)OCCOCc1ccc(cc1)C 34a_100011215236_100009814007 [0,1,0,0,0,1|2,0,0]=4 10732 B15R1.871 CC(=O)OCCOCc1ccc(cc1)C 7a_100011215236_100009814007 [0,1,0,0,0,1|2,0,0]=4 10733 B15R1.871 CC(=O)OCCOCc1ccc(cc1)Cl 34a_100000211118_100009814007 [0,1,0,0,0,1|2,0,0]=4 10734 B15R1.871 CC(=O)OCCOCc1ccc(cc1)Cl 7a_100000211118_100009814007 [0,1,0,0,0,1|2,0,0]=4 10735 B15R1.871 CC(=O)OCCOCc1ccc(cc1)F 34a_100000210977_100009814007 [0,1,0,0,0,1|2,0,0]=4 10736 B15R1.871 CC(=O)OCCOCc1ccc(cc1)F 7a_100000210977_100009814007 [0,1,0,0,0,1|2,0,0]=4 10737 B15R1.871 CC(=O)OCCOCc1ccc(cc1)I 34a_100000690907_100009814007 [0,1,0,0,0,1|2,0,0]=4 10738 B15R1.871 CC(=O)OCCOCc1ccc(cc1)I 7a_100000690907_100009814007 [0,1,0,0,0,1|2,0,0]=4 10739 B15R1.871 CC(=O)OCCOCc1ccc(cc1)N 34a_100011215238_100009814007 [0,1,0,0,0,1|2,0,0]=4 10740 B15R1.871 CC(=O)OCCSCc1ccc(cc1)Br 62a_100000189115_100009814007 [0,1,0,0,0,1|2,0,0]=4 10741 B15R1.871 CC(=O)OCCSCc1ccc(cc1)Br 62a_100009814007_100000189115 [0,1,0,0,0,1|2,0,0]=4 10742 B15R1.871 CC(=O)OCCSCc1ccc(cc1)C 62a_100000210814_100009814007 [0,1,0,0,0,1|2,0,0]=4 10743 B15R1.871 CC(=O)OCCSCc1ccc(cc1)C 62a_100009814007_100000210814 [0,1,0,0,0,1|2,0,0]=4 10744 B15R1.871 CC(=O)OCCSCc1ccc(cc1)Cl 62a_100000187161_100009814007 [0,1,0,0,0,1|2,0,0]=4 10745 B15R1.871 CC(=O)OCCSCc1ccc(cc1)Cl 62a_100009814007_100000187161 [0,1,0,0,0,1|2,0,0]=4 10746 B15R1.871 CC(=O)OCCSCc1ccc(cc1)F 62a_100000198546_100009814007 [0,1,0,0,0,1|2,0,0]=4 10747 B15R1.871 CC(=O)OCCSCc1ccc(cc1)F 62a_100009814007_100000187164 [0,1,0,0,0,1|2,0,0]=4 10748 B15R1.871 CC(=O)OCCSCc1ccc(cc1)I 62a_100000189116_100009814007 [0,1,0,0,0,1|2,0,0]=4 10749 B15R1.871 CC(=O)OCCSCc1ccc(cc1)I 62a_100009814007_100000189116 [0,1,0,0,0,1|2,0,0]=4 10750 B15R1.871 CC(=O)OCNCCc1ccc(cc1)Br 34a_100000755846_100009813279 [0,1,0,0,0,1|2,0,0]=4 10751 B15R1.871 CC(=O)OCNCCc1ccc(cc1)C 34a_100000705350_100009813279 [0,1,0,0,0,1|2,0,0]=4 10752 B15R1.871 CC(=O)OCNCCc1ccc(cc1)Cl 34a_100000185265_100009813279 [0,1,0,0,0,1|2,0,0]=4 10753 B15R1.871 CC(=O)OCNCCc1ccc(cc1)F 34a_100000199005_100009813279 [0,1,0,0,0,1|2,0,0]=4 10754 B15R1.871 CC(=O)OCNCCc1ccc(cc1)O 34a_100000743037_100009813279 [0,1,0,0,0,1|2,0,0]=4 10755 B15R1.871 CC(=O)OCOCCc1ccc(cc1)Br 34a_100000766406_100009813279 [0,1,0,0,0,1|2,0,0]=4 10756 B15R1.871 CC(=O)OCOCCc1ccc(cc1)C 34a_100000756670_100009813279 [0,1,0,0,0,1|2,0,0]=4 10757 B15R1.871 CC(=O)OCOCCc1ccc(cc1)Cl 34a_100011219627_100009813279 [0,1,0,0,0,1|2,0,0]=4 10758 B15R1.871 CC(=O)OCOCCc1ccc(cc1)F 34a_100000754732_100009813279 [0,1,0,0,0,1|2,0,0]=4 10759 B15R1.871 CC(=O)OCOCCc1ccc(cc1)I 34a_100012291149_100009813279 [0,1,0,0,0,1|2,0,0]=4 10760 B15R1.871 CC(=O)OCOCCc1ccc(cc1)N 34a_100011204434_100009813279 [0,1,0,0,0,1|2,0,0]=4 10761 B15R1.871 CC(=O)OCSCCc1ccc(cc1)Br 62a_100000076356_100011740612 [0,1,0,0,0,1|2,0,0]=4 10762 B15R1.871 CC(=O)OCSCCc1ccc(cc1)Br 62a_100011740612_100000076356 [0,1,0,0,0,1|2,0,0]=4 10763 B15R1.871 CC(=O)OCSCCc1ccc(cc1)C 62a_100000076356_100011713686 [0,1,0,0,0,1|2,0,0]=4 10764 B15R1.871 CC(=O)OCSCCc1ccc(cc1)C 62a_100011713686_100000076356 [0,1,0,0,0,1|2,0,0]=4 10765 B15R1.871 CC(=O)OCSCCc1ccc(cc1)Cl 62a_100000076356_100011713675 [0,1,0,0,0,1|2,0,0]=4 10766 B15R1.871 CC(=O)OCSCCc1ccc(cc1)Cl 62a_100011713675_100000076356 [0,1,0,0,0,1|2,0,0]=4 10767 B15R1.871 CC(=O)OCSCCc1ccc(cc1)F 62a_100000076356_100011217392 [0,1,0,0,0,1|2,0,0]=4 10768 B15R1.871 CC(=O)OCSCCc1ccc(cc1)F 62a_100011217392_100000076356 [0,1,0,0,0,1|2,0,0]=4 10769 B15R1.871 CC(=O)OCSCCc1ccc(cc1)O 62a_100000076356_100009816426 [0,1,0,0,0,1|2,0,0]=4 10770 B15R1.871 CC(=O)OCSCCc1ccc(cc1)O 62a_100009816426_100000076356 [0,1,0,0,0,1|2,0,0]=4 10771 B15R1.871 CC(=O)SCCCNc1ccc(cc1)Br 2230a_100000210018_100000038929 [0,1,0,0,0,1|2,0,0]=4 10772 B15R1.871 CC(=O)SCCCNc1ccc(cc1)Br 34a_100000210018_100000038929 [0,1,0,0,0,1|2,0,0]=4 10773 B15R1.871 CC(=O)SCCCNc1ccc(cc1)C 34a_100000124888_100000038929 [0,1,0,0,0,1|2,0,0]=4 10774 B15R1.871 CC(=O)SCCCNc1ccc(cc1)Cl 2230a_100000210052_100000038929 [0,1,0,0,0,1|2,0,0]=4 10775 B15R1.871 CC(=O)SCCCNc1ccc(cc1)Cl 34a_100000210052_100000038929 [0,1,0,0,0,1|2,0,0]=4 10776 B15R1.871 CC(=O)SCCCNc1ccc(cc1)F 34a_100000185862_100000038929 [0,1,0,0,0,1|2,0,0]=4 10777 B15R1.871 CC(=O)SCCCNc1ccc(cc1)I 34a_100000185761_100000038929 [0,1,0,0,0,1|2,0,0]=4 10778 B15R1.871 CC(=O)SCCCNc1ccc(cc1)O 34a_100000185829_100000038929 [0,1,0,0,0,1|2,0,0]=4 10779 B15R1.871 CC(=O)SCCCOc1ccc(cc1)Br 34a_100000185759_100000038929 [0,1,0,0,0,1|2,0,0]=4 10780 B15R1.871 CC(=O)SCCCOc1ccc(cc1)Br 7a_100000185759_100000038929 [0,1,0,0,0,1|2,0,0]=4 10781 B15R1.871 CC(=O)SCCCOc1ccc(cc1)C 34a_100000210336_100000038929 [0,1,0,0,0,1|2,0,0]=4 10782 B15R1.871 CC(=O)SCCCOc1ccc(cc1)C 7a_100000210336_100000038929 [0,1,0,0,0,1|2,0,0]=4 10783 B15R1.871 CC(=O)SCCCOc1ccc(cc1)Cl 34a_100000210216_100000038929 [0,1,0,0,0,1|2,0,0]=4 10784 B15R1.871 CC(=O)SCCCOc1ccc(cc1)Cl 7a_100000210216_100000038929 [0,1,0,0,0,1|2,0,0]=4 10785 B15R1.871 CC(=O)SCCCOc1ccc(cc1)F 34a_100000210339_100000038929 [0,1,0,0,0,1|2,0,0]=4 10786 B15R1.871 CC(=O)SCCCOc1ccc(cc1)I 34a_100000212066_100000038929 [0,1,0,0,0,1|2,0,0]=4 10787 B15R1.871 CC(=O)SCCCOc1ccc(cc1)I 7a_100000212066_100000038929 [0,1,0,0,0,1|2,0,0]=4 10788 B15R1.871 CC(=O)SCCCOc1ccc(cc1)N 34a_100000185829_100000038929 [0,1,0,0,0,1|2,0,0]=4 10789 B15R1.871 CC(=O)SCCCSc1ccc(cc1)Br 62a_100000038929_100000752885 [0,1,0,0,0,1|2,0,0]=4 10790 B15R1.871 CC(=O)SCCCSc1ccc(cc1)Br 62a_100000752885_100000038929 [0,1,0,0,0,1|2,0,0]=4 10791 B15R1.871 CC(=O)SCCCSc1ccc(cc1)C 62a_100000038929_100000186775 [0,1,0,0,0,1|2,0,0]=4 10792 B15R1.871 CC(=O)SCCCSc1ccc(cc1)C 62a_100000186775_100000038929 [0,1,0,0,0,1|2,0,0]=4 10793 B15R1.871 CC(=O)SCCCSc1ccc(cc1)Cl 62a_100000038929_100000755918 [0,1,0,0,0,1|2,0,0]=4 10794 B15R1.871 CC(=O)SCCCSc1ccc(cc1)Cl 62a_100000755918_100000038929 [0,1,0,0,0,1|2,0,0]=4 10795 B15R1.871 CC(=O)SCCCSc1ccc(cc1)F 62a_100000038929_100000211213 [0,1,0,0,0,1|2,0,0]=4 10796 B15R1.871 CC(=O)SCCCSc1ccc(cc1)F 62a_100000211213_100000038929 [0,1,0,0,0,1|2,0,0]=4 10797 B15R1.871 CC(=O)SCCCSc1ccc(cc1)N 62a_100000038929_100000185761 [0,1,0,0,0,1|2,0,0]=4 10798 B15R1.871 CC(=O)SCCCSc1ccc(cc1)N 62a_100000185761_100000038929 [0,1,0,0,0,1|2,0,0]=4 10799 B15R1.871 CC(=O)SCCCSc1ccc(cc1)O 62a_100000038929_100000185759 [0,1,0,0,0,1|2,0,0]=4 10800 B15R1.871 CC(O)CCCNCc1ccc(cc1)Br 2230a_100000174875_200000718107 [0,1,0,0,0,1|1,0,1]=4 10801 B15R1.871 CC(O)CCCNCc1ccc(cc1)Br 34a_100000174875_200000718107 [0,1,0,0,0,1|1,0,1]=4 10802 B15R1.871 CC(O)CCCNCc1ccc(cc1)Cl 2230a_100000174871_200000718107 [0,1,0,0,0,1|1,0,1]=4 10803 B15R1.871 CC(O)CCCNCc1ccc(cc1)Cl 34a_100000174871_200000718107 [0,1,0,0,0,1|1,0,1]=4 10804 B15R1.871 CC(O)CCCNCc1ccc(cc1)F 2230a_100000174882_200000718107 [0,1,0,0,0,1|1,0,1]=4 10805 B15R1.871 CC(O)CCCNCc1ccc(cc1)F 34a_100000174882_200000718107 [0,1,0,0,0,1|1,0,1]=4 10806 B15R1.871 CC(O)CCCNCc1ccc(cc1)I 2230a_100016989417_200000718107 [0,1,0,0,0,1|1,0,1]=4 10807 B15R1.871 CC(O)CCCNCc1ccc(cc1)I 34a_100016989417_200000718107 [0,1,0,0,0,1|1,0,1]=4 10808 B15R1.871 CC(O)CCCNCc1ccc(cc1)O 34a_100000185549_200000718107 [0,1,0,0,0,1|1,0,1]=4 10809 B15R1.871 CC(O)CCCOCc1ccc(cc1)Br 34a_100000695286_200000718107 [0,1,0,0,0,1|1,0,1]=4 10810 B15R1.871 CC(O)CCCOCc1ccc(cc1)Cl 34a_100000211118_200000718107 [0,1,0,0,0,1|1,0,1]=4 10811 B15R1.871 CC(O)CCCOCc1ccc(cc1)Cl 7a_100000211118_200000718107 [0,1,0,0,0,1|1,0,1]=4 10812 B15R1.871 CC(O)CCCOCc1ccc(cc1)F 34a_100000210977_200000718107 [0,1,0,0,0,1|1,0,1]=4 10813 B15R1.871 CC(O)CCCOCc1ccc(cc1)F 7a_100000210977_200000718107 [0,1,0,0,0,1|1,0,1]=4 10814 B15R1.871 CC(O)CCCOCc1ccc(cc1)I 34a_100000690907_200000718107 [0,1,0,0,0,1|1,0,1]=4 10815 B15R1.871 CC(O)CCCOCc1ccc(cc1)I 7a_100000690907_200000718107 [0,1,0,0,0,1|1,0,1]=4 10816 B15R1.871 CC(O)CCCOCc1ccc(cc1)N 34a_100011215238_200000718107 [0,1,0,0,0,1|1,0,1]=4 10817 B15R1.871 CC(O)CCCSCc1ccc(cc1)Br 62a_100000189115_200000718107 [0,1,0,0,0,1|1,0,1]=4 10818 B15R1.871 CC(O)CCCSCc1ccc(cc1)Br 62a_200000718107_100000189115 [0,1,0,0,0,1|1,0,1]=4 10819 B15R1.871 CC(O)CCCSCc1ccc(cc1)Cl 62a_100000187161_200000718107 [0,1,0,0,0,1|1,0,1]=4 10820 B15R1.871 CC(O)CCCSCc1ccc(cc1)Cl 62a_200000718107_100000187161 [0,1,0,0,0,1|1,0,1]=4 10821 B15R1.871 CC(O)CCCSCc1ccc(cc1)F 62a_100000198546_200000718107 [0,1,0,0,0,1|1,0,1]=4 10822 B15R1.871 CC(O)CCCSCc1ccc(cc1)F 62a_200000718107_100000187164 [0,1,0,0,0,1|1,0,1]=4 10823 B15R1.871 CC(O)CCCSCc1ccc(cc1)I 62a_100000189116_200000718107 [0,1,0,0,0,1|1,0,1]=4 10824 B15R1.871 CC(O)CCCSCc1ccc(cc1)I 62a_200000718107_100000189116 [0,1,0,0,0,1|1,0,1]=4 10825 B15R1.871 CC(O)CCNCCc1ccc(cc1)Br 2230a_100000755846_100012276601 [0,1,0,0,0,1|1,0,1]=4 10826 B15R1.871 CC(O)CCNCCc1ccc(cc1)Br 2230a_200000755665_100011740612 [0,1,0,0,0,1|1,0,1]=4 10827 B15R1.871 CC(O)CCNCCc1ccc(cc1)Br 34a_100000755846_100012276601 [0,1,0,0,0,1|1,0,1]=4 10828 B15R1.871 CC(O)CCNCCc1ccc(cc1)Cl 2230a_100000185265_100012276601 [0,1,0,0,0,1|1,0,1]=4 10829 B15R1.871 CC(O)CCNCCc1ccc(cc1)Cl 2230a_200000755665_100011713675 [0,1,0,0,0,1|1,0,1]=4 10830 B15R1.871 CC(O)CCNCCc1ccc(cc1)Cl 34a_100000185265_100012276601 [0,1,0,0,0,1|1,0,1]=4 10831 B15R1.871 CC(O)CCNCCc1ccc(cc1)F 2230a_100000199005_100012276601 [0,1,0,0,0,1|1,0,1]=4 10832 B15R1.871 CC(O)CCNCCc1ccc(cc1)F 2230a_200000755665_100011217392 [0,1,0,0,0,1|1,0,1]=4 10833 B15R1.871 CC(O)CCNCCc1ccc(cc1)F 34a_100000199005_100012276601 [0,1,0,0,0,1|1,0,1]=4 10834 B15R1.871 CC(O)CCNCCc1ccc(cc1)O 2230a_200000755665_100009816426 [0,1,0,0,0,1|1,0,1]=4 10835 B15R1.871 CC(O)CCNCCc1ccc(cc1)O 34a_100000743037_100012276601 [0,1,0,0,0,1|1,0,1]=4 10836 B15R1.871 CC(O)CCOCCc1ccc(cc1)Br 34a_100000766406_100012276601 [0,1,0,0,0,1|1,0,1]=4 10837 B15R1.871 CC(O)CCOCCc1ccc(cc1)Br 7a_100000766406_100012276601 [0,1,0,0,0,1|1,0,1]=4 10838 B15R1.871 CC(O)CCOCCc1ccc(cc1)Cl 34a_100011219627_100012276601 [0,1,0,0,0,1|1,0,1]=4 10839 B15R1.871 CC(O)CCOCCc1ccc(cc1)Cl 7a_100011219627_100012276601 [0,1,0,0,0,1|1,0,1]=4 10840 B15R1.871 CC(O)CCOCCc1ccc(cc1)F 34a_100000754732_100012276601 [0,1,0,0,0,1|1,0,1]=4 10841 B15R1.871 CC(O)CCOCCc1ccc(cc1)F 7a_100000754732_100012276601 [0,1,0,0,0,1|1,0,1]=4 10842 B15R1.871 CC(O)CCOCCc1ccc(cc1)I 34a_100012291149_100012276601 [0,1,0,0,0,1|1,0,1]=4 10843 B15R1.871 CC(O)CCOCCc1ccc(cc1)I 7a_100012291149_100012276601 [0,1,0,0,0,1|1,0,1]=4 10844 B15R1.871 CC(O)CCOCCc1ccc(cc1)N 34a_100011204434_100012276601 [0,1,0,0,0,1|1,0,1]=4 10845 B15R1.871 CC(O)CCSCCc1ccc(cc1)Br 62a_100011740612_100012276601 [0,1,0,0,0,1|1,0,1]=4 10846 B15R1.871 CC(O)CCSCCc1ccc(cc1)Br 62a_100012276601_100011740612 [0,1,0,0,0,1|1,0,1]=4 10847 B15R1.871 CC(O)CCSCCc1ccc(cc1)Cl 62a_100011713675_100012276601 [0,1,0,0,0,1|1,0,1]=4 10848 B15R1.871 CC(O)CCSCCc1ccc(cc1)Cl 62a_100012276601_100011713675 [0,1,0,0,0,1|1,0,1]=4 10849 B15R1.871 CC(O)CCSCCc1ccc(cc1)F 62a_100011217392_100012276601 [0,1,0,0,0,1|1,0,1]=4 10850 B15R1.871 CC(O)CCSCCc1ccc(cc1)F 62a_100012276601_100011217392 [0,1,0,0,0,1|1,0,1]=4 10851 B15R1.871 CC(O)CCSCCc1ccc(cc1)O 62a_100009816426_100012276601 [0,1,0,0,0,1|1,0,1]=4 10852 B15R1.871 CC(O)CCSCCc1ccc(cc1)O 62a_100012276601_100009816426 [0,1,0,0,0,1|1,0,1]=4 10853 B15R1.871 CC(O)CNCCCc1ccc(cc1)Br 2230a_100000210904_100011713682 [0,1,0,0,0,1|1,0,1]=4 10854 B15R1.871 CC(O)CNCCCc1ccc(cc1)Br 2230a_100011297623_100011218427 [0,1,0,0,0,1|1,0,1]=4 10855 B15R1.871 CC(O)CNCCCc1ccc(cc1)Br 34a_100000210904_100011713682 [0,1,0,0,0,1|1,0,1]=4 10856 B15R1.871 CC(O)CNCCCc1ccc(cc1)Br 34a_100011297623_100011218427 [0,1,0,0,0,1|1,0,1]=4 10857 B15R1.871 CC(O)CNCCCc1ccc(cc1)Cl 2230a_100000210904_100000759440 [0,1,0,0,0,1|1,0,1]=4 10858 B15R1.871 CC(O)CNCCCc1ccc(cc1)Cl 2230a_100000748451_100011218427 [0,1,0,0,0,1|1,0,1]=4 10859 B15R1.871 CC(O)CNCCCc1ccc(cc1)Cl 34a_100000210904_100000759440 [0,1,0,0,0,1|1,0,1]=4 10860 B15R1.871 CC(O)CNCCCc1ccc(cc1)Cl 34a_100000748451_100011218427 [0,1,0,0,0,1|1,0,1]=4 10861 B15R1.871 CC(O)CNCCCc1ccc(cc1)F 2230a_100000210904_200011713563 [0,1,0,0,0,1|1,0,1]=4 10862 B15R1.871 CC(O)CNCCCc1ccc(cc1)F 2230a_100025745824_100011218427 [0,1,0,0,0,1|1,0,1]=4 10863 B15R1.871 CC(O)CNCCCc1ccc(cc1)F 34a_100000210904_200011713563 [0,1,0,0,0,1|1,0,1]=4 10864 B15R1.871 CC(O)CNCCCc1ccc(cc1)F 34a_100025745824_100011218427 [0,1,0,0,0,1|1,0,1]=4 10865 B15R1.871 CC(O)COCCCc1ccc(cc1)Br 34a_100011709247_100011218427 [0,1,0,0,0,1|1,0,1]=4 10866 B15R1.871 CC(O)COCCCc1ccc(cc1)Br 7a_100011709247_100011218427 [0,1,0,0,0,1|1,0,1]=4 10867 B15R1.871 CC(O)COCCCc1ccc(cc1)Cl 34a_100011217485_100011218427 [0,1,0,0,0,1|1,0,1]=4 10868 B15R1.871 CC(O)COCCCc1ccc(cc1)Cl 7a_100011217485_100011218427 [0,1,0,0,0,1|1,0,1]=4 10869 B15R1.871 CC(O)COCCCc1ccc(cc1)F 34a_100000757351_100011218427 [0,1,0,0,0,1|1,0,1]=4 10870 B15R1.871 CC(O)COCCCc1ccc(cc1)F 7a_100000757351_100011218427 [0,1,0,0,0,1|1,0,1]=4 10871 B15R1.871 CC(O)CSCCCc1ccc(cc1)Br 62a_100011218427_100011713682 [0,1,0,0,0,1|1,0,1]=4 10872 B15R1.871 CC(O)CSCCCc1ccc(cc1)Br 62a_100011713682_100011218427 [0,1,0,0,0,1|1,0,1]=4 10873 B15R1.871 CC(O)CSCCCc1ccc(cc1)Cl 62a_100000759440_100011218427 [0,1,0,0,0,1|1,0,1]=4 10874 B15R1.871 CC(O)CSCCCc1ccc(cc1)Cl 62a_100011218427_100000759440 [0,1,0,0,0,1|1,0,1]=4 10875 B15R1.871 CC(O)CSCCCc1ccc(cc1)F 62a_100011218427_200011713563 [0,1,0,0,0,1|1,0,1]=4 10876 B15R1.871 CC(O)CSCCCc1ccc(cc1)F 62a_200011713563_100011218427 [0,1,0,0,0,1|1,0,1]=4 10877 B15R1.871 CS(=O)CCCNCc1ccc(cc1)Br 207a_200000753449_100000186029 [0,1,0,0,0,1|2,0,0]=4 10878 B15R1.871 CS(=O)CCCNCc1ccc(cc1)Br 2230a_200000753449_100011217064 [0,1,0,0,0,1|2,0,0]=4 10879 B15R1.871 CS(=O)CCCNCc1ccc(cc1)Br 270004a_200000753449_100000186029 [0,1,0,0,0,1|2,0,0]=4 10880 B15R1.871 CS(=O)CCCNCc1ccc(cc1)Cl 207a_200000753449_100000189385 [0,1,0,0,0,1|2,0,0]=4 10881 B15R1.871 CS(=O)CCCNCc1ccc(cc1)Cl 2230a_200000753449_100000694040 [0,1,0,0,0,1|2,0,0]=4 10882 B15R1.871 CS(=O)CCCNCc1ccc(cc1)Cl 270004a_200000753449_100000189385 [0,1,0,0,0,1|2,0,0]=4 10883 B15R1.871 CS(=O)CCCNCc1ccc(cc1)F 207a_200000753449_100000210084 [0,1,0,0,0,1|2,0,0]=4 10884 B15R1.871 CS(=O)CCCNCc1ccc(cc1)F 2230a_200000753449_100000198546 [0,1,0,0,0,1|2,0,0]=4 10885 B15R1.871 CS(=O)CCCNCc1ccc(cc1)F 270004a_200000753449_100000210084 [0,1,0,0,0,1|2,0,0]=4 10886 B15R1.871 CS(=O)CCCNCc1ccc(cc1)I 207a_200000753449_100000188517 [0,1,0,0,0,1|2,0,0]=4 10887 B15R1.871 CS(=O)CCCNCc1ccc(cc1)I 2230a_200000753449_100000189116 [0,1,0,0,0,1|2,0,0]=4 10888 B15R1.871 C[C@@H](O)CNCCCc1ccc(cc1)Br 2230a_100011297623_100009817552 [0,1,0,0,0,1|1,0,1]=4 10889 B15R1.871 C[C@@H](O)CNCCCc1ccc(cc1)Br 34a_100011297623_100009817552 [0,1,0,0,0,1|1,0,1]=4 10890 B15R1.871 C[C@@H](O)CNCCCc1ccc(cc1)Cl 2230a_100000748451_100009817552 [0,1,0,0,0,1|1,0,1]=4 10891 B15R1.871 C[C@@H](O)CNCCCc1ccc(cc1)Cl 34a_100000748451_100009817552 [0,1,0,0,0,1|1,0,1]=4 10892 B15R1.871 C[C@@H](O)CNCCCc1ccc(cc1)F 2230a_100025745824_100009817552 [0,1,0,0,0,1|1,0,1]=4 10893 B15R1.871 C[C@@H](O)CNCCCc1ccc(cc1)F 34a_100025745824_100009817552 [0,1,0,0,0,1|1,0,1]=4 10894 B15R1.871 C[C@@H](O)COCCCc1ccc(cc1)Br 34a_100011709247_100009817552 [0,1,0,0,0,1|1,0,1]=4 10895 B15R1.871 C[C@@H](O)COCCCc1ccc(cc1)Br 7a_100011709247_100009817552 [0,1,0,0,0,1|1,0,1]=4 10896 B15R1.871 C[C@@H](O)COCCCc1ccc(cc1)Cl 34a_100011217485_100009817552 [0,1,0,0,0,1|1,0,1]=4 10897 B15R1.871 C[C@@H](O)COCCCc1ccc(cc1)Cl 7a_100011217485_100009817552 [0,1,0,0,0,1|1,0,1]=4 10898 B15R1.871 C[C@@H](O)COCCCc1ccc(cc1)F 34a_100000757351_100009817552 [0,1,0,0,0,1|1,0,1]=4 10899 B15R1.871 C[C@@H](O)COCCCc1ccc(cc1)F 7a_100000757351_100009817552 [0,1,0,0,0,1|1,0,1]=4 10900 B15R1.871 C[C@@H](O)CSCCCc1ccc(cc1)Br 62a_100009817552_100011713682 [0,1,0,0,0,1|1,0,1]=4 10901 B15R1.871 C[C@@H](O)CSCCCc1ccc(cc1)Br 62a_100011713682_100009817552 [0,1,0,0,0,1|1,0,1]=4 10902 B15R1.871 C[C@@H](O)CSCCCc1ccc(cc1)Cl 62a_100000759440_100009817552 [0,1,0,0,0,1|1,0,1]=4 10903 B15R1.871 C[C@@H](O)CSCCCc1ccc(cc1)Cl 62a_100009817552_100000759440 [0,1,0,0,0,1|1,0,1]=4 10904 B15R1.871 C[C@@H](O)CSCCCc1ccc(cc1)F 62a_100009817552_200011713563 [0,1,0,0,0,1|1,0,1]=4 10905 B15R1.871 C[C@@H](O)CSCCCc1ccc(cc1)F 62a_200011713563_100009817552 [0,1,0,0,0,1|1,0,1]=4 10906 B15R1.871 C[n+]1ccc(cc1)COCCCC(=O)N 34a_100009831711_100102525003 [0,1,0,0,0,1|2,0,0]=4 10907 B15R1.871 Cc1ccc(cc1)CCCNCC(=O)N 2230a_100011236272_100000747473 [0,1,0,0,0,1|1,0,0]=3 10908 B15R1.871 Cc1ccc(cc1)CCCNCC(=O)N 34a_100011236272_100000187820 [0,1,0,0,0,1|1,0,0]=3 10909 B15R1.871 Cc1ccc(cc1)CCCNCC(=O)[O-] 34a_100011236272_100020667443 [0,1,0,0,0,1|0,0,1]=3 10910 B15R1.871 Cc1ccc(cc1)CCCNCC(C)O 2230a_100011236272_100011218427 [0,1,0,0,0,1|1,0,1]=4 10911 B15R1.871 Cc1ccc(cc1)CCCNCC(C)O 34a_100011236272_100011218427 [0,1,0,0,0,1|1,0,1]=4 10912 B15R1.871 Cc1ccc(cc1)CCCNC[C@@H](C)O 2230a_100011236272_100009817552 [0,1,0,0,0,1|1,0,1]=4 10913 B15R1.871 Cc1ccc(cc1)CCCNC[C@@H](C)O 34a_100011236272_100009817552 [0,1,0,0,0,1|1,0,1]=4 10914 B15R1.871 Cc1ccc(cc1)CCCNC[N+](=O)[O-] 34a_100011236272_100000761209 [0,1,0,0,0,1|1,0,1]=4 10915 B15R1.871 Cc1ccc(cc1)CCCOCC(=O)N 34a_100000189427_100000187820 [0,1,0,0,0,1|1,0,0]=3 10916 B15R1.871 Cc1ccc(cc1)CCCOCC(=O)N 7a_100000189427_100000187820 [0,1,0,0,0,1|1,0,0]=3 10917 B15R1.871 Cc1ccc(cc1)CCCOCC(=O)[O-] 34a_100000189427_100020667443 [0,1,0,0,0,1|0,0,1]=3 10918 B15R1.871 Cc1ccc(cc1)CCCOCC(C)O 34a_100000189427_100011218427 [0,1,0,0,0,1|1,0,1]=4 10919 B15R1.871 Cc1ccc(cc1)CCCOCC(C)O 7a_100000189427_100011218427 [0,1,0,0,0,1|1,0,1]=4 10920 B15R1.871 Cc1ccc(cc1)CCCOC[C@@H](C)O 34a_100000189427_100009817552 [0,1,0,0,0,1|1,0,1]=4 10921 B15R1.871 Cc1ccc(cc1)CCCOC[C@@H](C)O 7a_100000189427_100009817552 [0,1,0,0,0,1|1,0,1]=4 10922 B15R1.871 Cc1ccc(cc1)CCCOC[N+](=O)[O-] 34a_100000189427_100000761209 [0,1,0,0,0,1|1,0,1]=4 10923 B15R1.871 Cc1ccc(cc1)CCNCCC(=O)N 2230a_100000705350_100000744528 [0,1,0,0,0,1|1,0,0]=3 10924 B15R1.871 Cc1ccc(cc1)CCNCCC(=O)N 34a_100000705350_100000731001 [0,1,0,0,0,1|1,0,0]=3 10925 B15R1.871 Cc1ccc(cc1)CCNCCC(C)O 2230a_100000705350_100012276601 [0,1,0,0,0,1|1,0,1]=4 10926 B15R1.871 Cc1ccc(cc1)CCNCCC(C)O 2230a_200000755665_100011713686 [0,1,0,0,0,1|1,0,1]=4 10927 B15R1.871 Cc1ccc(cc1)CCNCCC(C)O 34a_100000705350_100012276601 [0,1,0,0,0,1|1,0,1]=4 10928 B15R1.871 Cc1ccc(cc1)CCNOCC(=O)O 269956a_100000106656_100011713686 [0,1,0,0,0,1|1,0,0]=3 10929 B15R1.871 Cc1ccc(cc1)CCOCCC(=O)N 34a_100000756670_100000731001 [0,1,0,0,0,1|1,0,0]=3 10930 B15R1.871 Cc1ccc(cc1)CCOCCC(=O)N 34a_100000757172_100011713686 [0,1,0,0,0,1|1,0,0]=3 10931 B15R1.871 Cc1ccc(cc1)CCOCCC(=O)N 7a_100000756670_100000744528 [0,1,0,0,0,1|1,0,0]=3 10932 B15R1.871 Cc1ccc(cc1)CCOCCC(=O)N 7a_100000757172_100011713686 [0,1,0,0,0,1|1,0,0]=3 10933 B15R1.871 Cc1ccc(cc1)CCOCCC(C)O 34a_100000756670_100012276601 [0,1,0,0,0,1|1,0,1]=4 10934 B15R1.871 Cc1ccc(cc1)CCOCCC(C)O 7a_100000756670_100012276601 [0,1,0,0,0,1|1,0,1]=4 10935 B15R1.871 Cc1ccc(cc1)CCSCCC(=O)N 62a_100000744528_100011713686 [0,1,0,0,0,1|1,0,0]=3 10936 B15R1.871 Cc1ccc(cc1)CCSCCC(=O)N 62a_100011713686_100000744528 [0,1,0,0,0,1|1,0,0]=3 10937 B15R1.871 Cc1ccc(cc1)CCSCCC(C)O 62a_100011713686_100012276601 [0,1,0,0,0,1|1,0,1]=4 10938 B15R1.871 Cc1ccc(cc1)CCSCCC(C)O 62a_100012276601_100011713686 [0,1,0,0,0,1|1,0,1]=4 10939 B15R1.871 Cc1ccc(cc1)CNCCCC(=O)N 34a_100000174908_100102525003 [0,1,0,0,0,1|1,0,0]=3 10940 B15R1.871 Cc1ccc(cc1)CNCCCC(=O)N 34a_100000739312_100000210814 [0,1,0,0,0,1|1,0,0]=3 10941 B15R1.871 Cc1ccc(cc1)CNCCCC(C)O 2230a_100000174908_200000718107 [0,1,0,0,0,1|1,0,1]=4 10942 B15R1.871 Cc1ccc(cc1)CNCCCC(C)O 34a_100000174908_200000718107 [0,1,0,0,0,1|1,0,1]=4 10943 B15R1.871 Cc1ccc(cc1)CNCCCS(=O)C 207a_200000753449_100000211033 [0,1,0,0,0,1|2,0,0]=4 10944 B15R1.871 Cc1ccc(cc1)CNCCCS(=O)C 2230a_200000753449_100000210814 [0,1,0,0,0,1|2,0,0]=4 10945 B15R1.871 Cc1ccc(cc1)CNCCCS(=O)C 270004a_200000753449_100000211033 [0,1,0,0,0,1|2,0,0]=4 10946 B15R1.871 Cc1ccc(cc1)CNCCNC(=O)N 207a_100020590234_100000211033 [0,1,0,0,0,1|2,0,0]=4 10947 B15R1.871 Cc1ccc(cc1)CNCCNC(=O)N 2230a_100000174908_200000034859 [0,1,0,0,0,1|2,0,0]=4 10948 B15R1.871 Cc1ccc(cc1)CNCCNC(=O)N 34a_100020590234_100000210814 [0,1,0,0,0,1|2,0,0]=4 10949 B15R1.871 Cc1ccc(cc1)CNCCOC(=O)N 34a_100000174908_200011214921 [0,1,0,0,0,1|2,0,0]=4 10950 B15R1.871 Cc1ccc(cc1)COCCCC(=O)N 34a_100011215236_100102525003 [0,1,0,0,0,1|1,0,0]=3 10951 B15R1.871 Cc1ccc(cc1)COCCCC(=O)N 7a_100011215236_100102525003 [0,1,0,0,0,1|1,0,0]=3 10952 B15R1.871 Cc1ccc(cc1)COCCCC(C)O 34a_100011215236_200000718107 [0,1,0,0,0,1|1,0,1]=4 10953 B15R1.871 Cc1ccc(cc1)COCCCC(C)O 7a_100011215236_200000718107 [0,1,0,0,0,1|1,0,1]=4 10954 B15R1.871 Cc1ccc(cc1)COCCC[N+](=O)[O-] 34a_200000037920_100000210814 [0,1,0,0,0,1|1,0,1]=4 10955 B15R1.871 Cc1ccc(cc1)COCCNC(=O)N 34a_100000181757_100000210814 [0,1,0,0,0,1|2,0,0]=4 10956 B15R1.871 Cc1ccc(cc1)COCCNC(=O)N 7a_100011215236_200000034859 [0,1,0,0,0,1|2,0,0]=4 10957 B15R1.871 Cc1ccc(cc1)COCCOC(=O)N 34a_100011215236_200011214921 [0,1,0,0,0,1|2,0,0]=4 10958 B15R1.871 Cc1ccc(cc1)COCCOC(=O)N 7a_100000766696_100000210814 [0,1,0,0,0,1|2,0,0]=4 10959 B15R1.871 Cc1ccc(cc1)COCCOC(=O)N 7a_100011215236_200011214921 [0,1,0,0,0,1|2,0,0]=4 10960 B15R1.871 Cc1ccc(cc1)CSCCCC(=O)N 62a_100000210814_100102525003 [0,1,0,0,0,1|1,0,0]=3 10961 B15R1.871 Cc1ccc(cc1)CSCCCC(=O)N 62a_100102525003_100000210814 [0,1,0,0,0,1|1,0,0]=3 10962 B15R1.871 Cc1ccc(cc1)CSCCCC(C)O 62a_100000210814_200000718107 [0,1,0,0,0,1|1,0,1]=4 10963 B15R1.871 Cc1ccc(cc1)CSCCCC(C)O 62a_200000718107_100000210814 [0,1,0,0,0,1|1,0,1]=4 10964 B15R1.871 Cc1ccc(cc1)CSCCNC(=O)N 62a_100000210814_200000034859 [0,1,0,0,0,1|2,0,0]=4 10965 B15R1.871 Cc1ccc(cc1)CSCCNC(=O)N 62a_200000034859_100000210814 [0,1,0,0,0,1|2,0,0]=4 10966 B15R1.871 Cc1ccc(cc1)CSCCOC(=O)N 62a_100000210814_200011214921 [0,1,0,0,0,1|2,0,0]=4 10967 B15R1.871 Cc1ccc(cc1)CSCCOC(=O)N 62a_200011214921_100000210814 [0,1,0,0,0,1|2,0,0]=4 10968 B15R1.871 Cc1ccc(cc1)NCCCCB(O)O 34a_100000124888_200009817182 [0,1,0,0,0,1|1,0,1]=4 10969 B15R1.871 Cc1ccc(cc1)NCCOCC(=O)N 34a_100000124888_100000076697 [0,1,0,0,0,1|2,0,0]=4 10970 B15R1.871 Cc1ccc(cc1)OCCCCB(O)O 34a_100000210336_200009817182 [0,1,0,0,0,1|1,0,1]=4 10971 B15R1.871 Cc1ccc(cc1)OCCCCB(O)O 7a_100000210336_200009817182 [0,1,0,0,0,1|1,0,1]=4 10972 B15R1.871 Cc1ccc(cc1)OCCNCC(=O)N 2230a_100000711301_100000183172 [0,1,0,0,0,1|2,0,0]=4 10973 B15R1.871 Cc1ccc(cc1)OCCNCC(=O)N 2230a_100020666663_100000747473 [0,1,0,0,0,1|2,0,0]=4 10974 B15R1.871 Cc1ccc(cc1)OCCNCC(=O)N 34a_100020666663_100000187820 [0,1,0,0,0,1|2,0,0]=4 10975 B15R1.871 Cc1ccc(cc1)OCCNCC(=O)O 269956a_100016091260_100000183172 [0,1,0,0,0,1|1,0,0]=3 10976 B15R1.871 Cc1ccc(cc1)OCCNCC(=O)[O-] 34a_100020666663_100020667443 [0,1,0,0,0,1|1,0,1]=4 10977 B15R1.871 Cc1ccc(cc1)OCCOCC(=O)N 34a_100000210336_100000076697 [0,1,0,0,0,1|2,0,0]=4 10978 B15R1.871 Cc1ccc(cc1)OCCOCC(=O)N 34a_100011219107_100000187820 [0,1,0,0,0,1|2,0,0]=4 10979 B15R1.871 Cc1ccc(cc1)OCCOCC(=O)N 7a_100000210336_100000076697 [0,1,0,0,0,1|2,0,0]=4 10980 B15R1.871 Cc1ccc(cc1)OCCOCC(=O)N 7a_100011219107_100000187820 [0,1,0,0,0,1|2,0,0]=4 10981 B15R1.871 Cc1ccc(cc1)OCCOCC(=O)[O-] 34a_100011219107_100020667443 [0,1,0,0,0,1|1,0,1]=4 10982 B15R1.871 Cc1ccc(cc1)OCCSCC(=O)N 62a_100000183172_100000747473 [0,1,0,0,0,1|2,0,0]=4 10983 B15R1.871 Cc1ccc(cc1)OCCSCC(=O)N 62a_100000747473_100000183172 [0,1,0,0,0,1|2,0,0]=4 10984 B15R1.871 Cc1ccc(cc1)OCCSCC(=O)[O-] 62a_100000183172_100020667443 [0,1,0,0,0,1|1,0,1]=4 10985 B15R1.871 Cc1ccc(cc1)OCCSCC(=O)[O-] 62a_100020667443_100000183172 [0,1,0,0,0,1|1,0,1]=4 10986 B15R1.871 Cc1ccc(cc1)SCCCCB(O)O 62a_100000186775_200009817182 [0,1,0,0,0,1|1,0,1]=4 10987 B15R1.871 Cc1ccc(cc1)SCCCCB(O)O 62a_200009817182_100000186775 [0,1,0,0,0,1|1,0,1]=4 10988 B15R1.871 Cc1ccc(cc1)SCCNCC(=O)N 2230a_100000739754_100000747473 [0,1,0,0,0,1|2,0,0]=4 10989 B15R1.871 Cc1ccc(cc1)SCCOCC(=O)N 34a_200000230582_100000187820 [0,1,0,0,0,1|2,0,0]=4 10990 B15R1.871 Cc1ccc(cc1)SCCOCC(=O)N 62a_100000076697_100000186775 [0,1,0,0,0,1|2,0,0]=4 10991 B15R1.871 Cc1ccc(cc1)SCCOCC(=O)N 62a_100000186775_100000076697 [0,1,0,0,0,1|2,0,0]=4 10992 B15R1.871 Cc1ccc(cc1)SCCOCC(=O)N 7a_200000230582_100000187820 [0,1,0,0,0,1|2,0,0]=4 10993 B15R1.871 Cc1ccc(cc1)SCCOCC(=O)[O-] 34a_200000230582_100020667443 [0,1,0,0,0,1|1,0,1]=4 10994 B15R1.871 Cc1ccc(cn1)CCOCCC(=O)N 34a_100011815783_100000731001 [0,1,0,0,0,1|2,0,0]=4 10995 B15R1.871 Cc1ccc(cn1)CNCCCC(=O)N 34a_100000739312_100016987292 [0,1,0,0,0,1|2,0,0]=4 10996 B15R1.871 Cc1ccc(cn1)CNCCCC(=O)N 34a_100000740942_100102525003 [0,1,0,0,0,1|2,0,0]=4 10997 B15R1.871 Cc1ccc(cn1)COCCCC(=O)N 34a_100011248133_100102525003 [0,1,0,0,0,1|2,0,0]=4 10998 B15R1.871 Cc1ccc(cn1)CSCCCC(=O)N 62a_100016987292_100102525003 [0,1,0,0,0,1|2,0,0]=4 10999 B15R1.871 Cc1ccc(cn1)CSCCCC(=O)N 62a_100102525003_100016987292 [0,1,0,0,0,1|2,0,0]=4 11000 B15R1.871 Cc1ccc(nc1)CNCCCC(=O)N 34a_100000739312_100000691093 [0,1,0,0,0,1|2,0,0]=4 11001 B15R1.871 Cc1ccc(nc1)CNCCCC(=O)N 34a_100015187455_100102525003 [0,1,0,0,0,1|2,0,0]=4 11002 B15R1.871 Cc1ccc(nc1)COCCCC(=O)N 34a_100012001401_100102525003 [0,1,0,0,0,1|2,0,0]=4 11003 B15R1.871 Cc1ccc(nc1)CSCCCC(=O)N 62a_100000691093_100102525003 [0,1,0,0,0,1|2,0,0]=4 11004 B15R1.871 Cc1ccc(nc1)CSCCCC(=O)N 62a_100102525003_100000691093 [0,1,0,0,0,1|2,0,0]=4 11005 B15R1.871 NC(=O)CCCNCc1ccc(cc1)Br 34a_100000174875_100102525003 [0,1,0,0,0,1|1,0,0]=3 11006 B15R1.871 NC(=O)CCCNCc1ccc(cc1)Br 34a_100000739312_100000189115 [0,1,0,0,0,1|1,0,0]=3 11007 B15R1.871 NC(=O)CCCNCc1ccc(cc1)Cl 34a_100000174871_100102525003 [0,1,0,0,0,1|1,0,0]=3 11008 B15R1.871 NC(=O)CCCNCc1ccc(cc1)Cl 34a_100000739312_100000694040 [0,1,0,0,0,1|1,0,0]=3 11009 B15R1.871 NC(=O)CCCNCc1ccc(cc1)F 34a_100000174882_100102525003 [0,1,0,0,0,1|1,0,0]=3 11010 B15R1.871 NC(=O)CCCNCc1ccc(cc1)F 34a_100000739312_100000198546 [0,1,0,0,0,1|1,0,0]=3 11011 B15R1.871 NC(=O)CCCNCc1ccc(cc1)I 34a_100000739312_100000189116 [0,1,0,0,0,1|1,0,0]=3 11012 B15R1.871 NC(=O)CCCNCc1ccc(cc1)I 34a_100016989417_100102525003 [0,1,0,0,0,1|1,0,0]=3 11013 B15R1.871 NC(=O)CCCNCc1ccc(cc1)O 34a_100000185549_100102525003 [0,1,0,0,0,1|1,0,0]=3 11014 B15R1.871 NC(=O)CCCNCc1ccc(cn1)Br 34a_100000739312_100000702658 [0,1,0,0,0,1|2,0,0]=4 11015 B15R1.871 NC(=O)CCCNCc1ccc(cn1)Br 34a_100015188789_100102525003 [0,1,0,0,0,1|2,0,0]=4 11016 B15R1.871 NC(=O)CCCNCc1ccc(cn1)Cl 34a_100000697193_100102525003 [0,1,0,0,0,1|2,0,0]=4 11017 B15R1.871 NC(=O)CCCNCc1ccc(cn1)Cl 34a_100000739312_100012066911 [0,1,0,0,0,1|2,0,0]=4 11018 B15R1.871 NC(=O)CCCNCc1ccc(cn1)F 34a_100000739312_100000703193 [0,1,0,0,0,1|2,0,0]=4 11019 B15R1.871 NC(=O)CCCNCc1ccc(cn1)F 34a_100020620131_100102525003 [0,1,0,0,0,1|2,0,0]=4 11020 B15R1.871 NC(=O)CCCNCc1ccc(nc1)Br 34a_100000739312_100009831999 [0,1,0,0,0,1|2,0,0]=4 11021 B15R1.871 NC(=O)CCCNCc1ccc(nc1)Br 34a_100009817727_100102525003 [0,1,0,0,0,1|2,0,0]=4 11022 B15R1.871 NC(=O)CCCNCc1ccc(nc1)Cl 34a_100000735879_100102525003 [0,1,0,0,0,1|2,0,0]=4 11023 B15R1.871 NC(=O)CCCNCc1ccc(nc1)Cl 34a_100000739312_100000735431 [0,1,0,0,0,1|2,0,0]=4 11024 B15R1.871 NC(=O)CCCNCc1ccc(nc1)F 34a_100000101913_100102525003 [0,1,0,0,0,1|2,0,0]=4 11025 B15R1.871 NC(=O)CCCNCc1ccc(nc1)F 34a_100000739312_100000099788 [0,1,0,0,0,1|2,0,0]=4 11026 B15R1.871 NC(=O)CCCOCc1cc[n+](cc1)[O-] 34a_100000031831_100102525003 [0,1,0,0,0,1|2,0,0]=4 11027 B15R1.871 NC(=O)CCCOCc1cc[n+](cc1)[O-] 7a_100000031831_100102525003 [0,1,0,0,0,1|2,0,0]=4 11028 B15R1.871 NC(=O)CCCOCc1ccc(=O)[nH]c1 34a_100011999846_100102525003 [0,1,0,0,0,1|2,0,0]=4 11029 B15R1.871 NC(=O)CCCOCc1ccc(cc1)Br 34a_100000695286_100102525003 [0,1,0,0,0,1|1,0,0]=3 11030 B15R1.871 NC(=O)CCCOCc1ccc(cc1)Cl 34a_100000211118_100102525003 [0,1,0,0,0,1|1,0,0]=3 11031 B15R1.871 NC(=O)CCCOCc1ccc(cc1)Cl 7a_100000211118_100102525003 [0,1,0,0,0,1|1,0,0]=3 11032 B15R1.871 NC(=O)CCCOCc1ccc(cc1)F 34a_100000210977_100102525003 [0,1,0,0,0,1|1,0,0]=3 11033 B15R1.871 NC(=O)CCCOCc1ccc(cc1)F 7a_100000210977_100102525003 [0,1,0,0,0,1|1,0,0]=3 11034 B15R1.871 NC(=O)CCCOCc1ccc(cc1)I 34a_100000690907_100102525003 [0,1,0,0,0,1|1,0,0]=3 11035 B15R1.871 NC(=O)CCCOCc1ccc(cc1)I 7a_100000690907_100102525003 [0,1,0,0,0,1|1,0,0]=3 11036 B15R1.871 NC(=O)CCCOCc1ccc(cc1)N 34a_100011215238_100102525003 [0,1,0,0,0,1|1,0,0]=3 11037 B15R1.871 NC(=O)CCCOCc1ccc(cn1)Br 34a_100000754261_100102525003 [0,1,0,0,0,1|2,0,0]=4 11038 B15R1.871 NC(=O)CCCOCc1ccc(cn1)Cl 34a_100000703999_100102525003 [0,1,0,0,0,1|2,0,0]=4 11039 B15R1.871 NC(=O)CCCOCc1ccc(cn1)F 34a_100011999454_100102525003 [0,1,0,0,0,1|2,0,0]=4 11040 B15R1.871 NC(=O)CCCOCc1ccc(cn1)N 34a_100011998161_100102525003 [0,1,0,0,0,1|2,0,0]=4 11041 B15R1.871 NC(=O)CCCOCc1ccc(nc1)Br 34a_100009816760_100102525003 [0,1,0,0,0,1|2,0,0]=4 11042 B15R1.871 NC(=O)CCCOCc1ccc(nc1)Br 7a_100009816760_100102525003 [0,1,0,0,0,1|2,0,0]=4 11043 B15R1.871 NC(=O)CCCOCc1ccc(nc1)Cl 34a_100000755211_100102525003 [0,1,0,0,0,1|2,0,0]=4 11044 B15R1.871 NC(=O)CCCOCc1ccc(nc1)Cl 7a_100000755211_100102525003 [0,1,0,0,0,1|2,0,0]=4 11045 B15R1.871 NC(=O)CCCOCc1ccc(nc1)F 34a_100000079959_100102525003 [0,1,0,0,0,1|2,0,0]=4 11046 B15R1.871 NC(=O)CCCOCc1ccc(nc1)N 34a_100000704267_100102525003 [0,1,0,0,0,1|2,0,0]=4 11047 B15R1.871 NC(=O)CCCSCc1ccc(cc1)Br 62a_100000189115_100102525003 [0,1,0,0,0,1|1,0,0]=3 11048 B15R1.871 NC(=O)CCCSCc1ccc(cc1)Br 62a_100102525003_100000189115 [0,1,0,0,0,1|1,0,0]=3 11049 B15R1.871 NC(=O)CCCSCc1ccc(cc1)Cl 62a_100000187161_100102525003 [0,1,0,0,0,1|1,0,0]=3 11050 B15R1.871 NC(=O)CCCSCc1ccc(cc1)Cl 62a_100102525003_100000187161 [0,1,0,0,0,1|1,0,0]=3 11051 B15R1.871 NC(=O)CCCSCc1ccc(cc1)F 62a_100000198546_100102525003 [0,1,0,0,0,1|1,0,0]=3 11052 B15R1.871 NC(=O)CCCSCc1ccc(cc1)F 62a_100102525003_100000187164 [0,1,0,0,0,1|1,0,0]=3 11053 B15R1.871 NC(=O)CCCSCc1ccc(cc1)I 62a_100000189116_100102525003 [0,1,0,0,0,1|1,0,0]=3 11054 B15R1.871 NC(=O)CCCSCc1ccc(cc1)I 62a_100102525003_100000189116 [0,1,0,0,0,1|1,0,0]=3 11055 B15R1.871 NC(=O)CCCSCc1ccc(cn1)Br 62a_100000702658_100102525003 [0,1,0,0,0,1|2,0,0]=4 11056 B15R1.871 NC(=O)CCCSCc1ccc(cn1)Br 62a_100102525003_100000702658 [0,1,0,0,0,1|2,0,0]=4 11057 B15R1.871 NC(=O)CCCSCc1ccc(cn1)Cl 62a_100012066911_100102525003 [0,1,0,0,0,1|2,0,0]=4 11058 B15R1.871 NC(=O)CCCSCc1ccc(cn1)Cl 62a_100102525003_100000697101 [0,1,0,0,0,1|2,0,0]=4 11059 B15R1.871 NC(=O)CCCSCc1ccc(cn1)F 62a_100000703193_100102525003 [0,1,0,0,0,1|2,0,0]=4 11060 B15R1.871 NC(=O)CCCSCc1ccc(cn1)F 62a_100102525003_100000703193 [0,1,0,0,0,1|2,0,0]=4 11061 B15R1.871 NC(=O)CCCSCc1ccc(nc1)Br 62a_100009831999_100102525003 [0,1,0,0,0,1|2,0,0]=4 11062 B15R1.871 NC(=O)CCCSCc1ccc(nc1)Br 62a_100102525003_100009831999 [0,1,0,0,0,1|2,0,0]=4 11063 B15R1.871 NC(=O)CCCSCc1ccc(nc1)Cl 62a_100000735431_100102525003 [0,1,0,0,0,1|2,0,0]=4 11064 B15R1.871 NC(=O)CCCSCc1ccc(nc1)Cl 62a_100102525003_100000735431 [0,1,0,0,0,1|2,0,0]=4 11065 B15R1.871 NC(=O)CCCSCc1ccc(nc1)F 62a_100009820150_100102525003 [0,1,0,0,0,1|2,0,0]=4 11066 B15R1.871 NC(=O)CCCSCc1ccc(nc1)F 62a_100102525003_100000099788 [0,1,0,0,0,1|2,0,0]=4 11067 B15R1.871 NC(=O)CCNCCc1ccc(cc1)Br 2230a_100000755846_100000744528 [0,1,0,0,0,1|1,0,0]=3 11068 B15R1.871 NC(=O)CCNCCc1ccc(cc1)Br 34a_100000755846_100000731001 [0,1,0,0,0,1|1,0,0]=3 11069 B15R1.871 NC(=O)CCNCCc1ccc(cc1)Cl 2230a_100000185265_100000744528 [0,1,0,0,0,1|1,0,0]=3 11070 B15R1.871 NC(=O)CCNCCc1ccc(cc1)Cl 34a_100000185265_100000731001 [0,1,0,0,0,1|1,0,0]=3 11071 B15R1.871 NC(=O)CCNCCc1ccc(cc1)F 2230a_100000199005_100000744528 [0,1,0,0,0,1|1,0,0]=3 11072 B15R1.871 NC(=O)CCNCCc1ccc(cc1)F 34a_100000199005_100000731001 [0,1,0,0,0,1|1,0,0]=3 11073 B15R1.871 NC(=O)CCNCCc1ccc(cc1)O 34a_100000743037_100000731001 [0,1,0,0,0,1|1,0,0]=3 11074 B15R1.871 NC(=O)CCOCCc1ccc(cc1)Br 34a_100000757172_100011740612 [0,1,0,0,0,1|1,0,0]=3 11075 B15R1.871 NC(=O)CCOCCc1ccc(cc1)Br 34a_100000766406_100000731001 [0,1,0,0,0,1|1,0,0]=3 11076 B15R1.871 NC(=O)CCOCCc1ccc(cc1)Br 7a_100000757172_100011740612 [0,1,0,0,0,1|1,0,0]=3 11077 B15R1.871 NC(=O)CCOCCc1ccc(cc1)Br 7a_100000766406_100000744528 [0,1,0,0,0,1|1,0,0]=3 11078 B15R1.871 NC(=O)CCOCCc1ccc(cc1)Cl 34a_100000757172_100011713675 [0,1,0,0,0,1|1,0,0]=3 11079 B15R1.871 NC(=O)CCOCCc1ccc(cc1)Cl 34a_100011219627_100000731001 [0,1,0,0,0,1|1,0,0]=3 11080 B15R1.871 NC(=O)CCOCCc1ccc(cc1)Cl 7a_100000757172_100011713675 [0,1,0,0,0,1|1,0,0]=3 11081 B15R1.871 NC(=O)CCOCCc1ccc(cc1)Cl 7a_100011219627_100000744528 [0,1,0,0,0,1|1,0,0]=3 11082 B15R1.871 NC(=O)CCOCCc1ccc(cc1)F 34a_100000754732_100000731001 [0,1,0,0,0,1|1,0,0]=3 11083 B15R1.871 NC(=O)CCOCCc1ccc(cc1)F 34a_100000757172_100011217392 [0,1,0,0,0,1|1,0,0]=3 11084 B15R1.871 NC(=O)CCOCCc1ccc(cc1)F 7a_100000754732_100000744528 [0,1,0,0,0,1|1,0,0]=3 11085 B15R1.871 NC(=O)CCOCCc1ccc(cc1)F 7a_100000757172_100011217392 [0,1,0,0,0,1|1,0,0]=3 11086 B15R1.871 NC(=O)CCOCCc1ccc(cc1)I 34a_100012291149_100000731001 [0,1,0,0,0,1|1,0,0]=3 11087 B15R1.871 NC(=O)CCOCCc1ccc(cc1)I 7a_100012291149_100000744528 [0,1,0,0,0,1|1,0,0]=3 11088 B15R1.871 NC(=O)CCOCCc1ccc(cc1)N 34a_100011204434_100000731001 [0,1,0,0,0,1|1,0,0]=3 11089 B15R1.871 NC(=O)CCOCCc1ccc(cc1)O 7a_100000757172_100009816426 [0,1,0,0,0,1|1,0,0]=3 11090 B15R1.871 NC(=O)CCOCCc1ccc(cn1)Br 34a_100012357577_100000731001 [0,1,0,0,0,1|2,0,0]=4 11091 B15R1.871 NC(=O)CCOCCc1ccc(nc1)Cl 34a_100009880866_100000731001 [0,1,0,0,0,1|2,0,0]=4 11092 B15R1.871 NC(=O)CCOCCc1ccc(nc1)Cl 7a_100009880866_100000744528 [0,1,0,0,0,1|2,0,0]=4 11093 B15R1.871 NC(=O)CCSCCc1ccc(cc1)Br 62a_100000744528_100011740612 [0,1,0,0,0,1|1,0,0]=3 11094 B15R1.871 NC(=O)CCSCCc1ccc(cc1)Br 62a_100011740612_100000744528 [0,1,0,0,0,1|1,0,0]=3 11095 B15R1.871 NC(=O)CCSCCc1ccc(cc1)Cl 62a_100000744528_100011713675 [0,1,0,0,0,1|1,0,0]=3 11096 B15R1.871 NC(=O)CCSCCc1ccc(cc1)Cl 62a_100011713675_100000744528 [0,1,0,0,0,1|1,0,0]=3 11097 B15R1.871 NC(=O)CCSCCc1ccc(cc1)F 62a_100000744528_100011217392 [0,1,0,0,0,1|1,0,0]=3 11098 B15R1.871 NC(=O)CCSCCc1ccc(cc1)F 62a_100011217392_100000744528 [0,1,0,0,0,1|1,0,0]=3 11099 B15R1.871 NC(=O)CCSCCc1ccc(cc1)O 62a_100000744528_100009816426 [0,1,0,0,0,1|1,0,0]=3 11100 B15R1.871 NC(=O)CCSCCc1ccc(cc1)O 62a_100009816426_100000744528 [0,1,0,0,0,1|1,0,0]=3 11101 B15R1.871 NC(=O)CNCCCc1ccc(cc1)Br 2230a_100000711301_100011713682 [0,1,0,0,0,1|1,0,0]=3 11102 B15R1.871 NC(=O)CNCCCc1ccc(cc1)Br 2230a_100011297623_100000747473 [0,1,0,0,0,1|1,0,0]=3 11103 B15R1.871 NC(=O)CNCCCc1ccc(cc1)Br 34a_100011297623_100000187820 [0,1,0,0,0,1|1,0,0]=3 11104 B15R1.871 NC(=O)CNCCCc1ccc(cc1)Cl 2230a_100000711301_100000759440 [0,1,0,0,0,1|1,0,0]=3 11105 B15R1.871 NC(=O)CNCCCc1ccc(cc1)Cl 2230a_100000748451_100000747473 [0,1,0,0,0,1|1,0,0]=3 11106 B15R1.871 NC(=O)CNCCCc1ccc(cc1)Cl 34a_100000748451_100000187820 [0,1,0,0,0,1|1,0,0]=3 11107 B15R1.871 NC(=O)CNCCCc1ccc(cc1)F 2230a_100000711301_200011713563 [0,1,0,0,0,1|1,0,0]=3 11108 B15R1.871 NC(=O)CNCCCc1ccc(cc1)F 2230a_100025745824_100000747473 [0,1,0,0,0,1|1,0,0]=3 11109 B15R1.871 NC(=O)CNCCCc1ccc(cc1)F 34a_100025745824_100000187820 [0,1,0,0,0,1|1,0,0]=3 11110 B15R1.871 NC(=O)CNCCOc1ccc(cc1)Br 2230a_100000711301_100000183278 [0,1,0,0,0,1|2,0,0]=4 11111 B15R1.871 NC(=O)CNCCOc1ccc(cc1)Br 2230a_100000746992_100000747473 [0,1,0,0,0,1|2,0,0]=4 11112 B15R1.871 NC(=O)CNCCOc1ccc(cc1)Br 34a_100000746992_100000187820 [0,1,0,0,0,1|2,0,0]=4 11113 B15R1.871 NC(=O)CNCCOc1ccc(cc1)Cl 2230a_100000697975_100000747473 [0,1,0,0,0,1|2,0,0]=4 11114 B15R1.871 NC(=O)CNCCOc1ccc(cc1)Cl 2230a_100000711301_100000184122 [0,1,0,0,0,1|2,0,0]=4 11115 B15R1.871 NC(=O)CNCCOc1ccc(cc1)Cl 34a_100000697975_100000187820 [0,1,0,0,0,1|2,0,0]=4 11116 B15R1.871 NC(=O)CNCCOc1ccc(cc1)F 2230a_100000711301_100000184936 [0,1,0,0,0,1|2,0,0]=4 11117 B15R1.871 NC(=O)CNCCOc1ccc(cc1)F 2230a_100000737420_100000747473 [0,1,0,0,0,1|2,0,0]=4 11118 B15R1.871 NC(=O)CNCCOc1ccc(cc1)F 34a_100000737420_100000187820 [0,1,0,0,0,1|2,0,0]=4 11119 B15R1.871 NC(=O)CNCCSc1ccc(cc1)Br 2230a_100000184645_100000747473 [0,1,0,0,0,1|2,0,0]=4 11120 B15R1.871 NC(=O)CNCCSc1ccc(cc1)Cl 2230a_100000174974_100000747473 [0,1,0,0,0,1|2,0,0]=4 11121 B15R1.871 NC(=O)COCCCc1ccc(cc1)Br 34a_100011709247_100000187820 [0,1,0,0,0,1|1,0,0]=3 11122 B15R1.871 NC(=O)COCCCc1ccc(cc1)Br 7a_100011709247_100000187820 [0,1,0,0,0,1|1,0,0]=3 11123 B15R1.871 NC(=O)COCCCc1ccc(cc1)Cl 34a_100011217485_100000187820 [0,1,0,0,0,1|1,0,0]=3 11124 B15R1.871 NC(=O)COCCCc1ccc(cc1)Cl 7a_100011217485_100000187820 [0,1,0,0,0,1|1,0,0]=3 11125 B15R1.871 NC(=O)COCCCc1ccc(cc1)F 34a_100000757351_100000187820 [0,1,0,0,0,1|1,0,0]=3 11126 B15R1.871 NC(=O)COCCCc1ccc(cc1)F 7a_100000757351_100000187820 [0,1,0,0,0,1|1,0,0]=3 11127 B15R1.871 NC(=O)COCCNc1ccc(cc1)Br 2230a_100000210018_100000076697 [0,1,0,0,0,1|2,0,0]=4 11128 B15R1.871 NC(=O)COCCNc1ccc(cc1)Br 34a_100000210018_100000076697 [0,1,0,0,0,1|2,0,0]=4 11129 B15R1.871 NC(=O)COCCNc1ccc(cc1)Cl 2230a_100000210052_100000076697 [0,1,0,0,0,1|2,0,0]=4 11130 B15R1.871 NC(=O)COCCNc1ccc(cc1)Cl 34a_100000210052_100000076697 [0,1,0,0,0,1|2,0,0]=4 11131 B15R1.871 NC(=O)COCCNc1ccc(cc1)F 34a_100000185862_100000076697 [0,1,0,0,0,1|2,0,0]=4 11132 B15R1.871 NC(=O)COCCNc1ccc(cc1)I 34a_100000185761_100000076697 [0,1,0,0,0,1|2,0,0]=4 11133 B15R1.871 NC(=O)COCCNc1ccc(cc1)O 34a_100000185829_100000076697 [0,1,0,0,0,1|2,0,0]=4 11134 B15R1.871 NC(=O)COCCOc1ccc(cc1)Br 34a_100000185759_100000076697 [0,1,0,0,0,1|2,0,0]=4 11135 B15R1.871 NC(=O)COCCOc1ccc(cc1)Br 34a_100000686261_100000187820 [0,1,0,0,0,1|2,0,0]=4 11136 B15R1.871 NC(=O)COCCOc1ccc(cc1)Br 7a_100000185759_100000076697 [0,1,0,0,0,1|2,0,0]=4 11137 B15R1.871 NC(=O)COCCOc1ccc(cc1)Br 7a_100000686261_100000187820 [0,1,0,0,0,1|2,0,0]=4 11138 B15R1.871 NC(=O)COCCOc1ccc(cc1)Cl 34a_100000210216_100000076697 [0,1,0,0,0,1|2,0,0]=4 11139 B15R1.871 NC(=O)COCCOc1ccc(cc1)Cl 34a_100000237962_100000187820 [0,1,0,0,0,1|2,0,0]=4 11140 B15R1.871 NC(=O)COCCOc1ccc(cc1)Cl 7a_100000210216_100000076697 [0,1,0,0,0,1|2,0,0]=4 11141 B15R1.871 NC(=O)COCCOc1ccc(cc1)Cl 7a_100000237962_100000187820 [0,1,0,0,0,1|2,0,0]=4 11142 B15R1.871 NC(=O)COCCOc1ccc(cc1)F 34a_100000210339_100000076697 [0,1,0,0,0,1|2,0,0]=4 11143 B15R1.871 NC(=O)COCCOc1ccc(cc1)I 34a_100000212066_100000076697 [0,1,0,0,0,1|2,0,0]=4 11144 B15R1.871 NC(=O)COCCOc1ccc(cc1)I 7a_100000212066_100000076697 [0,1,0,0,0,1|2,0,0]=4 11145 B15R1.871 NC(=O)COCCOc1ccc(cc1)N 34a_100000185829_100000076697 [0,1,0,0,0,1|2,0,0]=4 11146 B15R1.871 NC(=O)COCCOc1ccc(cc1)N 34a_100000754363_100000187820 [0,1,0,0,0,1|2,0,0]=4 11147 B15R1.871 NC(=O)COCCSc1ccc(cc1)Br 62a_100000076697_100000752885 [0,1,0,0,0,1|2,0,0]=4 11148 B15R1.871 NC(=O)COCCSc1ccc(cc1)Br 62a_100000752885_100000076697 [0,1,0,0,0,1|2,0,0]=4 11149 B15R1.871 NC(=O)COCCSc1ccc(cc1)Cl 34a_100000230527_100000187820 [0,1,0,0,0,1|2,0,0]=4 11150 B15R1.871 NC(=O)COCCSc1ccc(cc1)Cl 62a_100000076697_100000755918 [0,1,0,0,0,1|2,0,0]=4 11151 B15R1.871 NC(=O)COCCSc1ccc(cc1)Cl 62a_100000755918_100000076697 [0,1,0,0,0,1|2,0,0]=4 11152 B15R1.871 NC(=O)COCCSc1ccc(cc1)Cl 7a_100000230527_100000187820 [0,1,0,0,0,1|2,0,0]=4 11153 B15R1.871 NC(=O)COCCSc1ccc(cc1)F 34a_200000230679_100000187820 [0,1,0,0,0,1|2,0,0]=4 11154 B15R1.871 NC(=O)COCCSc1ccc(cc1)F 62a_100000076697_100000211213 [0,1,0,0,0,1|2,0,0]=4 11155 B15R1.871 NC(=O)COCCSc1ccc(cc1)F 62a_100000211213_100000076697 [0,1,0,0,0,1|2,0,0]=4 11156 B15R1.871 NC(=O)COCCSc1ccc(cc1)F 7a_200000230679_100000187820 [0,1,0,0,0,1|2,0,0]=4 11157 B15R1.871 NC(=O)COCCSc1ccc(cc1)N 62a_100000076697_100000185761 [0,1,0,0,0,1|2,0,0]=4 11158 B15R1.871 NC(=O)COCCSc1ccc(cc1)N 62a_100000185761_100000076697 [0,1,0,0,0,1|2,0,0]=4 11159 B15R1.871 NC(=O)COCCSc1ccc(cc1)O 62a_100000076697_100000185759 [0,1,0,0,0,1|2,0,0]=4 11160 B15R1.871 NC(=O)CSCCCc1ccc(cc1)Br 62a_100000747473_100011713682 [0,1,0,0,0,1|1,0,0]=3 11161 B15R1.871 NC(=O)CSCCCc1ccc(cc1)Br 62a_100011713682_100000747473 [0,1,0,0,0,1|1,0,0]=3 11162 B15R1.871 NC(=O)CSCCCc1ccc(cc1)Cl 62a_100000747473_100000759440 [0,1,0,0,0,1|1,0,0]=3 11163 B15R1.871 NC(=O)CSCCCc1ccc(cc1)Cl 62a_100000759440_100000747473 [0,1,0,0,0,1|1,0,0]=3 11164 B15R1.871 NC(=O)CSCCCc1ccc(cc1)F 62a_100000747473_200011713563 [0,1,0,0,0,1|1,0,0]=3 11165 B15R1.871 NC(=O)CSCCCc1ccc(cc1)F 62a_200011713563_100000747473 [0,1,0,0,0,1|1,0,0]=3 11166 B15R1.871 NC(=O)CSCCOc1ccc(cc1)Br 62a_100000183278_100000747473 [0,1,0,0,0,1|2,0,0]=4 11167 B15R1.871 NC(=O)CSCCOc1ccc(cc1)Br 62a_100000747473_100000183278 [0,1,0,0,0,1|2,0,0]=4 11168 B15R1.871 NC(=O)CSCCOc1ccc(cc1)Cl 62a_100000184122_100000747473 [0,1,0,0,0,1|2,0,0]=4 11169 B15R1.871 NC(=O)CSCCOc1ccc(cc1)Cl 62a_100000747473_100000184122 [0,1,0,0,0,1|2,0,0]=4 11170 B15R1.871 NC(=O)CSCCOc1ccc(cc1)F 62a_100000184936_100000747473 [0,1,0,0,0,1|2,0,0]=4 11171 B15R1.871 NC(=O)CSCCOc1ccc(cc1)F 62a_100000747473_100000184936 [0,1,0,0,0,1|2,0,0]=4 11172 B15R1.871 NC(=O)NCCNCc1ccc(cc1)Br 207a_100020590234_100000186029 [0,1,0,0,0,1|2,0,0]=4 11173 B15R1.871 NC(=O)NCCNCc1ccc(cc1)Br 2230a_100000174875_200000034859 [0,1,0,0,0,1|2,0,0]=4 11174 B15R1.871 NC(=O)NCCNCc1ccc(cc1)Br 34a_100020590234_100000189115 [0,1,0,0,0,1|2,0,0]=4 11175 B15R1.871 NC(=O)NCCNCc1ccc(cc1)Cl 207a_100020590234_100000189385 [0,1,0,0,0,1|2,0,0]=4 11176 B15R1.871 NC(=O)NCCNCc1ccc(cc1)Cl 2230a_100000174871_200000034859 [0,1,0,0,0,1|2,0,0]=4 11177 B15R1.871 NC(=O)NCCNCc1ccc(cc1)Cl 34a_100020590234_100000694040 [0,1,0,0,0,1|2,0,0]=4 11178 B15R1.871 NC(=O)NCCNCc1ccc(cc1)F 207a_100020590234_100000210084 [0,1,0,0,0,1|2,0,0]=4 11179 B15R1.871 NC(=O)NCCNCc1ccc(cc1)F 2230a_100000174882_200000034859 [0,1,0,0,0,1|2,0,0]=4 11180 B15R1.871 NC(=O)NCCNCc1ccc(cc1)F 34a_100020590234_100000198546 [0,1,0,0,0,1|2,0,0]=4 11181 B15R1.871 NC(=O)NCCNCc1ccc(cc1)I 207a_100020590234_100000188517 [0,1,0,0,0,1|2,0,0]=4 11182 B15R1.871 NC(=O)NCCNCc1ccc(cc1)I 2230a_100016989417_200000034859 [0,1,0,0,0,1|2,0,0]=4 11183 B15R1.871 NC(=O)NCCNCc1ccc(cc1)I 34a_100020590234_100000189116 [0,1,0,0,0,1|2,0,0]=4 11184 B15R1.871 NC(=O)NCCOCc1ccc(cc1)Br 34a_100000181757_100000189115 [0,1,0,0,0,1|2,0,0]=4 11185 B15R1.871 NC(=O)NCCOCc1ccc(cc1)Cl 34a_100000181757_100000694040 [0,1,0,0,0,1|2,0,0]=4 11186 B15R1.871 NC(=O)NCCOCc1ccc(cc1)Cl 7a_100000211118_200000034859 [0,1,0,0,0,1|2,0,0]=4 11187 B15R1.871 NC(=O)NCCOCc1ccc(cc1)F 34a_100000181757_100000198546 [0,1,0,0,0,1|2,0,0]=4 11188 B15R1.871 NC(=O)NCCOCc1ccc(cc1)F 7a_100000210977_200000034859 [0,1,0,0,0,1|2,0,0]=4 11189 B15R1.871 NC(=O)NCCOCc1ccc(cc1)I 34a_100000181757_100000189116 [0,1,0,0,0,1|2,0,0]=4 11190 B15R1.871 NC(=O)NCCOCc1ccc(cc1)I 7a_100000690907_200000034859 [0,1,0,0,0,1|2,0,0]=4 11191 B15R1.871 NC(=O)NCCSCc1ccc(cc1)Br 62a_100000189115_200000034859 [0,1,0,0,0,1|2,0,0]=4 11192 B15R1.871 NC(=O)NCCSCc1ccc(cc1)Br 62a_200000034859_100000189115 [0,1,0,0,0,1|2,0,0]=4 11193 B15R1.871 NC(=O)NCCSCc1ccc(cc1)Cl 62a_100000187161_200000034859 [0,1,0,0,0,1|2,0,0]=4 11194 B15R1.871 NC(=O)NCCSCc1ccc(cc1)Cl 62a_200000034859_100000187161 [0,1,0,0,0,1|2,0,0]=4 11195 B15R1.871 NC(=O)NCCSCc1ccc(cc1)F 62a_100000198546_200000034859 [0,1,0,0,0,1|2,0,0]=4 11196 B15R1.871 NC(=O)NCCSCc1ccc(cc1)F 62a_200000034859_100000187164 [0,1,0,0,0,1|2,0,0]=4 11197 B15R1.871 NC(=O)NCCSCc1ccc(cc1)I 62a_100000189116_200000034859 [0,1,0,0,0,1|2,0,0]=4 11198 B15R1.871 NC(=O)NCCSCc1ccc(cc1)I 62a_200000034859_100000189116 [0,1,0,0,0,1|2,0,0]=4 11199 B15R1.871 NC(=O)OCCNCc1ccc(cc1)Br 34a_100000174875_200011214921 [0,1,0,0,0,1|2,0,0]=4 11200 B15R1.871 NC(=O)OCCNCc1ccc(cc1)Cl 34a_100000174871_200011214921 [0,1,0,0,0,1|2,0,0]=4 11201 B15R1.871 NC(=O)OCCNCc1ccc(cc1)F 34a_100000174882_200011214921 [0,1,0,0,0,1|2,0,0]=4 11202 B15R1.871 NC(=O)OCCNCc1ccc(cc1)I 34a_100016989417_200011214921 [0,1,0,0,0,1|2,0,0]=4 11203 B15R1.871 NC(=O)OCCNCc1ccc(cc1)O 34a_100000185549_200011214921 [0,1,0,0,0,1|2,0,0]=4 11204 B15R1.871 NC(=O)OCCOCc1ccc(cc1)Br 34a_100000695286_200011214921 [0,1,0,0,0,1|2,0,0]=4 11205 B15R1.871 NC(=O)OCCOCc1ccc(cc1)Br 7a_100000766696_100011217064 [0,1,0,0,0,1|2,0,0]=4 11206 B15R1.871 NC(=O)OCCOCc1ccc(cc1)Cl 34a_100000211118_200011214921 [0,1,0,0,0,1|2,0,0]=4 11207 B15R1.871 NC(=O)OCCOCc1ccc(cc1)Cl 7a_100000211118_200011214921 [0,1,0,0,0,1|2,0,0]=4 11208 B15R1.871 NC(=O)OCCOCc1ccc(cc1)Cl 7a_100000766696_100000187161 [0,1,0,0,0,1|2,0,0]=4 11209 B15R1.871 NC(=O)OCCOCc1ccc(cc1)F 34a_100000210977_200011214921 [0,1,0,0,0,1|2,0,0]=4 11210 B15R1.871 NC(=O)OCCOCc1ccc(cc1)F 7a_100000210977_200011214921 [0,1,0,0,0,1|2,0,0]=4 11211 B15R1.871 NC(=O)OCCOCc1ccc(cc1)F 7a_100000766696_100000198546 [0,1,0,0,0,1|2,0,0]=4 11212 B15R1.871 NC(=O)OCCOCc1ccc(cc1)I 34a_100000690907_200011214921 [0,1,0,0,0,1|2,0,0]=4 11213 B15R1.871 NC(=O)OCCOCc1ccc(cc1)I 7a_100000690907_200011214921 [0,1,0,0,0,1|2,0,0]=4 11214 B15R1.871 NC(=O)OCCOCc1ccc(cc1)I 7a_100000766696_100000189116 [0,1,0,0,0,1|2,0,0]=4 11215 B15R1.871 NC(=O)OCCOCc1ccc(cc1)N 34a_100011215238_200011214921 [0,1,0,0,0,1|2,0,0]=4 11216 B15R1.871 NC(=O)OCCSCc1ccc(cc1)Br 62a_100000189115_200011214921 [0,1,0,0,0,1|2,0,0]=4 11217 B15R1.871 NC(=O)OCCSCc1ccc(cc1)Br 62a_200011214921_100000189115 [0,1,0,0,0,1|2,0,0]=4 11218 B15R1.871 NC(=O)OCCSCc1ccc(cc1)Cl 62a_100000187161_200011214921 [0,1,0,0,0,1|2,0,0]=4 11219 B15R1.871 NC(=O)OCCSCc1ccc(cc1)Cl 62a_200011214921_100000187161 [0,1,0,0,0,1|2,0,0]=4 11220 B15R1.871 NC(=O)OCCSCc1ccc(cc1)F 62a_100000198546_200011214921 [0,1,0,0,0,1|2,0,0]=4 11221 B15R1.871 NC(=O)OCCSCc1ccc(cc1)F 62a_200011214921_100000187164 [0,1,0,0,0,1|2,0,0]=4 11222 B15R1.871 NC(=O)OCCSCc1ccc(cc1)I 62a_100000189116_200011214921 [0,1,0,0,0,1|2,0,0]=4 11223 B15R1.871 NC(=O)OCCSCc1ccc(cc1)I 62a_200011214921_100000189116 [0,1,0,0,0,1|2,0,0]=4 11224 B15R1.871 Nc1ccc(cc1)OCCCCB(O)O 34a_100000185829_200009817182 [0,1,0,0,0,1|1,0,1]=4 11225 B15R1.871 Nc1ccc(cc1)OCCOCC(=O)[O-] 34a_100000754363_100020667443 [0,1,0,0,0,1|1,0,1]=4 11226 B15R1.871 Nc1ccc(cc1)SCCCCB(O)O 62a_100000185761_200009817182 [0,1,0,0,0,1|1,0,1]=4 11227 B15R1.871 Nc1ccc(cc1)SCCCCB(O)O 62a_200009817182_100000185761 [0,1,0,0,0,1|1,0,1]=4 11228 B15R1.871 O=C(O)CNCC#Cc1ccc(cc1)Br 269956a_100016091260_100010706785 [0,1,0,0,0,1|0,0,2]=4 11229 B15R1.871 O=C(O)CNCC#Cc1ccc(cc1)F 269956a_100016091260_100010402171 [0,1,0,0,0,1|0,0,2]=4 11230 B15R1.871 O=C(O)CNCCCc1ccc(cc1)Br 269956a_100016091260_100011713682 [0,1,0,0,0,1|0,0,0]=2 11231 B15R1.871 O=C(O)CNCCCc1ccc(cc1)Cl 269956a_100016091260_100000759440 [0,1,0,0,0,1|0,0,0]=2 11232 B15R1.871 O=C(O)CNCCCc1ccc(cc1)F 269956a_100016091260_200011713563 [0,1,0,0,0,1|0,0,0]=2 11233 B15R1.871 O=C(O)CNCCOc1ccc(cc1)Br 269956a_100016091260_100000183278 [0,1,0,0,0,1|1,0,0]=3 11234 B15R1.871 O=C(O)CNCCOc1ccc(cc1)Cl 269956a_100016091260_100000184122 [0,1,0,0,0,1|1,0,0]=3 11235 B15R1.871 O=C(O)CNCCOc1ccc(cc1)F 269956a_100016091260_100000184936 [0,1,0,0,0,1|1,0,0]=3 11236 B15R1.871 O=C(O)CONCCc1ccc(cc1)Br 269956a_100000106656_100011740612 [0,1,0,0,0,1|1,0,0]=3 11237 B15R1.871 O=C(O)CONCCc1ccc(cc1)Cl 269956a_100000106656_100011713675 [0,1,0,0,0,1|1,0,0]=3 11238 B15R1.871 O=C(O)CONCCc1ccc(cc1)F 269956a_100000106656_100011217392 [0,1,0,0,0,1|1,0,0]=3 11239 B15R1.871 O=C(O)CONCCc1ccc(cc1)O 269956a_100000106656_100009816426 [0,1,0,0,0,1|1,0,0]=3 11240 B15R1.871 O=C([O-])CNCCCc1ccc(cc1)Br 34a_100011297623_100020667443 [0,1,0,0,0,1|0,0,1]=3 11241 B15R1.871 O=C([O-])CNCCCc1ccc(cc1)Cl 34a_100000748451_100020667443 [0,1,0,0,0,1|0,0,1]=3 11242 B15R1.871 O=C([O-])CNCCCc1ccc(cc1)F 34a_100025745824_100020667443 [0,1,0,0,0,1|0,0,1]=3 11243 B15R1.871 O=C([O-])CNCCOc1ccc(cc1)Br 34a_100000746992_100020667443 [0,1,0,0,0,1|1,0,1]=4 11244 B15R1.871 O=C([O-])CNCCOc1ccc(cc1)Cl 34a_100000697975_100020667443 [0,1,0,0,0,1|1,0,1]=4 11245 B15R1.871 O=C([O-])CNCCOc1ccc(cc1)F 34a_100000737420_100020667443 [0,1,0,0,0,1|1,0,1]=4 11246 B15R1.871 O=C([O-])COCCCc1ccc(cc1)Br 34a_100011709247_100020667443 [0,1,0,0,0,1|0,0,1]=3 11247 B15R1.871 O=C([O-])COCCCc1ccc(cc1)Cl 34a_100011217485_100020667443 [0,1,0,0,0,1|0,0,1]=3 11248 B15R1.871 O=C([O-])COCCCc1ccc(cc1)F 34a_100000757351_100020667443 [0,1,0,0,0,1|0,0,1]=3 11249 B15R1.871 O=C([O-])COCCOc1ccc(cc1)Br 34a_100000686261_100020667443 [0,1,0,0,0,1|1,0,1]=4 11250 B15R1.871 O=C([O-])COCCOc1ccc(cc1)Cl 34a_100000237962_100020667443 [0,1,0,0,0,1|1,0,1]=4 11251 B15R1.871 O=C([O-])COCCSc1ccc(cc1)Cl 34a_100000230527_100020667443 [0,1,0,0,0,1|1,0,1]=4 11252 B15R1.871 O=C([O-])COCCSc1ccc(cc1)F 34a_200000230679_100020667443 [0,1,0,0,0,1|1,0,1]=4 11253 B15R1.871 O=C([O-])CSCCCc1ccc(cc1)Br 62a_100011713682_100020667443 [0,1,0,0,0,1|0,0,1]=3 11254 B15R1.871 O=C([O-])CSCCCc1ccc(cc1)Br 62a_100020667443_100011713682 [0,1,0,0,0,1|0,0,1]=3 11255 B15R1.871 O=C([O-])CSCCCc1ccc(cc1)Cl 62a_100000759440_100020667443 [0,1,0,0,0,1|0,0,1]=3 11256 B15R1.871 O=C([O-])CSCCCc1ccc(cc1)Cl 62a_100020667443_100000759440 [0,1,0,0,0,1|0,0,1]=3 11257 B15R1.871 O=C([O-])CSCCCc1ccc(cc1)F 62a_100020667443_200011713563 [0,1,0,0,0,1|0,0,1]=3 11258 B15R1.871 O=C([O-])CSCCCc1ccc(cc1)F 62a_200011713563_100020667443 [0,1,0,0,0,1|0,0,1]=3 11259 B15R1.871 O=C([O-])CSCCOc1ccc(cc1)Br 62a_100000183278_100020667443 [0,1,0,0,0,1|1,0,1]=4 11260 B15R1.871 O=C([O-])CSCCOc1ccc(cc1)Br 62a_100020667443_100000183278 [0,1,0,0,0,1|1,0,1]=4 11261 B15R1.871 O=C([O-])CSCCOc1ccc(cc1)Cl 62a_100000184122_100020667443 [0,1,0,0,0,1|1,0,1]=4 11262 B15R1.871 O=C([O-])CSCCOc1ccc(cc1)Cl 62a_100020667443_100000184122 [0,1,0,0,0,1|1,0,1]=4 11263 B15R1.871 O=C([O-])CSCCOc1ccc(cc1)F 62a_100000184936_100020667443 [0,1,0,0,0,1|1,0,1]=4 11264 B15R1.871 O=C([O-])CSCCOc1ccc(cc1)F 62a_100020667443_100000184936 [0,1,0,0,0,1|1,0,1]=4 11265 B15R1.871 O=[N+]([O-])CCCOCc1ccc(cc1)Br 34a_200000037920_100000189115 [0,1,0,0,0,1|1,0,1]=4 11266 B15R1.871 O=[N+]([O-])CCCOCc1ccc(cc1)Cl 34a_200000037920_100000694040 [0,1,0,0,0,1|1,0,1]=4 11267 B15R1.871 O=[N+]([O-])CCCOCc1ccc(cc1)F 34a_200000037920_100000198546 [0,1,0,0,0,1|1,0,1]=4 11268 B15R1.871 O=[N+]([O-])CCCOCc1ccc(cc1)I 34a_200000037920_100000189116 [0,1,0,0,0,1|1,0,1]=4 11269 B15R1.871 O=[N+]([O-])CNCCCc1ccc(cc1)Br 34a_100011297623_100000761209 [0,1,0,0,0,1|1,0,1]=4 11270 B15R1.871 O=[N+]([O-])CNCCCc1ccc(cc1)Cl 34a_100000748451_100000761209 [0,1,0,0,0,1|1,0,1]=4 11271 B15R1.871 O=[N+]([O-])CNCCCc1ccc(cc1)F 34a_100025745824_100000761209 [0,1,0,0,0,1|1,0,1]=4 11272 B15R1.871 O=[N+]([O-])COCCCc1ccc(cc1)Br 34a_100011709247_100000761209 [0,1,0,0,0,1|1,0,1]=4 11273 B15R1.871 O=[N+]([O-])COCCCc1ccc(cc1)Cl 34a_100011217485_100000761209 [0,1,0,0,0,1|1,0,1]=4 11274 B15R1.871 O=[N+]([O-])COCCCc1ccc(cc1)F 34a_100000757351_100000761209 [0,1,0,0,0,1|1,0,1]=4 11275 B15R1.871 O=[N+]([O-])CSCCCc1ccc(cc1)Br 62a_100011713682_100000761209 [0,1,0,0,0,1|1,0,1]=4 11276 B15R1.871 O=[N+]([O-])CSCCCc1ccc(cc1)Cl 62a_100000759440_100000761209 [0,1,0,0,0,1|1,0,1]=4 11277 B15R1.871 O=[N+]([O-])CSCCCc1ccc(cc1)F 62a_200011713563_100000761209 [0,1,0,0,0,1|1,0,1]=4 11278 B15R1.871 OB(O)CCCCNc1ccc(cc1)Br 2230a_100000210018_200009817182 [0,1,0,0,0,1|1,0,1]=4 11279 B15R1.871 OB(O)CCCCNc1ccc(cc1)Br 34a_100000210018_200009817182 [0,1,0,0,0,1|1,0,1]=4 11280 B15R1.871 OB(O)CCCCNc1ccc(cc1)Cl 2230a_100000210052_200009817182 [0,1,0,0,0,1|1,0,1]=4 11281 B15R1.871 OB(O)CCCCNc1ccc(cc1)Cl 34a_100000210052_200009817182 [0,1,0,0,0,1|1,0,1]=4 11282 B15R1.871 OB(O)CCCCNc1ccc(cc1)F 34a_100000185862_200009817182 [0,1,0,0,0,1|1,0,1]=4 11283 B15R1.871 OB(O)CCCCNc1ccc(cc1)I 34a_100000185761_200009817182 [0,1,0,0,0,1|1,0,1]=4 11284 B15R1.871 OB(O)CCCCNc1ccc(cc1)O 34a_100000185829_200009817182 [0,1,0,0,0,1|1,0,1]=4 11285 B15R1.871 OB(O)CCCCOc1ccc(cc1)Br 34a_100000185759_200009817182 [0,1,0,0,0,1|1,0,1]=4 11286 B15R1.871 OB(O)CCCCOc1ccc(cc1)Br 7a_100000185759_200009817182 [0,1,0,0,0,1|1,0,1]=4 11287 B15R1.871 OB(O)CCCCOc1ccc(cc1)Cl 34a_100000210216_200009817182 [0,1,0,0,0,1|1,0,1]=4 11288 B15R1.871 OB(O)CCCCOc1ccc(cc1)Cl 7a_100000210216_200009817182 [0,1,0,0,0,1|1,0,1]=4 11289 B15R1.871 OB(O)CCCCOc1ccc(cc1)F 34a_100000210339_200009817182 [0,1,0,0,0,1|1,0,1]=4 11290 B15R1.871 OB(O)CCCCOc1ccc(cc1)I 34a_100000212066_200009817182 [0,1,0,0,0,1|1,0,1]=4 11291 B15R1.871 OB(O)CCCCOc1ccc(cc1)I 7a_100000212066_200009817182 [0,1,0,0,0,1|1,0,1]=4 11292 B15R1.871 OB(O)CCCCSc1ccc(cc1)Br 62a_100000752885_200009817182 [0,1,0,0,0,1|1,0,1]=4 11293 B15R1.871 OB(O)CCCCSc1ccc(cc1)Br 62a_200009817182_100000752885 [0,1,0,0,0,1|1,0,1]=4 11294 B15R1.871 OB(O)CCCCSc1ccc(cc1)Cl 62a_100000755918_200009817182 [0,1,0,0,0,1|1,0,1]=4 11295 B15R1.871 OB(O)CCCCSc1ccc(cc1)Cl 62a_200009817182_100000755918 [0,1,0,0,0,1|1,0,1]=4 11296 B15R1.871 OB(O)CCCCSc1ccc(cc1)F 62a_100000211213_200009817182 [0,1,0,0,0,1|1,0,1]=4 11297 B15R1.871 OB(O)CCCCSc1ccc(cc1)F 62a_200009817182_100000211213 [0,1,0,0,0,1|1,0,1]=4 11298 B15R1.871 OB(O)CCCCSc1ccc(cc1)O 62a_200009817182_100000185759 [0,1,0,0,0,1|1,0,1]=4 11299 B15R1.871 [13CH3]C(=O)CCCCOc1ccc(cc1)Br 1458a_100000753589_200025704644 [0,1,0,0,0,1|1,0,0]=3 11300 B15R1.871 [13CH3]C(=O)CCCCOc1ccc(cc1)F 1458a_200011217909_200025704644 [0,1,0,0,0,1|1,0,0]=3 11301 B15R1.962 C#CC(=O)CCCCCc1ccccc1 1458a_100000211873_200011217138 [0,1,0,0,0,1|1,0,0]=3 11302 B15R1.962 C#CC(=O)CCCCOc1ccccc1 1458a_100000211873_100011215240 [0,1,0,0,0,1|1,0,0]=3 11303 B15R1.962 C#CC(=O)CCCOCc1ccccc1 1458a_100000211873_100011215529 [0,1,0,0,0,1|1,0,0]=3 11304 B15R1.962 C=C(C#N)CNCCCc1ccccc1 2230a_100000211184_100000694840 [0,1,0,0,0,1|2,0,0]=4 11305 B15R1.962 C=C(C#N)CNCCCc1ccccc1 34a_100000211184_100000694840 [0,1,0,0,0,1|2,0,0]=4 11306 B15R1.962 C=C(C#N)COCCCc1ccccc1 34a_100000210828_100000694840 [0,1,0,0,0,1|2,0,0]=4 11307 B15R1.962 C=C(C#N)CSCCCc1ccccc1 62a_100000211621_100000694840 [0,1,0,0,0,1|2,0,0]=4 11308 B15R1.962 C=CC(=O)CCCCCc1ccccc1 1458a_100000185746_200011217138 [0,1,0,0,0,1|1,0,0]=3 11309 B15R1.962 C=CC(=O)CCCCOc1ccccc1 1458a_100000185746_100011215240 [0,1,0,0,0,1|1,0,0]=3 11310 B15R1.962 C=CC(=O)CCCOCc1ccccc1 1458a_100000185746_100011215529 [0,1,0,0,0,1|1,0,0]=3 11311 B15R1.962 C=CC(=O)NCCCCc1ccccc1 1626a_100015280158_100000185746 [0,1,0,0,0,1|1,0,0]=3 11312 B15R1.962 C=CC(=O)NCCCCc1ccccc1 240690a_100015280158_200121576911 [0,1,0,0,0,1|1,0,0]=3 11313 B15R1.962 C=CC(=O)NCCCOc1ccccc1 1626a_100000216521_100000185746 [0,1,0,0,0,1|2,0,0]=4 11314 B15R1.962 C=CC(=O)NCCCOc1ccccc1 240690a_100000216521_200121576911 [0,1,0,0,0,1|2,0,0]=4 11315 B15R1.962 C=CC(=O)NCCCSc1ccccc1 240690a_100000184639_200121576911 [0,1,0,0,0,1|2,0,0]=4 11316 B15R1.962 C=CC(=O)NCCNCc1ccccc1 207a_114873766552_100015611070 [0,1,0,0,0,1|2,0,0]=4 11317 B15R1.962 C=CC(=O)NCCNCc1ccccc1 2230a_114873766552_100015291786 [0,1,0,0,0,1|2,0,0]=4 11318 B15R1.962 C=CC(=O)NCCOCc1ccccc1 1626a_100000753106_100000185746 [0,1,0,0,0,1|2,0,0]=4 11319 B15R1.962 C=CC(=O)NCCOCc1ccccc1 240690a_100000753106_200121576911 [0,1,0,0,0,1|2,0,0]=4 11320 B15R1.962 C=CC(=O)NCCOCc1ccccc1 34a_100011304386_100015291786 [0,1,0,0,0,1|2,0,0]=4 11321 B15R1.962 C=CC(=O)NCCSCc1ccccc1 240690a_100000189534_200121576911 [0,1,0,0,0,1|2,0,0]=4 11322 B15R1.962 C=CC(=O)OCCNCc1ccccc1 2230a_100015324214_100009813456 [0,1,0,0,0,1|2,0,0]=4 11323 B15R1.962 C=CC(=O)OCCNCc1ccccc1 34a_100015324214_100009813456 [0,1,0,0,0,1|2,0,0]=4 11324 B15R1.962 C=CC(=O)OCCOCc1ccccc1 34a_100000210790_100009813456 [0,1,0,0,0,1|2,0,0]=4 11325 B15R1.962 C=CC(=O)OCCOCc1ccccc1 7a_100000210790_100009813456 [0,1,0,0,0,1|2,0,0]=4 11326 B15R1.962 C=CC(=O)OCCSCc1ccccc1 62a_100000211182_100009813456 [0,1,0,0,0,1|2,0,0]=4 11327 B15R1.962 C=CC(=O)OCCSCc1ccccc1 62a_100009813456_100015291786 [0,1,0,0,0,1|2,0,0]=4 11328 B15R1.962 C=CC(O)CNCCCc1ccccc1 2230a_100000211184_100000730141 [0,1,0,0,0,1|1,0,1]=4 11329 B15R1.962 C=CC(O)CNCCCc1ccccc1 34a_100000211184_100000730141 [0,1,0,0,0,1|1,0,1]=4 11330 B15R1.962 C=CC(O)COCCCc1ccccc1 34a_100000210828_100000730141 [0,1,0,0,0,1|1,0,1]=4 11331 B15R1.962 C=CC(O)COCCCc1ccccc1 7a_100000210828_100000730141 [0,1,0,0,0,1|1,0,1]=4 11332 B15R1.962 C=CC(O)CSCCCc1ccccc1 62a_100000211621_100000730141 [0,1,0,0,0,1|1,0,1]=4 11333 B15R1.962 C=CC(O)CSCCCc1ccccc1 62a_100000730141_100000211621 [0,1,0,0,0,1|1,0,1]=4 11334 B15R1.962 CC(CO)CCNCCc1ccccc1 2230a_106354213184_100000765856 [0,1,0,0,0,1|1,0,1]=4 11335 B15R1.962 CC(CO)CCNCCc1ccccc1 34a_106354213184_100000765856 [0,1,0,0,0,1|1,0,1]=4 11336 B15R1.962 CC(CO)CNCCCc1ccccc1 34a_100000744482_100000211621 [0,1,0,0,0,1|1,0,1]=4 11337 B15R1.962 CC(CO)NCCCCc1ccccc1 2230a_100015280158_100012180447 [0,1,0,0,0,1|1,0,1]=4 11338 B15R1.962 CC(CO)NCCCCc1ccccc1 34a_100015280158_100012180447 [0,1,0,0,0,1|1,0,1]=4 11339 B15R1.962 CC(CO)OCCCCc1ccccc1 34a_100000703073_100012180447 [0,1,0,0,0,1|1,0,1]=4 11340 B15R1.962 CC(CO)OCCCCc1ccccc1 7a_100000703073_100012180447 [0,1,0,0,0,1|1,0,1]=4 11341 B15R1.962 CC(CO)SCCCCc1ccccc1 62a_100012180447_100000701786 [0,1,0,0,0,1|1,0,1]=4 11342 B15R1.962 CCC(=O)CCCCCc1ccccc1 1458a_100000210414_200011217138 [0,1,0,0,0,1|1,0,0]=3 11343 B15R1.962 CCC(=O)CCCCCc1ccccc1 1458a_100011216832_100000210202 [0,1,0,0,0,1|1,0,0]=3 11344 B15R1.962 CCC(=O)CCCCOc1ccccc1 1458a_100000210414_100011215240 [0,1,0,0,0,1|1,0,0]=3 11345 B15R1.962 CCC(=O)CCCCOc1ccccc1 1458a_200011216290_100000210202 [0,1,0,0,0,1|1,0,0]=3 11346 B15R1.962 CCC(=O)CCCOCc1ccccc1 1458a_100000210414_100011215529 [0,1,0,0,0,1|1,0,0]=3 11347 B15R1.962 CCC(=O)CCCOCc1ccccc1 1458a_100000748059_100000210202 [0,1,0,0,0,1|1,0,0]=3 11348 B15R1.962 CCC(=O)COCCCc1ccccc1 34a_100000725409_100000211621 [0,1,0,0,0,1|1,0,0]=3 11349 B15R1.962 CCC(=O)COCCCc1ccccc1 7a_100000210828_100000747405 [0,1,0,0,0,1|1,0,0]=3 11350 B15R1.962 CCC(=O)COCCOc1ccccc1 34a_100000725409_100000184471 [0,1,0,0,0,1|2,0,0]=4 11351 B15R1.962 CCC(=O)COCCOc1ccccc1 7a_100000210260_100000747405 [0,1,0,0,0,1|2,0,0]=4 11352 B15R1.962 CCC(=O)COCCSc1ccccc1 34a_100000725409_100000246102 [0,1,0,0,0,1|2,0,0]=4 11353 B15R1.962 CCC(=O)COCCSc1ccccc1 7a_100000230494_100000747405 [0,1,0,0,0,1|2,0,0]=4 11354 B15R1.962 CCC(=O)COCOCc1ccccc1 34a_100000725409_100000763385 [0,1,0,0,0,1|2,0,0]=4 11355 B15R1.962 CCC(=O)COCSCc1ccccc1 34a_100000725409_200011217039 [0,1,0,0,0,1|2,0,0]=4 11356 B15R1.962 CCC(=O)CSCCCc1ccccc1 62a_100000211621_100000747405 [0,1,0,0,0,1|1,0,0]=3 11357 B15R1.962 CCC(=O)CSCCCc1ccccc1 62a_100000747405_100000211621 [0,1,0,0,0,1|1,0,0]=3 11358 B15R1.962 CCC(=O)CSCCOc1ccccc1 1458a_200000150159_100000210202 [0,1,0,0,0,1|2,0,0]=4 11359 B15R1.962 CCC(=O)CSCCOc1ccccc1 62a_100000184471_100000747405 [0,1,0,0,0,1|2,0,0]=4 11360 B15R1.962 CCC(=O)CSCCOc1ccccc1 62a_100000747405_100000184471 [0,1,0,0,0,1|2,0,0]=4 11361 B15R1.962 CCC(=O)CSCCSc1ccccc1 62a_100000246102_100000747405 [0,1,0,0,0,1|2,0,0]=4 11362 B15R1.962 CCC(=O)CSCCSc1ccccc1 62a_100000747405_100000246102 [0,1,0,0,0,1|2,0,0]=4 11363 B15R1.962 CCC(=O)CSCOCc1ccccc1 62a_100000747405_100000763385 [0,1,0,0,0,1|2,0,0]=4 11364 B15R1.962 CCC(=O)CSCOCc1ccccc1 62a_100000763385_100000747405 [0,1,0,0,0,1|2,0,0]=4 11365 B15R1.962 CCC(=O)CSCSCc1ccccc1 62a_100000747405_200011217039 [0,1,0,0,0,1|2,0,0]=4 11366 B15R1.962 CCC(=O)CSCSCc1ccccc1 62a_200011217039_100000747405 [0,1,0,0,0,1|2,0,0]=4 11367 B15R1.962 CCC(=O)NCCCCc1ccccc1 11a_100015280158_100000210414 [0,1,0,0,0,1|1,0,0]=3 11368 B15R1.962 CCC(=O)NCCCCc1ccccc1 1626a_100015280158_100000210414 [0,1,0,0,0,1|1,0,0]=3 11369 B15R1.962 CCC(=O)NCCCCc1ccccc1 240690a_100015280158_100000210414 [0,1,0,0,0,1|1,0,0]=3 11370 B15R1.962 CCC(=O)NCCCCc1ccccc1 527a_100015280158_100000210414 [0,1,0,0,0,1|1,0,0]=3 11371 B15R1.962 CCC(=O)NCCCOc1ccccc1 11a_100000216521_100000210414 [0,1,0,0,0,1|2,0,0]=4 11372 B15R1.962 CCC(=O)NCCCOc1ccccc1 1626a_100000216521_100000210414 [0,1,0,0,0,1|2,0,0]=4 11373 B15R1.962 CCC(=O)NCCCOc1ccccc1 240690a_100000216521_100000210414 [0,1,0,0,0,1|2,0,0]=4 11374 B15R1.962 CCC(=O)NCCCOc1ccccc1 527a_100000216521_100000210414 [0,1,0,0,0,1|2,0,0]=4 11375 B15R1.962 CCC(=O)NCCCSc1ccccc1 11a_100000184639_100000210414 [0,1,0,0,0,1|2,0,0]=4 11376 B15R1.962 CCC(=O)NCCCSc1ccccc1 240690a_100000184639_100000210414 [0,1,0,0,0,1|2,0,0]=4 11377 B15R1.962 CCC(=O)NCCCSc1ccccc1 527a_100000184639_100000210414 [0,1,0,0,0,1|2,0,0]=4 11378 B15R1.962 CCC(=O)NCCNCc1ccccc1 207a_100132302217_100015611070 [0,1,0,0,0,1|2,0,0]=4 11379 B15R1.962 CCC(=O)NCCNCc1ccccc1 270004a_100132302217_100015611070 [0,1,0,0,0,1|2,0,0]=4 11380 B15R1.962 CCC(=O)NCCNCc1ccccc1 34a_100132302217_100015291786 [0,1,0,0,0,1|2,0,0]=4 11381 B15R1.962 CCC(=O)NCCOCc1ccccc1 11a_100000753106_100000210414 [0,1,0,0,0,1|2,0,0]=4 11382 B15R1.962 CCC(=O)NCCOCc1ccccc1 1626a_100000753106_100000210414 [0,1,0,0,0,1|2,0,0]=4 11383 B15R1.962 CCC(=O)NCCOCc1ccccc1 240690a_100000753106_100000210414 [0,1,0,0,0,1|2,0,0]=4 11384 B15R1.962 CCC(=O)NCCOCc1ccccc1 34a_200000158885_100015291786 [0,1,0,0,0,1|2,0,0]=4 11385 B15R1.962 CCC(=O)NCCOCc1ccccc1 527a_100000753106_100000210414 [0,1,0,0,0,1|2,0,0]=4 11386 B15R1.962 CCC(=O)NCCOCc1ccccc1 7a_200000158885_100000211182 [0,1,0,0,0,1|2,0,0]=4 11387 B15R1.962 CCC(=O)NCCSCc1ccccc1 11a_100000189534_100000210414 [0,1,0,0,0,1|2,0,0]=4 11388 B15R1.962 CCC(=O)NCCSCc1ccccc1 240690a_100000189534_100000210414 [0,1,0,0,0,1|2,0,0]=4 11389 B15R1.962 CCC(=O)NCCSCc1ccccc1 527a_100000189534_100000210414 [0,1,0,0,0,1|2,0,0]=4 11390 B15R1.962 CCC(=O)OCCOCc1ccccc1 7a_200000031056_100000211182 [0,1,0,0,0,1|2,0,0]=4 11391 B15R1.962 CCC(O)CNCCCc1ccccc1 2230a_100000211184_100011218378 [0,1,0,0,0,1|1,0,1]=4 11392 B15R1.962 CCC(O)CNCCCc1ccccc1 2230a_100011218483_100000211621 [0,1,0,0,0,1|1,0,1]=4 11393 B15R1.962 CCC(O)CNCCCc1ccccc1 34a_100000211184_100011218378 [0,1,0,0,0,1|1,0,1]=4 11394 B15R1.962 CCC(O)COCCCc1ccccc1 34a_100000210828_100011218378 [0,1,0,0,0,1|1,0,1]=4 11395 B15R1.962 CCC(O)COCCCc1ccccc1 7a_100000210828_100011218378 [0,1,0,0,0,1|1,0,1]=4 11396 B15R1.962 CCC(O)CSCCCc1ccccc1 62a_100000211621_100011218378 [0,1,0,0,0,1|1,0,1]=4 11397 B15R1.962 CCC(O)CSCCCc1ccccc1 62a_100011218378_100000211621 [0,1,0,0,0,1|1,0,1]=4 11398 B15R1.962 CNC(=O)CCCCCc1ccccc1 11a_106832991635_100011216832 [0,1,0,0,0,1|1,0,0]=3 11399 B15R1.962 CNC(=O)CCCCCc1ccccc1 1626a_100102657272_100011216832 [0,1,0,0,0,1|1,0,0]=3 11400 B15R1.962 CNC(=O)CCCCCc1ccccc1 240690a_100102657272_100011216832 [0,1,0,0,0,1|1,0,0]=3 11401 B15R1.962 CNC(=O)CCCCCc1ccccc1 527a_100102657272_100011216832 [0,1,0,0,0,1|1,0,0]=3 11402 B15R1.962 CNC(=O)CCCCOc1ccccc1 11a_106832991635_200011216290 [0,1,0,0,0,1|1,0,0]=3 11403 B15R1.962 CNC(=O)CCCCOc1ccccc1 1626a_100102657272_200011216290 [0,1,0,0,0,1|1,0,0]=3 11404 B15R1.962 CNC(=O)CCCCOc1ccccc1 240690a_100102657272_200011216290 [0,1,0,0,0,1|1,0,0]=3 11405 B15R1.962 CNC(=O)CCCCOc1ccccc1 527a_100102657272_200011216290 [0,1,0,0,0,1|1,0,0]=3 11406 B15R1.962 CNC(=O)CCCNCc1ccccc1 207a_100000740002_100015611070 [0,1,0,0,0,1|1,0,0]=3 11407 B15R1.962 CNC(=O)CCCNCc1ccccc1 2230a_100000740002_100015291786 [0,1,0,0,0,1|1,0,0]=3 11408 B15R1.962 CNC(=O)CCCNCc1ccccc1 2230a_100015324214_100000741757 [0,1,0,0,0,1|1,0,0]=3 11409 B15R1.962 CNC(=O)CCCNCc1ccccc1 270004a_100000740002_100015611070 [0,1,0,0,0,1|1,0,0]=3 11410 B15R1.962 CNC(=O)CCCNCc1ccccc1 34a_100000740002_100015291786 [0,1,0,0,0,1|1,0,0]=3 11411 B15R1.962 CNC(=O)CCCNCc1ccccc1 34a_100015324214_100000741757 [0,1,0,0,0,1|1,0,0]=3 11412 B15R1.962 CNC(=O)CCCNCc1ccccn1 207a_100000740002_100000209966 [0,1,0,0,0,1|2,0,0]=4 11413 B15R1.962 CNC(=O)CCCNCc1ccccn1 2230a_100000740002_100000721315 [0,1,0,0,0,1|2,0,0]=4 11414 B15R1.962 CNC(=O)CCCNCc1ccccn1 270004a_100000740002_100000209966 [0,1,0,0,0,1|2,0,0]=4 11415 B15R1.962 CNC(=O)CCCNCc1ccccn1 34a_100000740002_100000721315 [0,1,0,0,0,1|2,0,0]=4 11416 B15R1.962 CNC(=O)CCCNCc1cccnc1 207a_100000740002_100000209961 [0,1,0,0,0,1|2,0,0]=4 11417 B15R1.962 CNC(=O)CCCNCc1cccnc1 2230a_100000740002_100000741622 [0,1,0,0,0,1|2,0,0]=4 11418 B15R1.962 CNC(=O)CCCNCc1cccnc1 270004a_100000740002_100000209961 [0,1,0,0,0,1|2,0,0]=4 11419 B15R1.962 CNC(=O)CCCNCc1cccnc1 34a_100000740002_100000733263 [0,1,0,0,0,1|2,0,0]=4 11420 B15R1.962 CNC(=O)CCCNCc1ccncc1 207a_100000740002_100000186114 [0,1,0,0,0,1|2,0,0]=4 11421 B15R1.962 CNC(=O)CCCNCc1ccncc1 2230a_100000740002_100015193705 [0,1,0,0,0,1|2,0,0]=4 11422 B15R1.962 CNC(=O)CCCOCc1ccccc1 11a_106832991635_100000748059 [0,1,0,0,0,1|1,0,0]=3 11423 B15R1.962 CNC(=O)CCCOCc1ccccc1 1626a_100102657272_100000748059 [0,1,0,0,0,1|1,0,0]=3 11424 B15R1.962 CNC(=O)CCCOCc1ccccc1 240690a_100102657272_100000748059 [0,1,0,0,0,1|1,0,0]=3 11425 B15R1.962 CNC(=O)CCCOCc1ccccc1 34a_100000210790_100000741757 [0,1,0,0,0,1|1,0,0]=3 11426 B15R1.962 CNC(=O)CCCOCc1ccccc1 527a_100102657272_100000748059 [0,1,0,0,0,1|1,0,0]=3 11427 B15R1.962 CNC(=O)CCCOCc1ccccc1 7a_100000210790_100000741757 [0,1,0,0,0,1|1,0,0]=3 11428 B15R1.962 CNC(=O)CCCSCc1ccccc1 62a_100000211182_100000741757 [0,1,0,0,0,1|1,0,0]=3 11429 B15R1.962 CNC(=O)CCCSCc1ccccc1 62a_100000741757_100015291786 [0,1,0,0,0,1|1,0,0]=3 11430 B15R1.962 CNC(=O)CCCSCc1ccccn1 62a_100000721315_100000741757 [0,1,0,0,0,1|2,0,0]=4 11431 B15R1.962 CNC(=O)CCCSCc1ccccn1 62a_100000741757_100000721315 [0,1,0,0,0,1|2,0,0]=4 11432 B15R1.962 CNC(=O)CCCSCc1cccnc1 62a_100000741622_100000741757 [0,1,0,0,0,1|2,0,0]=4 11433 B15R1.962 CNC(=O)CCCSCc1cccnc1 62a_100000741757_100000741622 [0,1,0,0,0,1|2,0,0]=4 11434 B15R1.962 CNC(=O)CCCSCc1ccncc1 62a_100000741757_100015193705 [0,1,0,0,0,1|2,0,0]=4 11435 B15R1.962 CNC(=O)CCCSCc1ccncc1 62a_100015193705_100000741757 [0,1,0,0,0,1|2,0,0]=4 11436 B15R1.962 CNC(=O)CCNCCc1ccccc1 2230a_100000106460_100000737683 [0,1,0,0,0,1|1,0,0]=3 11437 B15R1.962 CNC(=O)CCNCCc1ccccc1 2230a_100000738227_100000765856 [0,1,0,0,0,1|1,0,0]=3 11438 B15R1.962 CNC(=O)CCNCCc1ccccc1 34a_100000106460_100012179268 [0,1,0,0,0,1|1,0,0]=3 11439 B15R1.962 CNC(=O)CCNCCc1ccccc1 34a_100000738227_100000765856 [0,1,0,0,0,1|1,0,0]=3 11440 B15R1.962 CNC(=O)CCNCCc1ccccn1 2230a_100000738227_100015183660 [0,1,0,0,0,1|2,0,0]=4 11441 B15R1.962 CNC(=O)CCNCCc1cccnc1 2230a_100000736294_100000737683 [0,1,0,0,0,1|2,0,0]=4 11442 B15R1.962 CNC(=O)CCNCCc1cccnc1 2230a_100000738227_200011713674 [0,1,0,0,0,1|2,0,0]=4 11443 B15R1.962 CNC(=O)CCNCCc1ccncc1 2230a_100000738227_100000723409 [0,1,0,0,0,1|2,0,0]=4 11444 B15R1.962 CNC(=O)CCNCSc1ccccc1 2230a_100000738227_100011218342 [0,1,0,0,0,1|2,0,0]=4 11445 B15R1.962 CNC(=O)CCOCCc1ccccc1 34a_100000210268_100012179268 [0,1,0,0,0,1|1,0,0]=3 11446 B15R1.962 CNC(=O)CCOCCc1ccccc1 34a_100000754576_100000765856 [0,1,0,0,0,1|1,0,0]=3 11447 B15R1.962 CNC(=O)CCOCCc1ccccc1 7a_100000210268_100000737683 [0,1,0,0,0,1|1,0,0]=3 11448 B15R1.962 CNC(=O)CCOCCc1ccccn1 34a_100000210271_100012179268 [0,1,0,0,0,1|2,0,0]=4 11449 B15R1.962 CNC(=O)CCOCCc1cccnc1 34a_100011217484_100012179268 [0,1,0,0,0,1|2,0,0]=4 11450 B15R1.962 CNC(=O)CCOCCc1ccncc1 34a_100011216225_100012179268 [0,1,0,0,0,1|2,0,0]=4 11451 B15R1.962 CNC(=O)CCSCCc1ccccc1 62a_100000737683_100011218657 [0,1,0,0,0,1|1,0,0]=3 11452 B15R1.962 CNC(=O)CCSCCc1ccccc1 62a_100000765856_100000737683 [0,1,0,0,0,1|1,0,0]=3 11453 B15R1.962 CNC(=O)CCSCCc1ccccn1 62a_100000737683_100015183660 [0,1,0,0,0,1|2,0,0]=4 11454 B15R1.962 CNC(=O)CCSCCc1ccccn1 62a_100015183660_100000737683 [0,1,0,0,0,1|2,0,0]=4 11455 B15R1.962 CNC(=O)CCSCCc1cccnc1 62a_100000737683_200011713674 [0,1,0,0,0,1|2,0,0]=4 11456 B15R1.962 CNC(=O)CCSCCc1cccnc1 62a_200011713674_100000737683 [0,1,0,0,0,1|2,0,0]=4 11457 B15R1.962 CNC(=O)CCSCCc1ccncc1 62a_100000723409_100000737683 [0,1,0,0,0,1|2,0,0]=4 11458 B15R1.962 CNC(=O)CCSCCc1ccncc1 62a_100000737683_100000723409 [0,1,0,0,0,1|2,0,0]=4 11459 B15R1.962 CNC(=O)CCSCSc1ccccc1 62a_100000737683_100011218342 [0,1,0,0,0,1|2,0,0]=4 11460 B15R1.962 CNC(=O)CCSCSc1ccccc1 62a_100011218342_100000737683 [0,1,0,0,0,1|2,0,0]=4 11461 B15R1.962 CNC(=O)CNCCCc1ccccc1 2230a_100000211184_100000183359 [0,1,0,0,0,1|1,0,0]=3 11462 B15R1.962 CNC(=O)CNCCCc1ccccc1 2230a_100000693194_100000211621 [0,1,0,0,0,1|1,0,0]=3 11463 B15R1.962 CNC(=O)CNCCCc1ccccc1 34a_100000211184_100000183359 [0,1,0,0,0,1|1,0,0]=3 11464 B15R1.962 CNC(=O)CNCCCc1cccnc1 2230a_100011532358_100000183359 [0,1,0,0,0,1|2,0,0]=4 11465 B15R1.962 CNC(=O)CNCCCc1cccnc1 34a_100011532358_100000183359 [0,1,0,0,0,1|2,0,0]=4 11466 B15R1.962 CNC(=O)CNCCCc1ccncc1 2230a_100011275580_100000183359 [0,1,0,0,0,1|2,0,0]=4 11467 B15R1.962 CNC(=O)CNCCOc1ccccc1 2230a_100000174943_100000183359 [0,1,0,0,0,1|2,0,0]=4 11468 B15R1.962 CNC(=O)CNCCOc1ccccc1 2230a_100000693194_100000184471 [0,1,0,0,0,1|2,0,0]=4 11469 B15R1.962 CNC(=O)CNCCOc1ccccc1 270004a_100000693194_100000758736 [0,1,0,0,0,1|2,0,0]=4 11470 B15R1.962 CNC(=O)CNCCOc1ccccc1 34a_100000174943_100000183359 [0,1,0,0,0,1|2,0,0]=4 11471 B15R1.962 CNC(=O)CNCCSc1ccccc1 2230a_100000189519_100000183359 [0,1,0,0,0,1|2,0,0]=4 11472 B15R1.962 CNC(=O)CNCCSc1ccccc1 2230a_100000693194_100000246102 [0,1,0,0,0,1|2,0,0]=4 11473 B15R1.962 CNC(=O)CNCOCc1ccccc1 2230a_100000693194_100000763385 [0,1,0,0,0,1|2,0,0]=4 11474 B15R1.962 CNC(=O)CNCSCc1ccccc1 2230a_100000693194_200011217039 [0,1,0,0,0,1|2,0,0]=4 11475 B15R1.962 CNC(=O)COCCCc1ccccc1 34a_100000210828_100000183359 [0,1,0,0,0,1|1,0,0]=3 11476 B15R1.962 CNC(=O)COCCCc1ccccc1 34a_100000750040_100000211621 [0,1,0,0,0,1|1,0,0]=3 11477 B15R1.962 CNC(=O)COCCCc1ccccc1 7a_100000210828_100000183359 [0,1,0,0,0,1|1,0,0]=3 11478 B15R1.962 CNC(=O)COCCCc1ccccn1 34a_100011215068_100000183359 [0,1,0,0,0,1|2,0,0]=4 11479 B15R1.962 CNC(=O)COCCCc1cccnc1 34a_100000211284_100000183359 [0,1,0,0,0,1|2,0,0]=4 11480 B15R1.962 CNC(=O)COCCCc1ccncc1 34a_100000210659_100000183359 [0,1,0,0,0,1|2,0,0]=4 11481 B15R1.962 CNC(=O)COCCNc1ccccc1 34a_100000211345_100000183359 [0,1,0,0,0,1|2,0,0]=4 11482 B15R1.962 CNC(=O)COCCOc1ccccc1 34a_100000210260_100000183359 [0,1,0,0,0,1|2,0,0]=4 11483 B15R1.962 CNC(=O)COCCOc1ccccc1 34a_100000750040_100000184471 [0,1,0,0,0,1|2,0,0]=4 11484 B15R1.962 CNC(=O)COCCOc1ccccc1 7a_100000210260_100000183359 [0,1,0,0,0,1|2,0,0]=4 11485 B15R1.962 CNC(=O)COCCSc1ccccc1 34a_100000750040_100000246102 [0,1,0,0,0,1|2,0,0]=4 11486 B15R1.962 CNC(=O)COCCSc1ccccc1 7a_100000230494_100000183359 [0,1,0,0,0,1|2,0,0]=4 11487 B15R1.962 CNC(=O)COCOCc1ccccc1 34a_100000750040_100000763385 [0,1,0,0,0,1|2,0,0]=4 11488 B15R1.962 CNC(=O)COCSCc1ccccc1 34a_100000750040_200011217039 [0,1,0,0,0,1|2,0,0]=4 11489 B15R1.962 CNC(=O)CSCCCc1ccccc1 62a_100000183359_100000211621 [0,1,0,0,0,1|1,0,0]=3 11490 B15R1.962 CNC(=O)CSCCCc1ccccc1 62a_100000211621_100000183359 [0,1,0,0,0,1|1,0,0]=3 11491 B15R1.962 CNC(=O)CSCCOc1ccccc1 11a_106832991635_200000150159 [0,1,0,0,0,1|2,0,0]=4 11492 B15R1.962 CNC(=O)CSCCOc1ccccc1 1626a_100102657272_200000150159 [0,1,0,0,0,1|2,0,0]=4 11493 B15R1.962 CNC(=O)CSCCOc1ccccc1 240690a_100102657272_200000150159 [0,1,0,0,0,1|2,0,0]=4 11494 B15R1.962 CNC(=O)CSCCOc1ccccc1 527a_100102657272_200000150159 [0,1,0,0,0,1|2,0,0]=4 11495 B15R1.962 CNC(=O)CSCCOc1ccccc1 62a_100000183359_100000184471 [0,1,0,0,0,1|2,0,0]=4 11496 B15R1.962 CNC(=O)CSCCOc1ccccc1 62a_100000184471_100000183359 [0,1,0,0,0,1|2,0,0]=4 11497 B15R1.962 CNC(=O)CSCCSc1ccccc1 62a_100000183359_100000246102 [0,1,0,0,0,1|2,0,0]=4 11498 B15R1.962 CNC(=O)CSCCSc1ccccc1 62a_100000246102_100000183359 [0,1,0,0,0,1|2,0,0]=4 11499 B15R1.962 CNC(=O)CSCOCc1ccccc1 62a_100000183359_100000763385 [0,1,0,0,0,1|2,0,0]=4 11500 B15R1.962 CNC(=O)CSCOCc1ccccc1 62a_100000763385_100000183359 [0,1,0,0,0,1|2,0,0]=4 11501 B15R1.962 CNC(=O)CSCSCc1ccccc1 62a_100000183359_200011217039 [0,1,0,0,0,1|2,0,0]=4 11502 B15R1.962 CNC(=O)CSCSCc1ccccc1 62a_200011217039_100000183359 [0,1,0,0,0,1|2,0,0]=4 11503 B15R1.962 CNC(=O)NCCCCc1ccccc1 2708a_100015280158_106832991635 [0,1,0,0,0,1|1,0,0]=3 11504 B15R1.962 CNC(=O)NCCCCc1ccccc1 2708a_100102657272_100015280158 [0,1,0,0,0,1|1,0,0]=3 11505 B15R1.962 CNC(=O)NCCCCc1ccccc1 273464a_100015280158_100102657272 [0,1,0,0,0,1|1,0,0]=3 11506 B15R1.962 CNC(=O)NCCCCc1ccccc1 273464a_100102657272_100015280158 [0,1,0,0,0,1|1,0,0]=3 11507 B15R1.962 CNC(=O)NCCCCc1ccccc1 512a_100015280158_100102657272 [0,1,0,0,0,1|1,0,0]=3 11508 B15R1.962 CNC(=O)NCCCCc1ccccc1 512a_106832991638_100015280158 [0,1,0,0,0,1|1,0,0]=3 11509 B15R1.962 CNC(=O)NCCCOc1ccccc1 2708a_100000216521_106832991635 [0,1,0,0,0,1|2,0,0]=4 11510 B15R1.962 CNC(=O)NCCCOc1ccccc1 2708a_100102657272_100000216521 [0,1,0,0,0,1|2,0,0]=4 11511 B15R1.962 CNC(=O)NCCCOc1ccccc1 273464a_100000216521_100102657272 [0,1,0,0,0,1|2,0,0]=4 11512 B15R1.962 CNC(=O)NCCCOc1ccccc1 273464a_100102657272_100000216521 [0,1,0,0,0,1|2,0,0]=4 11513 B15R1.962 CNC(=O)NCCCOc1ccccc1 512a_100000216521_100102657272 [0,1,0,0,0,1|2,0,0]=4 11514 B15R1.962 CNC(=O)NCCCOc1ccccc1 512a_106832991638_100000216521 [0,1,0,0,0,1|2,0,0]=4 11515 B15R1.962 CNC(=O)NCCCSc1ccccc1 2708a_100000184639_106832991635 [0,1,0,0,0,1|2,0,0]=4 11516 B15R1.962 CNC(=O)NCCCSc1ccccc1 2708a_100102657272_100000184639 [0,1,0,0,0,1|2,0,0]=4 11517 B15R1.962 CNC(=O)NCCCSc1ccccc1 273464a_100000184639_100102657272 [0,1,0,0,0,1|2,0,0]=4 11518 B15R1.962 CNC(=O)NCCCSc1ccccc1 273464a_100102657272_100000184639 [0,1,0,0,0,1|2,0,0]=4 11519 B15R1.962 CNC(=O)NCCCSc1ccccc1 512a_100000184639_100102657272 [0,1,0,0,0,1|2,0,0]=4 11520 B15R1.962 CNC(=O)NCCCSc1ccccc1 512a_106832991638_100000184639 [0,1,0,0,0,1|2,0,0]=4 11521 B15R1.962 CNC(=O)NCCNCc1ccccc1 207a_100015205895_100015611070 [0,1,0,0,0,1|2,0,0]=4 11522 B15R1.962 CNC(=O)NCCNCc1ccccc1 34a_100015205895_100015291786 [0,1,0,0,0,1|2,0,0]=4 11523 B15R1.962 CNC(=O)NCCOCc1ccccc1 2708a_100000753106_106832991635 [0,1,0,0,0,1|2,0,0]=4 11524 B15R1.962 CNC(=O)NCCOCc1ccccc1 2708a_100102657272_100000753106 [0,1,0,0,0,1|2,0,0]=4 11525 B15R1.962 CNC(=O)NCCOCc1ccccc1 273464a_100000753106_100102657272 [0,1,0,0,0,1|2,0,0]=4 11526 B15R1.962 CNC(=O)NCCOCc1ccccc1 273464a_100102657272_100000753106 [0,1,0,0,0,1|2,0,0]=4 11527 B15R1.962 CNC(=O)NCCOCc1ccccc1 512a_100000753106_100102657272 [0,1,0,0,0,1|2,0,0]=4 11528 B15R1.962 CNC(=O)NCCOCc1ccccc1 512a_106832991638_100000753106 [0,1,0,0,0,1|2,0,0]=4 11529 B15R1.962 CNC(=O)NCCSCc1ccccc1 2708a_100000189534_106832991635 [0,1,0,0,0,1|2,0,0]=4 11530 B15R1.962 CNC(=O)NCCSCc1ccccc1 2708a_100102657272_100000189534 [0,1,0,0,0,1|2,0,0]=4 11531 B15R1.962 CNC(=O)NCCSCc1ccccc1 273464a_100000189534_100102657272 [0,1,0,0,0,1|2,0,0]=4 11532 B15R1.962 CNC(=O)NCCSCc1ccccc1 273464a_100102657272_100000189534 [0,1,0,0,0,1|2,0,0]=4 11533 B15R1.962 CNC(=O)NCCSCc1ccccc1 512a_100000189534_100102657272 [0,1,0,0,0,1|2,0,0]=4 11534 B15R1.962 CNC(=O)NCCSCc1ccccc1 512a_106832991638_100000189534 [0,1,0,0,0,1|2,0,0]=4 11535 B15R1.962 CNC(=O)OCCNCc1ccccc1 34a_100015324214_200011997002 [0,1,0,0,0,1|2,0,0]=4 11536 B15R1.962 CNC(=O)OCCOCc1ccccc1 34a_100000210790_200011997002 [0,1,0,0,0,1|2,0,0]=4 11537 B15R1.962 CNC(=O)OCCOCc1ccccc1 7a_100000210790_200011997002 [0,1,0,0,0,1|2,0,0]=4 11538 B15R1.962 CNC(=O)OCCSCc1ccccc1 62a_100000211182_200011997002 [0,1,0,0,0,1|2,0,0]=4 11539 B15R1.962 CNC(=O)OCCSCc1ccccc1 62a_200011997002_100015291786 [0,1,0,0,0,1|2,0,0]=4 11540 B15R1.962 COC(=O)/C=C/CNCc1ccccc1 2230a_100015324214_100000742655 [0,1,0,0,0,1|0,0,2]=4 11541 B15R1.962 COC(=O)/C=C/CNCc1ccccc1 34a_100015324214_100000742655 [0,1,0,0,0,1|0,0,2]=4 11542 B15R1.962 COC(=O)/C=C/COCc1ccccc1 34a_100000210790_100000742655 [0,1,0,0,0,1|0,0,2]=4 11543 B15R1.962 COC(=O)/C=C/COCc1ccccc1 7a_100000210790_100000742655 [0,1,0,0,0,1|0,0,2]=4 11544 B15R1.962 COC(=O)/C=C/CSCc1ccccc1 62a_100000211182_100000742655 [0,1,0,0,0,1|0,0,2]=4 11545 B15R1.962 COC(=O)/C=C/CSCc1ccccc1 62a_100000742655_100015291786 [0,1,0,0,0,1|0,0,2]=4 11546 B15R1.962 COC(=O)C=NNCCc1ccccc1 4a_100000740470_200011823558 [0,1,0,0,0,1|1,0,1]=4 11547 B15R1.962 COC(=O)CC=NNCc1ccccc1 4a_100000007032_200011552997 [0,1,0,0,0,1|1,0,1]=4 11548 B15R1.962 COC(=O)CCC=NNc1ccccc1 4a_100015195140_100012047195 [0,1,0,0,0,1|1,0,1]=4 11549 B15R1.962 COC(=O)CCCCNc1ccccc1 34a_100000106764_100000204269 [0,1,0,0,0,1|0,0,0]=2 11550 B15R1.962 COC(=O)CCCCOc1ccccc1 34a_100000210340_100000204269 [0,1,0,0,0,1|0,0,0]=2 11551 B15R1.962 COC(=O)CCCCOc1ccccc1 7a_100000210340_100000204269 [0,1,0,0,0,1|0,0,0]=2 11552 B15R1.962 COC(=O)CCCCOc1cccnc1 34a_100000210849_100000204269 [0,1,0,0,0,1|1,0,0]=3 11553 B15R1.962 COC(=O)CCCCOc1cccnc1 7a_100000210849_100000204269 [0,1,0,0,0,1|1,0,0]=3 11554 B15R1.962 COC(=O)CCCCOc1ccncc1 34a_100000212176_100000204269 [0,1,0,0,0,1|1,0,0]=3 11555 B15R1.962 COC(=O)CCCCOc1ccnnc1 34a_100015204005_100000204269 [0,1,0,0,0,1|2,0,0]=4 11556 B15R1.962 COC(=O)CCCCOc1cncnc1 7a_100000754086_100000204269 [0,1,0,0,0,1|2,0,0]=4 11557 B15R1.962 COC(=O)CCCCSc1ccccc1 62a_100000204269_100000041952 [0,1,0,0,0,1|0,0,0]=2 11558 B15R1.962 COC(=O)CCCCSc1ccccc1 62a_100000719477_100000204269 [0,1,0,0,0,1|0,0,0]=2 11559 B15R1.962 COC(=O)CCCCSc1ccccn1 62a_100000204269_100011216584 [0,1,0,0,0,1|1,0,0]=3 11560 B15R1.962 COC(=O)CCCCSc1ccccn1 62a_100011216584_100000204269 [0,1,0,0,0,1|1,0,0]=3 11561 B15R1.962 COC(=O)CCCCSc1cccnc1 62a_100000204269_100000210063 [0,1,0,0,0,1|1,0,0]=3 11562 B15R1.962 COC(=O)CCCCSc1cccnc1 62a_100000210063_100000204269 [0,1,0,0,0,1|1,0,0]=3 11563 B15R1.962 COC(=O)CCCCSc1cccnn1 62a_100000204269_100016991348 [0,1,0,0,0,1|2,0,0]=4 11564 B15R1.962 COC(=O)CCCCSc1cccnn1 62a_100016991348_100000204269 [0,1,0,0,0,1|2,0,0]=4 11565 B15R1.962 COC(=O)CCCCSc1ccncc1 62a_100000204269_100000728582 [0,1,0,0,0,1|1,0,0]=3 11566 B15R1.962 COC(=O)CCCCSc1ccncc1 62a_100000728582_100000204269 [0,1,0,0,0,1|1,0,0]=3 11567 B15R1.962 COC(=O)CCCCSc1ccncn1 62a_100000204269_100000703185 [0,1,0,0,0,1|2,0,0]=4 11568 B15R1.962 COC(=O)CCCCSc1ccncn1 62a_100000703185_100000204269 [0,1,0,0,0,1|2,0,0]=4 11569 B15R1.962 COC(=O)CCCCSc1ccnnc1 62a_100000204269_100000732662 [0,1,0,0,0,1|2,0,0]=4 11570 B15R1.962 COC(=O)CCCCSc1ccnnc1 62a_100000732662_100000204269 [0,1,0,0,0,1|2,0,0]=4 11571 B15R1.962 COC(=O)CCCCSc1cnccn1 62a_100000204269_100000211759 [0,1,0,0,0,1|2,0,0]=4 11572 B15R1.962 COC(=O)CCCCSc1cnccn1 62a_100000211759_100000204269 [0,1,0,0,0,1|2,0,0]=4 11573 B15R1.962 COC(=O)CCCCSc1cncnc1 62a_100000204269_100011206942 [0,1,0,0,0,1|2,0,0]=4 11574 B15R1.962 COC(=O)CCCCSc1cncnc1 62a_100011206942_100000204269 [0,1,0,0,0,1|2,0,0]=4 11575 B15R1.962 COC(=O)CCCCSc1ncccn1 62a_100000204269_100000211032 [0,1,0,0,0,1|2,0,0]=4 11576 B15R1.962 COC(=O)CCCCSc1ncccn1 62a_100000211032_100000204269 [0,1,0,0,0,1|2,0,0]=4 11577 B15R1.962 COC(=O)CCCNCc1ccccc1 2230a_100015324214_100011218270 [0,1,0,0,0,1|0,0,0]=2 11578 B15R1.962 COC(=O)CCCNCc1ccccc1 34a_100015324214_100000742333 [0,1,0,0,0,1|0,0,0]=2 11579 B15R1.962 COC(=O)CCCNCc1cccnn1 2230a_100159270163_100011218270 [0,1,0,0,0,1|2,0,0]=4 11580 B15R1.962 COC(=O)CCCNCc1cncnc1 2230a_100011243677_100011218270 [0,1,0,0,0,1|2,0,0]=4 11581 B15R1.962 COC(=O)CCCOCc1ccccc1 34a_100000210790_100000742333 [0,1,0,0,0,1|0,0,0]=2 11582 B15R1.962 COC(=O)CCCOCc1ccccc1 7a_100000210790_100011218270 [0,1,0,0,0,1|0,0,0]=2 11583 B15R1.962 COC(=O)CCCSCc1ccccc1 62a_100000211182_100011218270 [0,1,0,0,0,1|0,0,0]=2 11584 B15R1.962 COC(=O)CCCSCc1ccccc1 62a_100011218270_100015291786 [0,1,0,0,0,1|0,0,0]=2 11585 B15R1.962 COC(=O)CCCSCc1ccccn1 62a_100000721315_100011218270 [0,1,0,0,0,1|1,0,0]=3 11586 B15R1.962 COC(=O)CCCSCc1ccccn1 62a_100011218270_100000721315 [0,1,0,0,0,1|1,0,0]=3 11587 B15R1.962 COC(=O)CCCSCc1cccnc1 62a_100000741622_100011218270 [0,1,0,0,0,1|1,0,0]=3 11588 B15R1.962 COC(=O)CCCSCc1cccnc1 62a_100011218270_100000741622 [0,1,0,0,0,1|1,0,0]=3 11589 B15R1.962 COC(=O)CCCSCc1cccnn1 62a_100011218270_100016990269 [0,1,0,0,0,1|2,0,0]=4 11590 B15R1.962 COC(=O)CCCSCc1cccnn1 62a_100016990269_100011218270 [0,1,0,0,0,1|2,0,0]=4 11591 B15R1.962 COC(=O)CCCSCc1ccncc1 62a_100011218270_100015193705 [0,1,0,0,0,1|1,0,0]=3 11592 B15R1.962 COC(=O)CCCSCc1ccncc1 62a_100015193705_100011218270 [0,1,0,0,0,1|1,0,0]=3 11593 B15R1.962 COC(=O)CCCSCc1cnccn1 62a_100011218270_100016995436 [0,1,0,0,0,1|2,0,0]=4 11594 B15R1.962 COC(=O)CCCSCc1cnccn1 62a_100016995436_100011218270 [0,1,0,0,0,1|2,0,0]=4 11595 B15R1.962 COC(=O)CCCSCc1cncnc1 62a_100011218270_100015196519 [0,1,0,0,0,1|2,0,0]=4 11596 B15R1.962 COC(=O)CCCSCc1cncnc1 62a_100015196519_100011218270 [0,1,0,0,0,1|2,0,0]=4 11597 B15R1.962 COC(=O)CCCSCc1ncccn1 62a_100000703007_100011218270 [0,1,0,0,0,1|2,0,0]=4 11598 B15R1.962 COC(=O)CCCSCc1ncccn1 62a_100011218270_100000703007 [0,1,0,0,0,1|2,0,0]=4 11599 B15R1.962 COC(=O)CCNCCc1ccccc1 2230a_100000106460_100000204255 [0,1,0,0,0,1|0,0,0]=2 11600 B15R1.962 COC(=O)CCNCCc1ccccc1 34a_100000106460_100000742370 [0,1,0,0,0,1|0,0,0]=2 11601 B15R1.962 COC(=O)CCNCCc1cccnc1 2230a_100000736294_100000204255 [0,1,0,0,0,1|1,0,0]=3 11602 B15R1.962 COC(=O)CCOCCc1ccccc1 34a_100000210268_100000742370 [0,1,0,0,0,1|0,0,0]=2 11603 B15R1.962 COC(=O)CCOCCc1ccccc1 7a_100000210268_100000204255 [0,1,0,0,0,1|0,0,0]=2 11604 B15R1.962 COC(=O)CCOCCc1ccccn1 34a_100000210271_100000742370 [0,1,0,0,0,1|1,0,0]=3 11605 B15R1.962 COC(=O)CCOCCc1cccnc1 34a_100011217484_100000742370 [0,1,0,0,0,1|1,0,0]=3 11606 B15R1.962 COC(=O)CCOCCc1ccncc1 34a_100011216225_100000742370 [0,1,0,0,0,1|1,0,0]=3 11607 B15R1.962 COC(=O)CCOCCc1cnccn1 34a_100011349526_100000742370 [0,1,0,0,0,1|2,0,0]=4 11608 B15R1.962 COC(=O)CCOCCc1cncnc1 34a_100011709255_100000742370 [0,1,0,0,0,1|2,0,0]=4 11609 B15R1.962 COC(=O)CCSCCc1ccccc1 62a_100000204255_100011218657 [0,1,0,0,0,1|0,0,0]=2 11610 B15R1.962 COC(=O)CCSCCc1ccccc1 62a_100000765856_100000204255 [0,1,0,0,0,1|0,0,0]=2 11611 B15R1.962 COC(=O)CCSCCc1ccccn1 62a_100000204255_100015183660 [0,1,0,0,0,1|1,0,0]=3 11612 B15R1.962 COC(=O)CCSCCc1ccccn1 62a_100015183660_100000204255 [0,1,0,0,0,1|1,0,0]=3 11613 B15R1.962 COC(=O)CCSCCc1cccnc1 62a_100000204255_200011713674 [0,1,0,0,0,1|1,0,0]=3 11614 B15R1.962 COC(=O)CCSCCc1cccnc1 62a_200011713674_100000204255 [0,1,0,0,0,1|1,0,0]=3 11615 B15R1.962 COC(=O)CCSCCc1ccncc1 62a_100000204255_100000723409 [0,1,0,0,0,1|1,0,0]=3 11616 B15R1.962 COC(=O)CCSCCc1ccncc1 62a_100000723409_100000204255 [0,1,0,0,0,1|1,0,0]=3 11617 B15R1.962 COC(=O)CCSCSc1ccccc1 62a_100000204255_100011218342 [0,1,0,0,0,1|1,0,0]=3 11618 B15R1.962 COC(=O)CCSCSc1ccccc1 62a_100011218342_100000204255 [0,1,0,0,0,1|1,0,0]=3 11619 B15R1.962 COC(=O)CNC/C=C/c1ccccc1 2230a_100020603302_100000747449 [0,1,0,0,0,1|0,0,2]=4 11620 B15R1.962 COC(=O)CNC/C=C/c1ccccc1 34a_100020603302_100000747449 [0,1,0,0,0,1|0,0,2]=4 11621 B15R1.962 COC(=O)CNCC#Cc1ccccc1 34a_100000735379_100000747449 [0,1,0,0,0,1|0,0,2]=4 11622 B15R1.962 COC(=O)CNCCCc1ccccc1 2230a_100000211184_100000747449 [0,1,0,0,0,1|0,0,0]=2 11623 B15R1.962 COC(=O)CNCCCc1ccccc1 34a_100000211184_100000747449 [0,1,0,0,0,1|0,0,0]=2 11624 B15R1.962 COC(=O)CNCCCc1cccnc1 2230a_100011532358_100000747449 [0,1,0,0,0,1|1,0,0]=3 11625 B15R1.962 COC(=O)CNCCCc1cccnc1 34a_100011532358_100000747449 [0,1,0,0,0,1|1,0,0]=3 11626 B15R1.962 COC(=O)CNCCCc1ccncc1 2230a_100011275580_100000747449 [0,1,0,0,0,1|1,0,0]=3 11627 B15R1.962 COC(=O)CNCCOc1ccccc1 2230a_100000174943_100000747449 [0,1,0,0,0,1|1,0,0]=3 11628 B15R1.962 COC(=O)CNCCOc1ccccc1 34a_100000174943_100000747449 [0,1,0,0,0,1|1,0,0]=3 11629 B15R1.962 COC(=O)CNCCOc1ccccn1 2230a_106741647558_100000747449 [0,1,0,0,0,1|2,0,0]=4 11630 B15R1.962 COC(=O)CNCCOc1cccnc1 2230a_100000754688_100000747449 [0,1,0,0,0,1|2,0,0]=4 11631 B15R1.962 COC(=O)CNCCSc1ccccc1 2230a_100000189519_100000747449 [0,1,0,0,0,1|1,0,0]=3 11632 B15R1.962 COC(=O)COC/C=C/c1ccccc1 34a_100000210256_100000747449 [0,1,0,0,0,1|0,0,2]=4 11633 B15R1.962 COC(=O)COCC#Cc1ccccc1 34a_100011217464_100000747449 [0,1,0,0,0,1|0,0,2]=4 11634 B15R1.962 COC(=O)COCC#Cc1ccccc1 7a_100011217464_100000747449 [0,1,0,0,0,1|0,0,2]=4 11635 B15R1.962 COC(=O)COCCCC1=CCC=CC1 34a_100020667889_100000747449 [0,1,0,0,0,1|0,0,2]=4 11636 B15R1.962 COC(=O)COCCCc1ccccc1 34a_100000210828_100000747449 [0,1,0,0,0,1|0,0,0]=2 11637 B15R1.962 COC(=O)COCCCc1ccccc1 7a_100000210828_100000747449 [0,1,0,0,0,1|0,0,0]=2 11638 B15R1.962 COC(=O)COCCCc1ccccn1 34a_100011215068_100000747449 [0,1,0,0,0,1|1,0,0]=3 11639 B15R1.962 COC(=O)COCCCc1cccnc1 34a_100000211284_100000747449 [0,1,0,0,0,1|1,0,0]=3 11640 B15R1.962 COC(=O)COCCCc1ccncc1 34a_100000210659_100000747449 [0,1,0,0,0,1|1,0,0]=3 11641 B15R1.962 COC(=O)COCCNc1ccccc1 34a_100000106764_100000090808 [0,1,0,0,0,1|1,0,0]=3 11642 B15R1.962 COC(=O)COCCNc1ccccc1 34a_100000211345_100000747449 [0,1,0,0,0,1|1,0,0]=3 11643 B15R1.962 COC(=O)COCCNc1ccncc1 34a_200011243140_100000747449 [0,1,0,0,0,1|2,0,0]=4 11644 B15R1.962 COC(=O)COCCOc1ccccc1 34a_100000210260_100000747449 [0,1,0,0,0,1|1,0,0]=3 11645 B15R1.962 COC(=O)COCCOc1ccccc1 34a_100000210340_100000090808 [0,1,0,0,0,1|1,0,0]=3 11646 B15R1.962 COC(=O)COCCOc1ccccc1 7a_100000210260_100000747449 [0,1,0,0,0,1|1,0,0]=3 11647 B15R1.962 COC(=O)COCCOc1ccccc1 7a_100000210340_100000090808 [0,1,0,0,0,1|1,0,0]=3 11648 B15R1.962 COC(=O)COCCOc1cccnc1 34a_100000210849_100000090808 [0,1,0,0,0,1|2,0,0]=4 11649 B15R1.962 COC(=O)COCCOc1cccnc1 7a_100000210849_100000090808 [0,1,0,0,0,1|2,0,0]=4 11650 B15R1.962 COC(=O)COCCOc1ccncc1 34a_100000212176_100000090808 [0,1,0,0,0,1|2,0,0]=4 11651 B15R1.962 COC(=O)COCCSc1ccccc1 62a_100000090808_100000041952 [0,1,0,0,0,1|1,0,0]=3 11652 B15R1.962 COC(=O)COCCSc1ccccc1 62a_100000719477_100000090808 [0,1,0,0,0,1|1,0,0]=3 11653 B15R1.962 COC(=O)COCCSc1ccccc1 7a_100000230494_100000747449 [0,1,0,0,0,1|1,0,0]=3 11654 B15R1.962 COC(=O)COCCSc1ccccn1 62a_100000090808_100011216584 [0,1,0,0,0,1|2,0,0]=4 11655 B15R1.962 COC(=O)COCCSc1ccccn1 62a_100011216584_100000090808 [0,1,0,0,0,1|2,0,0]=4 11656 B15R1.962 COC(=O)COCCSc1ccccn1 7a_100000156319_100000747449 [0,1,0,0,0,1|2,0,0]=4 11657 B15R1.962 COC(=O)COCCSc1cccnc1 62a_100000090808_100000210063 [0,1,0,0,0,1|2,0,0]=4 11658 B15R1.962 COC(=O)COCCSc1cccnc1 62a_100000210063_100000090808 [0,1,0,0,0,1|2,0,0]=4 11659 B15R1.962 COC(=O)COCCSc1ccncc1 62a_100000090808_100000728582 [0,1,0,0,0,1|2,0,0]=4 11660 B15R1.962 COC(=O)COCCSc1ccncc1 62a_100000728582_100000090808 [0,1,0,0,0,1|2,0,0]=4 11661 B15R1.962 COC(=O)CSC/C=C/c1ccccc1 62a_100000747449_100016265936 [0,1,0,0,0,1|0,0,2]=4 11662 B15R1.962 COC(=O)CSC/C=C/c1ccccc1 62a_100016265936_100000747449 [0,1,0,0,0,1|0,0,2]=4 11663 B15R1.962 COC(=O)CSCC#Cc1ccccc1 62a_100000747449_100011352542 [0,1,0,0,0,1|0,0,2]=4 11664 B15R1.962 COC(=O)CSCCCc1ccccc1 62a_100000211621_100000747449 [0,1,0,0,0,1|0,0,0]=2 11665 B15R1.962 COC(=O)CSCCCc1ccccc1 62a_100000747449_100000211621 [0,1,0,0,0,1|0,0,0]=2 11666 B15R1.962 COC(=O)CSCCOc1ccccc1 62a_100000184471_100000747449 [0,1,0,0,0,1|1,0,0]=3 11667 B15R1.962 COC(=O)CSCCOc1ccccc1 62a_100000747449_100000184471 [0,1,0,0,0,1|1,0,0]=3 11668 B15R1.962 COC(=O)CSCCSc1ccccc1 62a_100000246102_100000747449 [0,1,0,0,0,1|1,0,0]=3 11669 B15R1.962 COC(=O)CSCCSc1ccccc1 62a_100000747449_100000246102 [0,1,0,0,0,1|1,0,0]=3 11670 B15R1.962 COC(=O)CSCOCc1ccccc1 62a_100000747449_100000763385 [0,1,0,0,0,1|1,0,0]=3 11671 B15R1.962 COC(=O)CSCOCc1ccccc1 62a_100000763385_100000747449 [0,1,0,0,0,1|1,0,0]=3 11672 B15R1.962 COC(=O)CSCSCc1ccccc1 62a_100000747449_200011217039 [0,1,0,0,0,1|1,0,0]=3 11673 B15R1.962 COC(=O)CSCSCc1ccccc1 62a_200011217039_100000747449 [0,1,0,0,0,1|1,0,0]=3 11674 B15R1.962 COC(=O)NCCOCc1ccccc1 34a_100000757965_100015291786 [0,1,0,0,0,1|1,0,0]=3 11675 B15R1.962 COC(=O)NCCOCc1ccccn1 34a_100000757965_100000721315 [0,1,0,0,0,1|2,0,0]=4 11676 B15R1.962 COC(=O)NCCOCc1cccnc1 34a_100000757965_100000733263 [0,1,0,0,0,1|2,0,0]=4 11677 B15R1.962 COC(=O)OCCOCc1ccccc1 34a_100010262106_100015291786 [0,1,0,0,0,1|1,0,0]=3 11678 B15R1.962 COC(=O)OCCOCc1ccccn1 34a_100010262106_100000721315 [0,1,0,0,0,1|2,0,0]=4 11679 B15R1.962 COC(=O)OCCOCc1cccnc1 34a_100010262106_100000733263 [0,1,0,0,0,1|2,0,0]=4 11680 B15R1.962 COC(=O)OCSCCc1ccccc1 62a_100000765856_100000139417 [0,1,0,0,0,1|1,0,0]=3 11681 B15R1.962 COC(=O)OCSCCc1ccccn1 62a_100015183660_100000139417 [0,1,0,0,0,1|2,0,0]=4 11682 B15R1.962 COC(=O)OCSCCc1cccnc1 62a_200011713674_100000139417 [0,1,0,0,0,1|2,0,0]=4 11683 B15R1.962 COC(=O)OCSCCc1ccncc1 62a_100000723409_100000139417 [0,1,0,0,0,1|2,0,0]=4 11684 B15R1.962 COC(=O)OCSCSc1ccccc1 62a_100011218342_100000139417 [0,1,0,0,0,1|2,0,0]=4 11685 B15R1.962 COC(C)CCOCCc1ccccc1 7a_100000764861_100000765856 [0,1,0,0,0,1|1,0,1]=4 11686 B15R1.962 COC(C)COCCCc1ccccc1 34a_100000690652_100000211621 [0,1,0,0,0,1|1,0,1]=4 11687 B15R1.962 COC(C)SCCCCc1ccccc1 62a_100000701786_100009879195 [0,1,0,0,0,1|1,0,1]=4 11688 B15R1.962 COC(C)SCCCCc1ccccc1 62a_100009879195_100000701786 [0,1,0,0,0,1|1,0,1]=4 11689 B15R1.962 CO[C@H](C)CNCCCc1ccccc1 2230a_100020591295_100000211621 [0,1,0,0,0,1|1,0,1]=4 11690 B15R1.962 C[C@@H](CO)CNCCCc1ccccc1 2230a_100000211184_100000059175 [0,1,0,0,0,1|1,0,1]=4 11691 B15R1.962 C[C@@H](CO)CNCCCc1ccccc1 34a_100000211184_100000059175 [0,1,0,0,0,1|1,0,1]=4 11692 B15R1.962 C[C@@H](CO)COCCCc1ccccc1 34a_100000210828_100000059175 [0,1,0,0,0,1|1,0,1]=4 11693 B15R1.962 C[C@@H](CO)COCCCc1ccccc1 7a_100000210828_100000059175 [0,1,0,0,0,1|1,0,1]=4 11694 B15R1.962 C[C@@H](CO)CSCCCc1ccccc1 62a_100000059175_100000211621 [0,1,0,0,0,1|1,0,1]=4 11695 B15R1.962 C[C@@H](CO)CSCCCc1ccccc1 62a_100000211621_100000059175 [0,1,0,0,0,1|1,0,1]=4 11696 B15R1.962 C[C@H](CO)NCCCCc1ccccc1 2230a_100000737577_100000701786 [0,1,0,0,0,1|1,0,1]=4 11697 B15R1.962 C[C@H](CO)SCCCCc1ccccc1 62a_100000701786_100016084084 [0,1,0,0,0,1|1,0,1]=4 11698 B15R1.962 C[C@H](CO)SCCCCc1ccccc1 62a_100016084084_100000701786 [0,1,0,0,0,1|1,0,1]=4 11699 B15R1.962 NC(=NO)CCOCCc1ccccc1 34a_100000749954_100000765856 [0,1,0,0,0,1|1,0,0]=3 11700 B15R1.962 NNC(=O)CCCOCc1ccccc1 34a_100000211488_100015291786 [0,1,0,0,0,1|1,0,0]=3 11701 B15R1.962 NNC(=O)CCCOCc1ccccn1 34a_100000211488_100000721315 [0,1,0,0,0,1|2,0,0]=4 11702 B15R1.962 NNC(=O)CCCOCc1cccnc1 34a_100000211488_100000733263 [0,1,0,0,0,1|2,0,0]=4 11703 B15R1.962 O=C(CF)CCCCCc1ccccc1 1458a_100011216832_100015361967 [0,1,0,0,0,1|1,0,0]=3 11704 B15R1.962 O=C(CF)CCCCOc1ccccc1 1458a_200011216290_100015361967 [0,1,0,0,0,1|1,0,0]=3 11705 B15R1.962 O=C(CF)CCCOCc1ccccc1 1458a_100000748059_100015361967 [0,1,0,0,0,1|1,0,0]=3 11706 B15R1.962 O=C(CF)CSCCOc1ccccc1 1458a_200000150159_100015361967 [0,1,0,0,0,1|2,0,0]=4 11707 B15R1.962 O=C(CO)CCCCCc1ccccc1 1458a_100000210174_200011217138 [0,1,0,0,0,1|0,0,0]=2 11708 B15R1.962 O=C(CO)CCCCOc1ccccc1 1458a_100000210174_100011215240 [0,1,0,0,0,1|0,0,0]=2 11709 B15R1.962 O=C(CO)CCCOCc1ccccc1 1458a_100000210174_100011215529 [0,1,0,0,0,1|0,0,0]=2 11710 B15R1.962 O=C(CO)NCCCCc1ccccc1 240690a_100015280158_100000210174 [0,1,0,0,0,1|0,0,0]=2 11711 B15R1.962 O=C(CO)NCCCCc1ccccc1 527a_100015280158_100000210174 [0,1,0,0,0,1|0,0,0]=2 11712 B15R1.962 O=C(CO)NCCCOc1ccccc1 240690a_100000216521_100000210174 [0,1,0,0,0,1|1,0,0]=3 11713 B15R1.962 O=C(CO)NCCCOc1ccccc1 527a_100000216521_100000210174 [0,1,0,0,0,1|1,0,0]=3 11714 B15R1.962 O=C(CO)NCCCSc1ccccc1 240690a_100000184639_100000210174 [0,1,0,0,0,1|1,0,0]=3 11715 B15R1.962 O=C(CO)NCCCSc1ccccc1 527a_100000184639_100000210174 [0,1,0,0,0,1|1,0,0]=3 11716 B15R1.962 O=C(CO)NCCOCc1ccccc1 240690a_100000753106_100000210174 [0,1,0,0,0,1|1,0,0]=3 11717 B15R1.962 O=C(CO)NCCOCc1ccccc1 527a_100000753106_100000210174 [0,1,0,0,0,1|1,0,0]=3 11718 B15R1.962 O=C(CO)NCCSCc1ccccc1 240690a_100000189534_100000210174 [0,1,0,0,0,1|1,0,0]=3 11719 B15R1.962 O=C(CO)NCCSCc1ccccc1 527a_100000189534_100000210174 [0,1,0,0,0,1|1,0,0]=3 11720 B15R1.962 OCC(O)CNCCCc1ccccc1 2230a_100000211184_100011219619 [0,1,0,0,0,1|0,0,2]=4 11721 B15R1.962 OCC(O)CNCCCc1ccccc1 34a_100000211184_100011219619 [0,1,0,0,0,1|0,0,2]=4 11722 B15R1.962 OCC(O)COCCCc1ccccc1 34a_100000210828_100011219619 [0,1,0,0,0,1|0,0,2]=4 11723 B15R1.962 OCC(O)COCCCc1ccccc1 7a_100000210828_100011219619 [0,1,0,0,0,1|0,0,2]=4 11724 B15R1.962 OCC(O)CSCCCc1ccccc1 62a_100000211621_100011219619 [0,1,0,0,0,1|0,0,2]=4 11725 B15R1.962 OCC(O)CSCCCc1ccccc1 62a_100011219619_100000211621 [0,1,0,0,0,1|0,0,2]=4 11726 B15R1.962 OC[C@@H](O)CNCCCc1ccccc1 2230a_100020644852_100000211621 [0,1,0,0,0,1|0,0,2]=4 11727 B15R1.962 OC[C@H](F)CNCCCc1ccccc1 34a_100015665980_100000211621 [0,1,0,0,0,1|1,0,1]=4 11728 B15R1.962 OC[C@H](O)CNCCCc1ccccc1 2230a_100000211184_100009815848 [0,1,0,0,0,1|0,0,2]=4 11729 B15R1.962 OC[C@H](O)CNCCCc1ccccc1 34a_100000211184_100009815848 [0,1,0,0,0,1|0,0,2]=4 11730 B15R1.962 OC[C@H](O)COCCCc1ccccc1 34a_100000210828_100009815848 [0,1,0,0,0,1|0,0,2]=4 11731 B15R1.962 OC[C@H](O)COCCCc1ccccc1 7a_100000210828_100009815848 [0,1,0,0,0,1|0,0,2]=4 11732 B15R1.962 OC[C@H](O)CSCCCc1ccccc1 62a_100000211621_100009815848 [0,1,0,0,0,1|0,0,2]=4 11733 B15R1.962 OC[C@H](O)CSCCCc1ccccc1 62a_100009815848_100000211621 [0,1,0,0,0,1|0,0,2]=4 11734 B15R1.962 O[C@@H](CF)CNCCCc1ccccc1 2230a_100000211184_100015614560 [0,1,0,0,0,1|1,0,1]=4 11735 B15R1.962 O[C@@H](CF)CNCCCc1ccccc1 34a_100000211184_100015614560 [0,1,0,0,0,1|1,0,1]=4 11736 B15R1.962 O[C@@H](CF)COCCCc1ccccc1 34a_100000210828_100015614560 [0,1,0,0,0,1|1,0,1]=4 11737 B15R1.962 O[C@@H](CF)COCCCc1ccccc1 7a_100000210828_100015614560 [0,1,0,0,0,1|1,0,1]=4 11738 B15R1.962 O[C@@H](CF)CSCCCc1ccccc1 62a_100000211621_100015614560 [0,1,0,0,0,1|1,0,1]=4 11739 B15R1.962 O[C@@H](CF)CSCCCc1ccccc1 62a_100015614560_100000211621 [0,1,0,0,0,1|1,0,1]=4 11740 B15R1.1081 C=C(Br)CCOC(C)Cc1ccccc1 34a_100009813270_200011218536 [0,1,0,0,0,1|2,0,0]=4 11741 B15R1.1081 C=C(C)CCOC(C)Cc1ccccc1 34a_100000748627_100000730704 [0,1,0,0,0,1|2,0,0]=4 11742 B15R1.1081 C=C(C)CCOC(C)Cc1ccccc1 34a_100000764851_200011218536 [0,1,0,0,0,1|2,0,0]=4 11743 B15R1.1081 C=C(C)CCOC(C)Cc1ccccc1 7a_100000748627_100000730704 [0,1,0,0,0,1|2,0,0]=4 11744 B15R1.1081 C=C(C)CCSC(C)Cc1ccccc1 62a_100000730704_200011218536 [0,1,0,0,0,1|2,0,0]=4 11745 B15R1.1081 C=C(C)CCSC(C)Cc1ccccc1 62a_200011218536_100000730704 [0,1,0,0,0,1|2,0,0]=4 11746 B15R1.1081 C=C(C)CNCC(O)Cc1ccccc1 2230a_100000752270_100000748629 [0,1,0,0,0,1|2,0,0]=4 11747 B15R1.1081 C=C(C)COCC(C)Cc1ccccc1 34a_100012125295_100000748629 [0,1,0,0,0,1|2,0,0]=4 11748 B15R1.1081 C=C(C)COCC(C)Cc1ccccc1 7a_100012125295_100000748629 [0,1,0,0,0,1|2,0,0]=4 11749 B15R1.1081 C=C(C)COCC(N)Cc1ccccc1 34a_100000739027_100000748629 [0,1,0,0,0,1|2,0,0]=4 11750 B15R1.1081 C=C(C)COC[C@@H](O)Cc1ccccc1 34a_100000210245_100000729385 [0,1,0,0,0,1|2,0,0]=4 11751 B15R1.1081 C=C(C)CSC[C@@H](O)Cc1ccccc1 62a_100000729385_100000211660 [0,1,0,0,0,1|2,0,0]=4 11752 B15R1.1081 C=C(C)CSC[C@@H](O)Cc1ccccc1 62a_100000748629_100000729385 [0,1,0,0,0,1|2,0,0]=4 11753 B15R1.1081 C=C(F)CNCC(O)Cc1ccccc1 2230a_100000752270_100009893438 [0,1,0,0,0,1|2,0,0]=4 11754 B15R1.1081 C=C(F)COCC(C)Cc1ccccc1 34a_100012125295_100009893438 [0,1,0,0,0,1|2,0,0]=4 11755 B15R1.1081 C=C(F)COCC(C)Cc1ccccc1 7a_100012125295_100000042424 [0,1,0,0,0,1|2,0,0]=4 11756 B15R1.1081 C=C(F)COCC(N)Cc1ccccc1 34a_100000739027_100009893438 [0,1,0,0,0,1|2,0,0]=4 11757 B15R1.1081 C=C(F)COC[C@@H](O)Cc1ccccc1 34a_200010262243_100000729385 [0,1,0,0,0,1|2,0,0]=4 11758 B15R1.1081 C=C(F)CSC[C@@H](O)Cc1ccccc1 62a_100000042424_100000729385 [0,1,0,0,0,1|2,0,0]=4 11759 B15R1.1081 C=C(F)CSC[C@@H](O)Cc1ccccc1 62a_100000729385_100000042424 [0,1,0,0,0,1|2,0,0]=4 11760 B15R1.1081 CC(=O)CCCC(=O)C[n+]1ccccc1 1458a_200000086051_100011215641 [0,1,0,0,0,1|2,0,0]=4 11761 B15R1.1081 CC(=O)CCCC(=O)Cc1ccccn1 1458a_100000233486_100011215641 [0,1,0,0,0,1|2,0,0]=4 11762 B15R1.1081 CC(=O)CCCC(=O)Cc1cccnc1 1458a_100000737805_100011215641 [0,1,0,0,0,1|2,0,0]=4 11763 B15R1.1081 CC(=O)CCCC(=O)Nc1ccccc1 1458a_100000070787_100011194425 [0,1,0,0,0,1|1,0,1]=4 11764 B15R1.1081 CC(=O)CCCC(=O)Nc1ccccc1 1458a_200000181736_200000210301 [0,1,0,0,0,1|1,0,1]=4 11765 B15R1.1081 CC(=O)CCCN(C)Cc1ccccc1 269982a_100000186898_100011215641 [0,1,0,0,0,1|1,0,0]=3 11766 B15R1.1081 CC(=O)CCCN(C)Cc1ccccn1 269982a_100000207498_100011215641 [0,1,0,0,0,1|2,0,0]=4 11767 B15R1.1081 CC(=O)CCCN(C)Cc1cccnc1 269982a_100000184577_100011215641 [0,1,0,0,0,1|2,0,0]=4 11768 B15R1.1081 CC(=O)CCCN(C)Cc1ccncc1 269982a_100000187231_100011215641 [0,1,0,0,0,1|2,0,0]=4 11769 B15R1.1081 CC(=O)CCOC(C)Cc1ccccc1 34a_100000759926_200011218536 [0,1,0,0,0,1|1,0,0]=3 11770 B15R1.1081 CC(=O)CCOC(C)Cc1ccccc1 7a_100000748627_100000053229 [0,1,0,0,0,1|1,0,0]=3 11771 B15R1.1081 CC(=O)CCOC(C)Cc1ccccc1 7a_100000759926_200011218536 [0,1,0,0,0,1|1,0,0]=3 11772 B15R1.1081 CC(=O)CCSC(C)Cc1ccccc1 62a_100000053229_200011218536 [0,1,0,0,0,1|1,0,0]=3 11773 B15R1.1081 CC(=O)CCSC(C)Cc1ccccc1 62a_200011218536_100000053229 [0,1,0,0,0,1|1,0,0]=3 11774 B15R1.1081 CC(=O)COC[C@@H](O)Cc1ccccc1 34a_100000211253_100000729385 [0,1,0,0,0,1|1,0,0]=3 11775 B15R1.1081 CC(=O)NCCC(=O)Cc1ccccc1 1458a_100000183196_100015291786 [0,1,0,0,0,1|1,0,1]=4 11776 B15R1.1081 CC(=O)NCCN(C)Cc1ccccc1 2230a_100000186898_100000189650 [0,1,0,0,0,1|2,0,0]=4 11777 B15R1.1081 CC(=O)NCCN(C)Cc1ccccc1 240690a_100000744458_100015343762 [0,1,0,0,0,1|2,0,0]=4 11778 B15R1.1081 CC(=O)NCCN(C)Cc1ccccc1 269982a_100000186898_100000189650 [0,1,0,0,0,1|2,0,0]=4 11779 B15R1.1081 CC(=O)NCCN(C)Cc1ccccc1 527a_100000744458_100103153847 [0,1,0,0,0,1|2,0,0]=4 11780 B15R1.1081 CC(=O)OCCN(C)Cc1ccccc1 269982a_100000186898_100009814007 [0,1,0,0,0,1|2,0,0]=4 11781 B15R1.1081 CC(=O)OCOC(C)Cc1ccccc1 34a_100000748627_100009813279 [0,1,0,0,0,1|2,0,0]=4 11782 B15R1.1081 CC(=O)OCSC(C)Cc1ccccc1 62a_100000076356_200011218536 [0,1,0,0,0,1|2,0,0]=4 11783 B15R1.1081 CC(=O)OCSC(C)Cc1ccccc1 62a_200011218536_100000076356 [0,1,0,0,0,1|2,0,0]=4 11784 B15R1.1081 CC(=O)SCCC(=O)Cc1ccccc1 1458a_100000048949_100015291786 [0,1,0,0,0,1|1,0,1]=4 11785 B15R1.1081 CC(CNCC(=O)N)Oc1ccccc1 2230a_100000755676_100000747473 [0,1,0,0,0,1|2,0,0]=4 11786 B15R1.1081 CC(CNCC(=O)N)Oc1ccccc1 34a_100000755676_100000187820 [0,1,0,0,0,1|2,0,0]=4 11787 B15R1.1081 CC(CNCC(=O)[O-])Oc1ccccc1 34a_100000755676_100020667443 [0,1,0,0,0,1|1,0,1]=4 11788 B15R1.1081 CC(COCC(=O)N)Cc1ccccc1 34a_100012125295_100000187820 [0,1,0,0,0,1|1,0,0]=3 11789 B15R1.1081 CC(COCC(=O)N)Cc1ccccc1 7a_100012125295_100000187820 [0,1,0,0,0,1|1,0,0]=3 11790 B15R1.1081 CC(COCC(=O)N)Oc1ccccc1 34a_200000036796_100000187820 [0,1,0,0,0,1|2,0,0]=4 11791 B15R1.1081 CC(COCC(=O)N)Oc1ccccc1 7a_200000036796_100000187820 [0,1,0,0,0,1|2,0,0]=4 11792 B15R1.1081 CC(COCC(=O)[O-])Cc1ccccc1 34a_100012125295_100020667443 [0,1,0,0,0,1|0,0,1]=3 11793 B15R1.1081 CC(COCC(=O)[O-])Oc1ccccc1 34a_200000036796_100020667443 [0,1,0,0,0,1|1,0,1]=4 11794 B15R1.1081 CC(COC[C@@H](C)O)Cc1ccccc1 34a_100012125295_100009817552 [0,1,0,0,0,1|1,0,1]=4 11795 B15R1.1081 CC(COC[C@@H](C)O)Cc1ccccc1 7a_100012125295_100009817552 [0,1,0,0,0,1|1,0,1]=4 11796 B15R1.1081 CC(COC[N+](=O)[O-])Cc1ccccc1 34a_100012125295_100000761209 [0,1,0,0,0,1|1,0,1]=4 11797 B15R1.1081 CC(Cc1ccccc1)NOCC(=O)O 269956a_100000106656_200011218536 [0,1,0,0,0,1|1,0,0]=3 11798 B15R1.1081 CC(Cc1ccccc1)OCCC(=O)N 34a_100000748627_100000731001 [0,1,0,0,0,1|1,0,0]=3 11799 B15R1.1081 CC(Cc1ccccc1)OCCC(=O)N 34a_100000757172_200011218536 [0,1,0,0,0,1|1,0,0]=3 11800 B15R1.1081 CC(Cc1ccccc1)OCCC(=O)N 7a_100000748627_100000744528 [0,1,0,0,0,1|1,0,0]=3 11801 B15R1.1081 CC(Cc1ccccc1)OCCC(=O)N 7a_100000757172_200011218536 [0,1,0,0,0,1|1,0,0]=3 11802 B15R1.1081 CC(Cc1ccccc1)SCCC(=O)N 62a_100000744528_200011218536 [0,1,0,0,0,1|1,0,0]=3 11803 B15R1.1081 CC(Cc1ccccc1)SCCC(=O)N 62a_200011218536_100000744528 [0,1,0,0,0,1|1,0,0]=3 11804 B15R1.1081 CC(Cc1ccccn1)NCCC(=O)N 2230a_100000238496_100000744528 [0,1,0,0,0,1|2,0,0]=4 11805 B15R1.1081 CC(Cc1cccnc1)NCCC(=O)N 2230a_100011207255_100000744528 [0,1,0,0,0,1|2,0,0]=4 11806 B15R1.1081 CC(O)CCCN(C)Cc1ccccc1 2230a_100000186898_200000718107 [0,1,0,0,0,1|1,0,1]=4 11807 B15R1.1081 CC(O)CCCN(C)Cc1ccccc1 269982a_100000186898_200000718107 [0,1,0,0,0,1|1,0,1]=4 11808 B15R1.1081 CC(O)CCOC(C)Cc1ccccc1 34a_100000748627_100012276601 [0,1,0,0,0,1|1,0,1]=4 11809 B15R1.1081 CC(O)CCOC(C)Cc1ccccc1 7a_100000748627_100012276601 [0,1,0,0,0,1|1,0,1]=4 11810 B15R1.1081 CC(O)CCSC(C)Cc1ccccc1 62a_100012276601_200011218536 [0,1,0,0,0,1|1,0,1]=4 11811 B15R1.1081 CC(O)CCSC(C)Cc1ccccc1 62a_200011218536_100012276601 [0,1,0,0,0,1|1,0,1]=4 11812 B15R1.1081 CC(O)CNCC(O)Cc1ccccc1 2230a_100000752270_100011218427 [0,1,0,0,0,1|1,0,1]=4 11813 B15R1.1081 CC(O)CNC[C@@H](O)Cc1ccccc1 2230a_100000210904_100000729385 [0,1,0,0,0,1|1,0,1]=4 11814 B15R1.1081 CC(O)CNC[C@@H](O)Cc1ccccc1 34a_100000210904_100000729385 [0,1,0,0,0,1|1,0,1]=4 11815 B15R1.1081 CC(O)COCC(C)Cc1ccccc1 34a_100012125295_100011218427 [0,1,0,0,0,1|1,0,1]=4 11816 B15R1.1081 CC(O)COCC(C)Cc1ccccc1 7a_100012125295_100011218427 [0,1,0,0,0,1|1,0,1]=4 11817 B15R1.1081 CC(O)COCC(N)Cc1ccccc1 34a_100000739027_100011218427 [0,1,0,0,0,1|1,0,1]=4 11818 B15R1.1081 CC(O)CSC[C@@H](O)Cc1ccccc1 62a_100000729385_100011218427 [0,1,0,0,0,1|1,0,1]=4 11819 B15R1.1081 CC(O)CSC[C@@H](O)Cc1ccccc1 62a_100011218427_100000729385 [0,1,0,0,0,1|1,0,1]=4 11820 B15R1.1081 CN(CCCC(=O)N)Cc1ccccc1 269982a_100000186898_100102525003 [0,1,0,0,0,1|1,0,0]=3 11821 B15R1.1081 CN(CCCC(=O)N)Cc1ccccn1 269982a_100000207498_100102525003 [0,1,0,0,0,1|2,0,0]=4 11822 B15R1.1081 CN(CCCC(=O)N)Cc1cccnc1 269982a_100000184577_100102525003 [0,1,0,0,0,1|2,0,0]=4 11823 B15R1.1081 CN(CCCC(=O)N)Cc1ccncc1 269982a_100000187231_100102525003 [0,1,0,0,0,1|2,0,0]=4 11824 B15R1.1081 CN(CCCC(=O)O)Cc1ccccc1 269956a_100000719178_100015291786 [0,1,0,0,0,1|0,0,0]=2 11825 B15R1.1081 CN(CCCC(=O)O)Cc1ccccn1 269956a_100000719178_100000721315 [0,1,0,0,0,1|1,0,0]=3 11826 B15R1.1081 CN(CCCC(=O)O)Cc1cccnc1 269956a_100000719178_100000733263 [0,1,0,0,0,1|1,0,0]=3 11827 B15R1.1081 CN(CCCC(=O)O)Cc1cccnn1 269956a_100000719178_100016990269 [0,1,0,0,0,1|2,0,0]=4 11828 B15R1.1081 CN(CCCC(=O)O)Cc1ccncc1 269956a_100000719178_100015193705 [0,1,0,0,0,1|1,0,0]=3 11829 B15R1.1081 CN(CCCC(=O)O)Cc1cnccn1 269956a_100000719178_100016995436 [0,1,0,0,0,1|2,0,0]=4 11830 B15R1.1081 CN(CCCC(=O)O)Cc1cncnc1 269956a_100000719178_100016991940 [0,1,0,0,0,1|2,0,0]=4 11831 B15R1.1081 CN(CCCC(=O)O)Cc1ncccn1 269956a_100000719178_100000703007 [0,1,0,0,0,1|2,0,0]=4 11832 B15R1.1081 CN(CCNC(=O)N)Cc1ccccc1 2230a_100000186898_200000034859 [0,1,0,0,0,1|2,0,0]=4 11833 B15R1.1081 CN(CCNC(=O)N)Cc1ccccc1 269982a_100000186898_200000034859 [0,1,0,0,0,1|2,0,0]=4 11834 B15R1.1081 CN(CCOC(=O)N)Cc1ccccc1 269982a_100000186898_200011214921 [0,1,0,0,0,1|2,0,0]=4 11835 B15R1.1081 C[C@@H](O)CNCC(O)Cc1ccccc1 2230a_100000752270_100009817552 [0,1,0,0,0,1|1,0,1]=4 11836 B15R1.1081 C[C@@H](O)COCC(N)Cc1ccccc1 34a_100000739027_100009817552 [0,1,0,0,0,1|1,0,1]=4 11837 B15R1.1081 C[C@@H](O)CSC[C@@H](O)Cc1ccccc1 62a_100000729385_100009817552 [0,1,0,0,0,1|1,0,1]=4 11838 B15R1.1081 C[C@@H](O)CSC[C@@H](O)Cc1ccccc1 62a_100009817552_100000729385 [0,1,0,0,0,1|1,0,1]=4 11839 B15R1.1081 NC(=O)CCCC(=O)C[n+]1ccccc1 1458a_200000086051_100102525003 [0,1,0,0,0,1|2,0,0]=4 11840 B15R1.1081 NC(=O)CCCC(=O)Cc1ccccn1 1458a_100000233486_100102525003 [0,1,0,0,0,1|2,0,0]=4 11841 B15R1.1081 NC(=O)CCCC(=O)Cc1cccnc1 1458a_100000737805_100102525003 [0,1,0,0,0,1|2,0,0]=4 11842 B15R1.1081 NC(=O)CNCC(=O)Cc1ccccc1 2230a_100000711301_100000233483 [0,1,0,0,0,1|1,0,1]=4 11843 B15R1.1081 NC(=O)CNCC(O)Cc1ccccc1 2230a_100000752270_100000747473 [0,1,0,0,0,1|1,0,0]=3 11844 B15R1.1081 NC(=O)CNC[C@@H](O)Cc1ccccc1 2230a_100000711301_100000729385 [0,1,0,0,0,1|1,0,0]=3 11845 B15R1.1081 NC(=O)COCC(=O)Cc1ccccc1 1458a_100011219004_100015291786 [0,1,0,0,0,1|1,0,1]=4 11846 B15R1.1081 NC(=O)COCC(N)Cc1ccccc1 34a_100000739027_100000187820 [0,1,0,0,0,1|1,0,0]=3 11847 B15R1.1081 NC(=O)CSCC(=O)Cc1ccccc1 62a_100000233483_100000747473 [0,1,0,0,0,1|1,0,1]=4 11848 B15R1.1081 NC(=O)CSCC(=O)Cc1ccccc1 62a_100000747473_100000233483 [0,1,0,0,0,1|1,0,1]=4 11849 B15R1.1081 NC(=O)CSC[C@@H](O)Cc1ccccc1 62a_100000729385_100000747473 [0,1,0,0,0,1|1,0,0]=3 11850 B15R1.1081 NC(=O)CSC[C@@H](O)Cc1ccccc1 62a_100000747473_100000729385 [0,1,0,0,0,1|1,0,0]=3 11851 B15R1.1081 NC(=O)NCCC(=O)Cc1ccccc1 1458a_100000181464_100015291786 [0,1,0,0,0,1|1,0,1]=4 11852 B15R1.1081 NC(COCC(=O)[O-])Cc1ccccc1 34a_100000739027_100020667443 [0,1,0,0,0,1|0,0,1]=3 11853 B15R1.1081 NC(COC[N+](=O)[O-])Cc1ccccc1 34a_100000739027_100000761209 [0,1,0,0,0,1|1,0,1]=4 11854 B15R1.1081 O=C(CCC[N+](=O)[O-])Cc1ccccc1 1458a_100016109205_100015291786 [0,1,0,0,0,1|1,0,1]=4 11855 B15R1.1081 O=C(O)CNCC(=O)Cc1ccccc1 269956a_100016091260_100000233483 [0,1,0,0,0,1|0,0,1]=3 11856 B15R1.1081 O=C(O)CNCC(=O)Nc1ccccc1 269956a_100016091260_100000182850 [0,1,0,0,0,1|1,0,1]=4 11857 B15R1.1081 O=C(O)CNCC(=O)Oc1ccccc1 269956a_100016091260_100009813826 [0,1,0,0,0,1|1,0,1]=4 11858 B15R1.1081 O=C(O)CNC[C@@H](O)Cc1ccccc1 269956a_100016091260_100000729385 [0,1,0,0,0,1|0,0,0]=2 11859 B15R1.1081 O=C([O-])CSCC(=O)Cc1ccccc1 62a_100000233483_100020667443 [0,1,0,0,0,1|0,0,2]=4 11860 B15R1.1081 O=C([O-])CSCC(=O)Cc1ccccc1 62a_100020667443_100000233483 [0,1,0,0,0,1|0,0,2]=4 11861 B15R1.1081 O=C([O-])CSC[C@@H](O)Cc1ccccc1 62a_100000729385_100020667443 [0,1,0,0,0,1|0,0,1]=3 11862 B15R1.1081 O=C([O-])CSC[C@@H](O)Cc1ccccc1 62a_100020667443_100000729385 [0,1,0,0,0,1|0,0,1]=3 11863 B15R1.1081 O=[N+]([O-])CSC[C@@H](O)Cc1ccccc1 62a_100000729385_100000761209 [0,1,0,0,0,1|1,0,1]=4 11864 B15R1.1081 [13CH3]C(=O)CCCC(=O)Nc1ccccc1 1458a_200000181736_200025704644 [0,1,0,0,0,1|1,0,1]=4 11865 B15R1.3664 C=C(C)C(=O)CCCCc1ccccc1 1458a_100000185857_100000701786 [0,1,0,0,0,1|2,0,0]=4 11866 B15R1.3664 C=C(C)C(C)NCCCc1ccccc1 269862a_100000211184_100011216138 [0,1,0,0,0,1|2,0,0]=4 11867 B15R1.3664 CC(=O)C(=O)CNCCc1ccccc1 34a_100000106460_100011261029 [0,1,0,0,0,1|1,0,1]=4 11868 B15R1.3664 CC(=O)C(=O)COCCc1ccccc1 34a_100000210268_100011261029 [0,1,0,0,0,1|1,0,1]=4 11869 B15R1.3664 CC(=O)C(=O)CSCCc1ccccc1 62a_100000765856_100011261029 [0,1,0,0,0,1|1,0,1]=4 11870 B15R1.3664 CC(=O)C(=O)CSCCc1ccccc1 62a_100011261029_100011218657 [0,1,0,0,0,1|1,0,1]=4 11871 B15R1.3664 CC(=O)C(C)COCCc1ccccc1 34a_100000032740_100000765856 [0,1,0,0,0,1|1,0,0]=3 11872 B15R1.3664 CC(=O)C(C)COCCc1ccccc1 7a_100000032740_100000765856 [0,1,0,0,0,1|1,0,0]=3 11873 B15R1.3664 CC(=O)C(C)COCCc1ccccn1 7a_100000032740_100015183660 [0,1,0,0,0,1|2,0,0]=4 11874 B15R1.3664 CC(=O)C(C)COCCc1cccnc1 7a_100000032740_200011713674 [0,1,0,0,0,1|2,0,0]=4 11875 B15R1.3664 CC(=O)C(C)COCCc1ccncc1 7a_100000032740_100000723409 [0,1,0,0,0,1|2,0,0]=4 11876 B15R1.3664 CC(=O)C(C)NCCCc1ccccc1 2230a_100000211184_100009814033 [0,1,0,0,0,1|1,0,0]=3 11877 B15R1.3664 CC(=O)C(C)NCCCc1cccnc1 2230a_100011532358_100009814033 [0,1,0,0,0,1|2,0,0]=4 11878 B15R1.3664 CC(=O)C(C)NCCCc1ccncc1 2230a_100011275580_100009814033 [0,1,0,0,0,1|2,0,0]=4 11879 B15R1.3664 CC(=O)C(C)NCCOc1ccccc1 2230a_100000174943_100009814033 [0,1,0,0,0,1|2,0,0]=4 11880 B15R1.3664 CC(=O)C(C)NCCSc1ccccc1 2230a_100000189519_100009814033 [0,1,0,0,0,1|2,0,0]=4 11881 B15R1.3664 CC(=O)C(C)OCCCc1ccccc1 34a_100000212229_100000211621 [0,1,0,0,0,1|1,0,0]=3 11882 B15R1.3664 CC(=O)C(C)OCCCc1ccccc1 7a_100000210828_100000179758 [0,1,0,0,0,1|1,0,0]=3 11883 B15R1.3664 CC(=O)C(C)OCCOc1ccccc1 34a_100000212229_100000184471 [0,1,0,0,0,1|2,0,0]=4 11884 B15R1.3664 CC(=O)C(C)OCCOc1ccccc1 7a_100000210260_100000179758 [0,1,0,0,0,1|2,0,0]=4 11885 B15R1.3664 CC(=O)C(C)OCCSc1ccccc1 34a_100000212229_100000246102 [0,1,0,0,0,1|2,0,0]=4 11886 B15R1.3664 CC(=O)C(C)OCCSc1ccccc1 7a_100000230494_100000179758 [0,1,0,0,0,1|2,0,0]=4 11887 B15R1.3664 CC(=O)C(C)OCOCc1ccccc1 34a_100000212229_100000763385 [0,1,0,0,0,1|2,0,0]=4 11888 B15R1.3664 CC(=O)C(C)OCSCc1ccccc1 34a_100000212229_200011217039 [0,1,0,0,0,1|2,0,0]=4 11889 B15R1.3664 CC(=O)C(C)SCCCc1ccccc1 62a_100000211621_100009814033 [0,1,0,0,0,1|1,0,0]=3 11890 B15R1.3664 CC(=O)C(C)SCCCc1ccccc1 62a_100009814033_100000211621 [0,1,0,0,0,1|1,0,0]=3 11891 B15R1.3664 CC(=O)C(C)SCCOc1ccccc1 62a_100000184471_100009814033 [0,1,0,0,0,1|2,0,0]=4 11892 B15R1.3664 CC(=O)C(C)SCCOc1ccccc1 62a_100009814033_100000184471 [0,1,0,0,0,1|2,0,0]=4 11893 B15R1.3664 CC(=O)C(C)SCCSc1ccccc1 62a_100000246102_100009814033 [0,1,0,0,0,1|2,0,0]=4 11894 B15R1.3664 CC(=O)C(C)SCCSc1ccccc1 62a_100009814033_100000246102 [0,1,0,0,0,1|2,0,0]=4 11895 B15R1.3664 CC(=O)C(C)SCOCc1ccccc1 62a_100000763385_100009814033 [0,1,0,0,0,1|2,0,0]=4 11896 B15R1.3664 CC(=O)C(C)SCOCc1ccccc1 62a_100009814033_100000763385 [0,1,0,0,0,1|2,0,0]=4 11897 B15R1.3664 CC(=O)C(C)SCSCc1ccccc1 62a_100009814033_200011217039 [0,1,0,0,0,1|2,0,0]=4 11898 B15R1.3664 CC(=O)C(C)SCSCc1ccccc1 62a_200011217039_100009814033 [0,1,0,0,0,1|2,0,0]=4 11899 B15R1.3664 CC(=O)N(C)CCCCc1ccccc1 11a_100000741445_100015343762 [0,1,0,0,0,1|1,0,0]=3 11900 B15R1.3664 CC(=O)N(C)CCCCc1ccccc1 1626a_100000741445_100015343762 [0,1,0,0,0,1|1,0,0]=3 11901 B15R1.3664 CC(=O)N(C)CCCCc1ccccc1 240690a_100000741445_100015343762 [0,1,0,0,0,1|1,0,0]=3 11902 B15R1.3664 CC(=O)N(C)CCCCc1ccccc1 527a_100000741445_100103153847 [0,1,0,0,0,1|1,0,0]=3 11903 B15R1.3664 CC(=O)N(C)CCCOc1ccccc1 11a_100000225623_100015343762 [0,1,0,0,0,1|2,0,0]=4 11904 B15R1.3664 CC(=O)N(C)CCCOc1ccccc1 1626a_100000225623_100015343762 [0,1,0,0,0,1|2,0,0]=4 11905 B15R1.3664 CC(=O)N(C)CCCOc1ccccc1 240690a_100000225623_100015343762 [0,1,0,0,0,1|2,0,0]=4 11906 B15R1.3664 CC(=O)N(C)CCCOc1ccccc1 527a_100000225623_100103153847 [0,1,0,0,0,1|2,0,0]=4 11907 B15R1.3664 CC(=O)N(C)CCCSc1ccccc1 11a_100015183843_100015343762 [0,1,0,0,0,1|2,0,0]=4 11908 B15R1.3664 CC(=O)N(C)CCCSc1ccccc1 240690a_100015183843_100015343762 [0,1,0,0,0,1|2,0,0]=4 11909 B15R1.3664 CC(=O)N(C)CCCSc1ccccc1 527a_100015183843_100103153847 [0,1,0,0,0,1|2,0,0]=4 11910 B15R1.3664 CC(=O)N(C)CCOCc1ccccc1 11a_100000687121_100015343762 [0,1,0,0,0,1|2,0,0]=4 11911 B15R1.3664 CC(=O)N(C)CCOCc1ccccc1 1626a_100000687121_100015343762 [0,1,0,0,0,1|2,0,0]=4 11912 B15R1.3664 CC(=O)N(C)CCOCc1ccccc1 240690a_100000687121_100015343762 [0,1,0,0,0,1|2,0,0]=4 11913 B15R1.3664 CC(=O)N(C)CCOCc1ccccc1 527a_100000687121_100103153847 [0,1,0,0,0,1|2,0,0]=4 11914 B15R1.3664 CC(CNCCc1ccccc1)C(=O)O 269956a_100000749485_100000765856 [0,1,0,0,0,1|0,0,0]=2 11915 B15R1.3664 CC(CNCCc1ccccn1)C(=O)O 269956a_100000749485_100015183660 [0,1,0,0,0,1|1,0,0]=3 11916 B15R1.3664 CC(CNCCc1cccnc1)C(=O)O 269956a_100000749485_200011713674 [0,1,0,0,0,1|1,0,0]=3 11917 B15R1.3664 CC(CNCCc1ccncc1)C(=O)O 269956a_100000749485_100000723409 [0,1,0,0,0,1|1,0,0]=3 11918 B15R1.3664 CC(CNCSc1ccccc1)C(=O)O 269956a_100000749485_100011218342 [0,1,0,0,0,1|1,0,0]=3 11919 B15R1.3664 CC(COCCc1ccccc1)[N+](=O)[O-] 34a_100000039676_100000765856 [0,1,0,0,0,1|1,0,1]=4 11920 B15R1.3664 CC(COCCc1ccccc1)[N+](=O)[O-] 7a_100000039676_100000765856 [0,1,0,0,0,1|1,0,1]=4 11921 B15R1.3664 CC(NCCCc1ccccc1)C(=O)N 2230a_100000211184_100000702099 [0,1,0,0,0,1|1,0,0]=3 11922 B15R1.3664 CC(NCCCc1ccccc1)C(=O)N 34a_100000211184_100000702099 [0,1,0,0,0,1|1,0,0]=3 11923 B15R1.3664 CC(NCCCc1cccnc1)C(=O)N 2230a_100011532358_100000702099 [0,1,0,0,0,1|2,0,0]=4 11924 B15R1.3664 CC(NCCCc1cccnc1)C(=O)N 34a_100011532358_100000702099 [0,1,0,0,0,1|2,0,0]=4 11925 B15R1.3664 CC(NCCCc1ccncc1)C(=O)N 2230a_100011275580_100000702099 [0,1,0,0,0,1|2,0,0]=4 11926 B15R1.3664 CC(NCCOc1ccccc1)C(=O)N 2230a_100000174943_100000702099 [0,1,0,0,0,1|2,0,0]=4 11927 B15R1.3664 CC(NCCOc1ccccc1)C(=O)N 34a_100000174943_100000702099 [0,1,0,0,0,1|2,0,0]=4 11928 B15R1.3664 CC(NCCSc1ccccc1)C(=O)N 2230a_100000189519_100000702099 [0,1,0,0,0,1|2,0,0]=4 11929 B15R1.3664 CC(OCCCc1ccccc1)C(=O)N 34a_100000210828_100000702099 [0,1,0,0,0,1|1,0,0]=3 11930 B15R1.3664 CC(OCCCc1ccccc1)C(=O)N 7a_100000210828_100000702099 [0,1,0,0,0,1|1,0,0]=3 11931 B15R1.3664 CC(OCCCc1ccccn1)C(=O)N 34a_100011215068_100000702099 [0,1,0,0,0,1|2,0,0]=4 11932 B15R1.3664 CC(OCCCc1cccnc1)C(=O)N 34a_100000211284_100000702099 [0,1,0,0,0,1|2,0,0]=4 11933 B15R1.3664 CC(OCCCc1ccncc1)C(=O)N 34a_100000210659_100000702099 [0,1,0,0,0,1|2,0,0]=4 11934 B15R1.3664 CC(OCCNc1ccccc1)C(=O)N 34a_100000211345_100000702099 [0,1,0,0,0,1|2,0,0]=4 11935 B15R1.3664 CC(OCCOc1ccccc1)C(=O)N 34a_100000210260_100000702099 [0,1,0,0,0,1|2,0,0]=4 11936 B15R1.3664 CC(OCCOc1ccccc1)C(=O)N 7a_100000210260_100000702099 [0,1,0,0,0,1|2,0,0]=4 11937 B15R1.3664 CC(OCCSc1ccccc1)C(=O)N 7a_100000230494_100000702099 [0,1,0,0,0,1|2,0,0]=4 11938 B15R1.3664 CC(SCCCc1ccccc1)C(=O)N 62a_100000211621_100000702099 [0,1,0,0,0,1|1,0,0]=3 11939 B15R1.3664 CC(SCCCc1ccccc1)C(=O)N 62a_100000702099_100000211621 [0,1,0,0,0,1|1,0,0]=3 11940 B15R1.3664 CC(SCCOc1ccccc1)C(=O)N 62a_100000184471_100000702099 [0,1,0,0,0,1|2,0,0]=4 11941 B15R1.3664 CC(SCCOc1ccccc1)C(=O)N 62a_100000702099_100000184471 [0,1,0,0,0,1|2,0,0]=4 11942 B15R1.3664 CC(SCCSc1ccccc1)C(=O)N 62a_100000246102_100000702099 [0,1,0,0,0,1|2,0,0]=4 11943 B15R1.3664 CC(SCCSc1ccccc1)C(=O)N 62a_100000702099_100000246102 [0,1,0,0,0,1|2,0,0]=4 11944 B15R1.3664 CC(SCOCc1ccccc1)C(=O)N 62a_100000702099_100000763385 [0,1,0,0,0,1|2,0,0]=4 11945 B15R1.3664 CC(SCOCc1ccccc1)C(=O)N 62a_100000763385_100000702099 [0,1,0,0,0,1|2,0,0]=4 11946 B15R1.3664 CC(SCSCc1ccccc1)C(=O)N 62a_100000702099_200011217039 [0,1,0,0,0,1|2,0,0]=4 11947 B15R1.3664 CC(SCSCc1ccccc1)C(=O)N 62a_200011217039_100000702099 [0,1,0,0,0,1|2,0,0]=4 11948 B15R1.3664 C[C@@H](NCCCc1ccccc1)C(=O)N 2230a_100000119354_100000211621 [0,1,0,0,0,1|1,0,0]=3 11949 B15R1.3664 C[C@@H](NCCCc1ccccc1)C(=O)N 34a_100000119354_100000211621 [0,1,0,0,0,1|1,0,0]=3 11950 B15R1.3664 C[C@@H](NCCOc1ccccc1)C(=O)N 2230a_100000119354_100000184471 [0,1,0,0,0,1|2,0,0]=4 11951 B15R1.3664 C[C@@H](NCCOc1ccccc1)C(=O)N 270004a_100000119354_100000758736 [0,1,0,0,0,1|2,0,0]=4 11952 B15R1.3664 C[C@@H](NCCOc1ccccc1)C(=O)N 34a_100000119354_100000184471 [0,1,0,0,0,1|2,0,0]=4 11953 B15R1.3664 C[C@@H](NCCSc1ccccc1)C(=O)N 2230a_100000119354_100000246102 [0,1,0,0,0,1|2,0,0]=4 11954 B15R1.3664 C[C@@H](NCCSc1ccccc1)C(=O)N 34a_100000119354_100000246102 [0,1,0,0,0,1|2,0,0]=4 11955 B15R1.3664 C[C@@H](NCOCc1ccccc1)C(=O)N 2230a_100000119354_100000763385 [0,1,0,0,0,1|2,0,0]=4 11956 B15R1.3664 C[C@@H](NCOCc1ccccc1)C(=O)N 34a_100000119354_100000763385 [0,1,0,0,0,1|2,0,0]=4 11957 B15R1.3664 C[C@@H](NCSCc1ccccc1)C(=O)N 2230a_100000119354_200011217039 [0,1,0,0,0,1|2,0,0]=4 11958 B15R1.3664 C[C@@H](NCSCc1ccccc1)C(=O)N 34a_100000119354_200011217039 [0,1,0,0,0,1|2,0,0]=4 11959 B15R1.3664 C[C@@H](O)C(=O)CCCCc1ccccc1 1458a_100000717761_100000701786 [0,1,0,0,0,1|1,0,1]=4 11960 B15R1.3664 C[C@@H](OCCCc1ccccc1)C(=O)N 34a_100000731257_100000211621 [0,1,0,0,0,1|1,0,0]=3 11961 B15R1.3664 C[C@@H](OCCCc1ccccc1)C(=O)N 7a_100000731257_100000211621 [0,1,0,0,0,1|1,0,0]=3 11962 B15R1.3664 C[C@@H](OCCOc1ccccc1)C(=O)N 34a_100000731257_100000184471 [0,1,0,0,0,1|2,0,0]=4 11963 B15R1.3664 C[C@@H](OCCOc1ccccc1)C(=O)N 7a_100000731257_100000184471 [0,1,0,0,0,1|2,0,0]=4 11964 B15R1.3664 C[C@@H](OCCSc1ccccc1)C(=O)N 34a_100000731257_100000246102 [0,1,0,0,0,1|2,0,0]=4 11965 B15R1.3664 C[C@@H](OCCSc1ccccc1)C(=O)N 7a_100000731257_100000246102 [0,1,0,0,0,1|2,0,0]=4 11966 B15R1.3664 C[C@@H](OCOCc1ccccc1)C(=O)N 34a_100000731257_100000763385 [0,1,0,0,0,1|2,0,0]=4 11967 B15R1.3664 C[C@@H](OCSCc1ccccc1)C(=O)N 34a_100000731257_200011217039 [0,1,0,0,0,1|2,0,0]=4 11968 B15R1.3664 C[C@H](NC/C=C/c1ccccc1)C(=O)O 269956a_100000743915_100016265936 [0,1,0,0,0,1|0,0,2]=4 11969 B15R1.3664 C[C@H](NCC#Cc1ccccc1)C(=O)O 269956a_100000743915_100011352542 [0,1,0,0,0,1|0,0,2]=4 11970 B15R1.3664 C[C@H](NCCCc1ccccc1)C(=O)O 269956a_100000743915_100000211621 [0,1,0,0,0,1|0,0,0]=2 11971 B15R1.3664 C[C@H](NCCOc1ccccc1)C(=O)O 269956a_100000743915_100000184471 [0,1,0,0,0,1|1,0,0]=3 11972 B15R1.3664 C[C@H](NCCSc1ccccc1)C(=O)O 269956a_100000743915_100000246102 [0,1,0,0,0,1|1,0,0]=3 11973 B15R1.3664 C[C@H](NCOCc1ccccc1)C(=O)O 269956a_100000743915_100000763385 [0,1,0,0,0,1|1,0,0]=3 11974 B15R1.3664 C[C@H](NCSCc1ccccc1)C(=O)O 269956a_100000743915_200011217039 [0,1,0,0,0,1|1,0,0]=3 11975 B15R1.3664 C[C@H](O)C(=O)CCCCc1ccccc1 1458a_217856618621_100000701786 [0,1,0,0,0,1|1,0,1]=4 11976 B15R1.3664 C[C@H](OCCCc1ccccc1)C(=O)[O-] 7a_217856618621_100000211621 [0,1,0,0,0,1|0,0,1]=3 11977 B15R1.3664 C[C@H](OCCOc1ccccc1)C(=O)[O-] 7a_217856618621_100000184471 [0,1,0,0,0,1|1,0,1]=4 11978 B15R1.3664 C[C@H](OCCSc1ccccc1)C(=O)[O-] 7a_217856618621_100000246102 [0,1,0,0,0,1|1,0,1]=4 11979 B15R1.3664 NC(=O)C(=O)NCCCc1ccccc1 240690a_100000211184_100011215815 [0,1,0,0,0,1|1,0,1]=4 11980 B15R1.3664 NC(=O)C(F)NCCCc1ccccc1 2230a_100000211184_100009813875 [0,1,0,0,0,1|1,0,0]=3 11981 B15R1.3664 NC(=O)C(F)NCCCc1ccccc1 34a_100000211184_100009813875 [0,1,0,0,0,1|1,0,0]=3 11982 B15R1.3664 NC(=O)C(F)NCCCc1cccnc1 2230a_100011532358_100009813875 [0,1,0,0,0,1|2,0,0]=4 11983 B15R1.3664 NC(=O)C(F)NCCCc1cccnc1 34a_100011532358_100009813875 [0,1,0,0,0,1|2,0,0]=4 11984 B15R1.3664 NC(=O)C(F)NCCCc1ccncc1 2230a_100011275580_100009813875 [0,1,0,0,0,1|2,0,0]=4 11985 B15R1.3664 NC(=O)C(F)NCCOc1ccccc1 2230a_100000174943_100009813875 [0,1,0,0,0,1|2,0,0]=4 11986 B15R1.3664 NC(=O)C(F)NCCOc1ccccc1 34a_100000174943_100009813875 [0,1,0,0,0,1|2,0,0]=4 11987 B15R1.3664 NC(=O)C(F)NCCSc1ccccc1 2230a_100000189519_100009813875 [0,1,0,0,0,1|2,0,0]=4 11988 B15R1.3664 NC(=O)C(F)OCCCc1ccccc1 34a_100000210828_100009813875 [0,1,0,0,0,1|1,0,0]=3 11989 B15R1.3664 NC(=O)C(F)OCCCc1ccccc1 7a_100000210828_100009813875 [0,1,0,0,0,1|1,0,0]=3 11990 B15R1.3664 NC(=O)C(F)OCCCc1ccccn1 34a_100011215068_100009813875 [0,1,0,0,0,1|2,0,0]=4 11991 B15R1.3664 NC(=O)C(F)OCCCc1cccnc1 34a_100000211284_100009813875 [0,1,0,0,0,1|2,0,0]=4 11992 B15R1.3664 NC(=O)C(F)OCCCc1ccncc1 34a_100000210659_100009813875 [0,1,0,0,0,1|2,0,0]=4 11993 B15R1.3664 NC(=O)C(F)OCCNc1ccccc1 34a_100000211345_100009813875 [0,1,0,0,0,1|2,0,0]=4 11994 B15R1.3664 NC(=O)C(F)OCCOc1ccccc1 34a_100000210260_100009813875 [0,1,0,0,0,1|2,0,0]=4 11995 B15R1.3664 NC(=O)C(F)OCCOc1ccccc1 7a_100000210260_100009813875 [0,1,0,0,0,1|2,0,0]=4 11996 B15R1.3664 NC(=O)C(F)OCCSc1ccccc1 7a_100000230494_100009813875 [0,1,0,0,0,1|2,0,0]=4 11997 B15R1.3664 NC(=O)C(F)SCCCc1ccccc1 62a_100000211621_100009813875 [0,1,0,0,0,1|1,0,0]=3 11998 B15R1.3664 NC(=O)C(F)SCCCc1ccccc1 62a_100009813875_100000211621 [0,1,0,0,0,1|1,0,0]=3 11999 B15R1.3664 NC(=O)C(F)SCCOc1ccccc1 62a_100000184471_100009813875 [0,1,0,0,0,1|2,0,0]=4 12000 B15R1.3664 NC(=O)C(F)SCCOc1ccccc1 62a_100009813875_100000184471 [0,1,0,0,0,1|2,0,0]=4 12001 B15R1.3664 NC(=O)C(F)SCCSc1ccccc1 62a_100000246102_100009813875 [0,1,0,0,0,1|2,0,0]=4 12002 B15R1.3664 NC(=O)C(F)SCCSc1ccccc1 62a_100009813875_100000246102 [0,1,0,0,0,1|2,0,0]=4 12003 B15R1.3664 NC(=O)C(F)SCOCc1ccccc1 62a_100000763385_100009813875 [0,1,0,0,0,1|2,0,0]=4 12004 B15R1.3664 NC(=O)C(F)SCOCc1ccccc1 62a_100009813875_100000763385 [0,1,0,0,0,1|2,0,0]=4 12005 B15R1.3664 NC(=O)C(F)SCSCc1ccccc1 62a_100009813875_200011217039 [0,1,0,0,0,1|2,0,0]=4 12006 B15R1.3664 NC(=O)C(F)SCSCc1ccccc1 62a_200011217039_100009813875 [0,1,0,0,0,1|2,0,0]=4 12007 B15R1.3664 NC(=O)[C@@H](N)COCCc1ccccc1 34a_100000729942_100000765856 [0,1,0,0,0,1|1,0,0]=3 12008 B15R1.3664 O=C(CCCCc1ccccc1)C(O)O 1458a_100000233687_100000701786 [0,1,0,0,0,1|0,0,2]=4 12009 B15R1.3664 O=C(O)C(F)CNCCc1ccccc1 269956a_100000084737_100000765856 [0,1,0,0,0,1|0,0,0]=2 12010 B15R1.3664 O=C(O)C(F)CNCCc1ccccn1 269956a_100000084737_100015183660 [0,1,0,0,0,1|1,0,0]=3 12011 B15R1.3664 O=C(O)C(F)CNCCc1cccnc1 269956a_100000084737_200011713674 [0,1,0,0,0,1|1,0,0]=3 12012 B15R1.3664 O=C(O)C(F)CNCCc1ccncc1 269956a_100000084737_100000723409 [0,1,0,0,0,1|1,0,0]=3 12013 B15R1.3664 O=C(O)C(F)CNCSc1ccccc1 269956a_100000084737_100011218342 [0,1,0,0,0,1|1,0,0]=3 12014 B15R1.3664 O=C([O-])C(F)NCCCc1ccccc1 34a_100000211184_100020610796 [0,1,0,0,0,1|0,0,1]=3 12015 B15R1.3664 O=C([O-])C(F)NCCCc1cccnc1 34a_100011532358_100020610796 [0,1,0,0,0,1|1,0,1]=4 12016 B15R1.3664 O=C([O-])C(F)NCCOc1ccccc1 34a_100000174943_100020610796 [0,1,0,0,0,1|1,0,1]=4 12017 B15R1.3664 O=C([O-])C(F)OCCCc1ccccc1 34a_100000210828_100020610796 [0,1,0,0,0,1|0,0,1]=3 12018 B15R1.3664 O=C([O-])C(F)OCCCc1ccccn1 34a_100011215068_100020610796 [0,1,0,0,0,1|1,0,1]=4 12019 B15R1.3664 O=C([O-])C(F)OCCCc1cccnc1 34a_100000211284_100020610796 [0,1,0,0,0,1|1,0,1]=4 12020 B15R1.3664 O=C([O-])C(F)OCCCc1ccncc1 34a_100000210659_100020610796 [0,1,0,0,0,1|1,0,1]=4 12021 B15R1.3664 O=C([O-])C(F)OCCNc1ccccc1 34a_100000211345_100020610796 [0,1,0,0,0,1|1,0,1]=4 12022 B15R1.3664 O=C([O-])C(F)OCCOc1ccccc1 34a_100000210260_100020610796 [0,1,0,0,0,1|1,0,1]=4 12023 B15R1.3664 O=C([O-])C(F)SCCCc1ccccc1 62a_100000211621_100020610796 [0,1,0,0,0,1|0,0,1]=3 12024 B15R1.3664 O=C([O-])C(F)SCCCc1ccccc1 62a_100020610796_100000211621 [0,1,0,0,0,1|0,0,1]=3 12025 B15R1.3664 O=C([O-])C(F)SCCOc1ccccc1 62a_100000184471_100020610796 [0,1,0,0,0,1|1,0,1]=4 12026 B15R1.3664 O=C([O-])C(F)SCCOc1ccccc1 62a_100020610796_100000184471 [0,1,0,0,0,1|1,0,1]=4 12027 B15R1.3664 O=C([O-])C(F)SCCSc1ccccc1 62a_100000246102_100020610796 [0,1,0,0,0,1|1,0,1]=4 12028 B15R1.3664 O=C([O-])C(F)SCCSc1ccccc1 62a_100020610796_100000246102 [0,1,0,0,0,1|1,0,1]=4 12029 B15R1.3664 O=C([O-])C(F)SCOCc1ccccc1 62a_100000763385_100020610796 [0,1,0,0,0,1|1,0,1]=4 12030 B15R1.3664 O=C([O-])C(F)SCOCc1ccccc1 62a_100020610796_100000763385 [0,1,0,0,0,1|1,0,1]=4 12031 B15R1.3664 O=C([O-])C(F)SCSCc1ccccc1 62a_100020610796_200011217039 [0,1,0,0,0,1|1,0,1]=4 12032 B15R1.3664 O=C([O-])C(F)SCSCc1ccccc1 62a_200011217039_100020610796 [0,1,0,0,0,1|1,0,1]=4 12033 B15R1.3890 CC(C)(O)CCCNCc1ccccc1 2230a_100015324214_100009888830 [0,1,0,0,0,1|1,0,1]=4 12034 B15R1.3890 CC(C)(O)CCCNCc1ccccc1 34a_100015324214_100009888830 [0,1,0,0,0,1|1,0,1]=4 12035 B15R1.3890 CC(C)(O)CCCOCc1ccccc1 34a_100000210790_100009888830 [0,1,0,0,0,1|1,0,1]=4 12036 B15R1.3890 CC(C)(O)CCCOCc1ccccc1 7a_100000210790_100009888830 [0,1,0,0,0,1|1,0,1]=4 12037 B15R1.3890 CC(C)(O)CCCSCc1ccccc1 62a_100000211182_100009888830 [0,1,0,0,0,1|1,0,1]=4 12038 B15R1.3890 CC(C)(O)CCCSCc1ccccc1 62a_100009888830_100015291786 [0,1,0,0,0,1|1,0,1]=4 12039 B15R1.3890 CC(C)(O)CCNCCc1ccccc1 2230a_100000106460_100000702414 [0,1,0,0,0,1|1,0,1]=4 12040 B15R1.3890 CC(C)(O)CCNCCc1ccccc1 34a_100000106460_100000702414 [0,1,0,0,0,1|1,0,1]=4 12041 B15R1.3890 CC(C)(O)CCOCCc1ccccc1 34a_100000210268_100000702414 [0,1,0,0,0,1|1,0,1]=4 12042 B15R1.3890 CC(C)(O)CCOCCc1ccccc1 7a_100000210268_100000702414 [0,1,0,0,0,1|1,0,1]=4 12043 B15R1.3890 CC(C)(O)CCSCCc1ccccc1 62a_100000702414_100011218657 [0,1,0,0,0,1|1,0,1]=4 12044 B15R1.3890 CC(C)(O)CCSCCc1ccccc1 62a_100000765856_100000702414 [0,1,0,0,0,1|1,0,1]=4 12045 B15R1.3890 CC(C)(O)CNCCCc1ccccc1 2230a_100000751335_100000211621 [0,1,0,0,0,1|1,0,1]=4 12046 B15R1.3890 CC(C)(O)CNCCCc1ccccc1 34a_100000211184_100000764493 [0,1,0,0,0,1|1,0,1]=4 12047 B15R1.3890 CC(C)(O)COCCCc1ccccc1 34a_100000210828_100000764493 [0,1,0,0,0,1|1,0,1]=4 12048 B15R1.3890 CC(C)(O)COCCCc1ccccc1 7a_100000210828_100000764493 [0,1,0,0,0,1|1,0,1]=4 12049 B15R1.3890 CC(C)(O)CSCCCc1ccccc1 62a_100000211621_100000764493 [0,1,0,0,0,1|1,0,1]=4 12050 B15R1.3890 CC(C)(O)CSCCCc1ccccc1 62a_100000764493_100000211621 [0,1,0,0,0,1|1,0,1]=4 12051 B15R1.3890 CS(=O)(=O)CCCNCc1ccccc1 207a_100000742409_100015611070 [0,1,0,0,0,1|1,0,1]=4 12052 B15R1.3890 CS(=O)(=O)CCCNCc1ccccc1 2230a_100000742409_100015291786 [0,1,0,0,0,1|1,0,1]=4 12053 B15R1.3890 CS(=O)(=O)CCCNCc1ccccc1 2230a_100015324214_100000754308 [0,1,0,0,0,1|1,0,1]=4 12054 B15R1.3890 CS(=O)(=O)CCCNCc1ccccc1 270004a_100000742409_100015611070 [0,1,0,0,0,1|1,0,1]=4 12055 B15R1.3890 CS(=O)(=O)CCCNCc1ccccc1 34a_100000742409_100015291786 [0,1,0,0,0,1|1,0,1]=4 12056 B15R1.3890 CS(=O)(=O)CCCNCc1ccccc1 34a_100015324214_100000754308 [0,1,0,0,0,1|1,0,1]=4 12057 B15R1.3890 CS(=O)(=O)CCCOCc1ccccc1 34a_100000210790_100000754308 [0,1,0,0,0,1|1,0,1]=4 12058 B15R1.3890 CS(=O)(=O)CCCOCc1ccccc1 34a_100000689940_100015291786 [0,1,0,0,0,1|1,0,1]=4 12059 B15R1.3890 CS(=O)(=O)CCCOCc1ccccc1 7a_100000210790_100000754308 [0,1,0,0,0,1|1,0,1]=4 12060 B15R1.3890 CS(=O)(=O)CCCOCc1ccccc1 7a_100000689940_100000211182 [0,1,0,0,0,1|1,0,1]=4 12061 B15R1.3890 CS(=O)(=O)CCCSCc1ccccc1 62a_100000211182_100000754308 [0,1,0,0,0,1|1,0,1]=4 12062 B15R1.3890 CS(=O)(=O)CCCSCc1ccccc1 62a_100000754308_100015291786 [0,1,0,0,0,1|1,0,1]=4 12063 B15R1.3890 CS(=O)(=O)CCNCCc1ccccc1 2230a_100000106460_100000731031 [0,1,0,0,0,1|1,0,1]=4 12064 B15R1.3890 CS(=O)(=O)CCNCCc1ccccc1 2230a_100000740961_100000765856 [0,1,0,0,0,1|1,0,1]=4 12065 B15R1.3890 CS(=O)(=O)CCNCCc1ccccc1 34a_100000106460_100000731031 [0,1,0,0,0,1|1,0,1]=4 12066 B15R1.3890 CS(=O)(=O)CCNCCc1ccccc1 34a_100000740961_100000765856 [0,1,0,0,0,1|1,0,1]=4 12067 B15R1.3890 CS(=O)(=O)CCOCCc1ccccc1 34a_100000210268_100000731031 [0,1,0,0,0,1|1,0,1]=4 12068 B15R1.3890 CS(=O)(=O)CCOCCc1ccccc1 34a_100000211924_100000765856 [0,1,0,0,0,1|1,0,1]=4 12069 B15R1.3890 CS(=O)(=O)CCOCCc1ccccc1 7a_100000210268_100000230027 [0,1,0,0,0,1|1,0,1]=4 12070 B15R1.3890 CS(=O)(=O)CCOCCc1ccccc1 7a_100000211924_100000765856 [0,1,0,0,0,1|1,0,1]=4 12071 B15R1.3890 CS(=O)(=O)CCSCCc1ccccc1 62a_100000731031_100011218657 [0,1,0,0,0,1|1,0,1]=4 12072 B15R1.3890 CS(=O)(=O)CCSCCc1ccccc1 62a_100000765856_100000230027 [0,1,0,0,0,1|1,0,1]=4 12073 B15R1.3890 CS(=O)(=O)NCCCCc1ccccc1 40a_100015280158_100000738038 [0,1,0,0,0,1|1,0,1]=4 12074 B15R1.3890 NS(=O)(=O)CCCNCc1ccccc1 2230a_100015324214_100000750626 [0,1,0,0,0,1|1,0,1]=4 12075 B15R1.3890 NS(=O)(=O)CCCNCc1ccccc1 34a_100015324214_100000750626 [0,1,0,0,0,1|1,0,1]=4 12076 B15R1.3890 NS(=O)(=O)CCCOCc1ccccc1 34a_100000210790_100000750626 [0,1,0,0,0,1|1,0,1]=4 12077 B15R1.3890 NS(=O)(=O)CCCOCc1ccccc1 7a_100000210790_100000750626 [0,1,0,0,0,1|1,0,1]=4 12078 B15R1.3890 NS(=O)(=O)CCCSCc1ccccc1 62a_100000211182_100000750626 [0,1,0,0,0,1|1,0,1]=4 12079 B15R1.3890 NS(=O)(=O)CCCSCc1ccccc1 62a_100000750626_100015291786 [0,1,0,0,0,1|1,0,1]=4 12080 B15R1.3890 NS(=O)(=O)CCNCCc1ccccc1 2230a_100000738205_100000765856 [0,1,0,0,0,1|1,0,1]=4 12081 B15R1.3890 NS(=O)(=O)CCNCCc1ccccc1 34a_100000738205_100000765856 [0,1,0,0,0,1|1,0,1]=4 12082 B15R1.3890 NS(=O)(=O)CCOCCc1ccccc1 34a_100012334274_100000765856 [0,1,0,0,0,1|1,0,1]=4 12083 B15R1.3890 NS(=O)(=O)CSCCCc1ccccc1 62a_100000211621_100000741382 [0,1,0,0,0,1|1,0,1]=4 12084 B15R1.3890 NS(=O)(=O)CSCCCc1ccccc1 62a_100000741382_100000211621 [0,1,0,0,0,1|1,0,1]=4 12085 B15R1.3890 O=S(=O)([O-])CCCNCc1ccccc1 34a_100015324214_100009813499 [0,1,0,0,0,1|1,0,1]=4 12086 B15R1.3890 O=S(=O)([O-])CCCOCc1ccccc1 34a_100000210790_100009813499 [0,1,0,0,0,1|1,0,1]=4 12087 B15R1.3890 O=S(=O)([O-])CCCSCc1ccccc1 62a_100000211182_100009813499 [0,1,0,0,0,1|1,0,1]=4 12088 B15R1.3890 O=S(=O)([O-])CCCSCc1ccccc1 62a_100009813499_100015291786 [0,1,0,0,0,1|1,0,1]=4 12089 B15R1.3890 O=S(=O)([O-])CCNCCc1ccccc1 2230a_100000106460_100000737633 [0,1,0,0,0,1|1,0,1]=4 12090 B15R1.3890 O=S(=O)([O-])CCNCCc1ccccc1 34a_100000106460_100000762736 [0,1,0,0,0,1|1,0,1]=4 12091 B15R1.3890 O=S(=O)([O-])CCOCCc1ccccc1 34a_100000210268_100000762736 [0,1,0,0,0,1|1,0,1]=4 12092 B15R1.3890 O=S(=O)([O-])CCSCCc1ccccc1 62a_100000762736_100011218657 [0,1,0,0,0,1|1,0,1]=4 12093 B15R1.3890 O=S(=O)([O-])CCSCCc1ccccc1 62a_100000765856_100000762736 [0,1,0,0,0,1|1,0,1]=4 12094 B15R1.3890 O=S(=O)([O-])CNCCCc1ccccc1 34a_100000211184_100009817235 [0,1,0,0,0,1|1,0,1]=4 12095 B15R1.3890 O=S(=O)([O-])COCCCc1ccccc1 34a_100000210828_100009817235 [0,1,0,0,0,1|1,0,1]=4 12096 B15R1.3890 O=S(=O)([O-])CSCCCc1ccccc1 62a_100000211621_100009817235 [0,1,0,0,0,1|1,0,1]=4 12097 B15R1.3890 O=S(=O)([O-])CSCCCc1ccccc1 62a_100009817235_100000211621 [0,1,0,0,0,1|1,0,1]=4 12098 B15R1.3890 O[Si](O)(O)CCCNCc1ccccc1 207a_100000066040_100015611070 [0,1,0,0,0,1|0,1,1]=4 12099 B15R1.5919 C=C(C)CCC(=O)CCc1ccccc1 1458a_100000185753_100000730704 [0,1,0,0,0,1|2,0,0]=4 12100 B15R1.5919 C=C(C)CCC(=O)CCc1ccccc1 1458a_200000688413_100000765856 [0,1,0,0,0,1|2,0,0]=4 12101 B15R1.5919 C=C(C)CCC(C)NCc1ccccc1 270004a_100015324214_100011215600 [0,1,0,0,0,1|2,0,0]=4 12102 B15R1.5919 C=C(C)CCN(C)CCc1ccccc1 2230a_100000207497_100000730704 [0,1,0,0,0,1|2,0,0]=4 12103 B15R1.5919 C=C(C)CCN(C)CCc1ccccc1 269982a_100000207497_100000730704 [0,1,0,0,0,1|2,0,0]=4 12104 B15R1.5919 C=C(C)CNC(C)CCc1ccccc1 2230a_100000210798_100000748629 [0,1,0,0,0,1|2,0,0]=4 12105 B15R1.5919 C=C(C)CNC(C)CCc1ccccc1 34a_100000210798_100000748629 [0,1,0,0,0,1|2,0,0]=4 12106 B15R1.5919 C=C(C)CO[C@@H](C)CCc1ccccc1 34a_100009815974_100000748629 [0,1,0,0,0,1|2,0,0]=4 12107 B15R1.5919 C=C(C)CO[C@@H](C)CCc1ccccc1 7a_100009815974_100000748629 [0,1,0,0,0,1|2,0,0]=4 12108 B15R1.5919 C=C(F)CNC(C)CCc1ccccc1 2230a_100000210798_100009893438 [0,1,0,0,0,1|2,0,0]=4 12109 B15R1.5919 C=C(F)CNC(C)CCc1ccccc1 34a_100000210798_100009893438 [0,1,0,0,0,1|2,0,0]=4 12110 B15R1.5919 C=C(F)CO[C@@H](C)CCc1ccccc1 34a_100009815974_100009893438 [0,1,0,0,0,1|2,0,0]=4 12111 B15R1.5919 C=C(F)CO[C@@H](C)CCc1ccccc1 7a_100009815974_100000042424 [0,1,0,0,0,1|2,0,0]=4 12112 B15R1.5919 CC(=O)CCC(=O)NCc1ccccc1 1458a_100000185749_200000210301 [0,1,0,0,0,1|1,0,1]=4 12113 B15R1.5919 CC(=O)CCC(=O)OCc1ccccc1 1458a_100000066287_200000210301 [0,1,0,0,0,1|1,0,1]=4 12114 B15R1.5919 CC(=O)CCC(=O)OCc1ccccc1 1458a_100000070787_100009813219 [0,1,0,0,0,1|1,0,1]=4 12115 B15R1.5919 CC(=O)CCN(C)CCc1ccccc1 269982a_100000207497_100000053229 [0,1,0,0,0,1|1,0,0]=3 12116 B15R1.5919 CC(=O)CCN(C)CCc1ccccn1 269982a_100000737206_100000053229 [0,1,0,0,0,1|2,0,0]=4 12117 B15R1.5919 CC(=O)CCN(C)CCc1cccnc1 269982a_100000763209_100000053229 [0,1,0,0,0,1|2,0,0]=4 12118 B15R1.5919 CC(=O)CCN(C)CCc1ccncc1 269982a_100000742850_100000053229 [0,1,0,0,0,1|2,0,0]=4 12119 B15R1.5919 CC(=O)CNC(=O)CCc1ccccc1 1458a_100000194590_200000210301 [0,1,0,0,0,1|1,0,1]=4 12120 B15R1.5919 CC(=O)NCC(=O)CCc1ccccc1 1458a_100000194580_100000765856 [0,1,0,0,0,1|1,0,1]=4 12121 B15R1.5919 CC(=O)NCC(O)COc1ccccc1 240690a_100000738913_100015343762 [0,1,0,0,0,1|2,0,0]=4 12122 B15R1.5919 CC(=O)NCC(O)COc1ccccc1 527a_100000738913_100103153847 [0,1,0,0,0,1|2,0,0]=4 12123 B15R1.5919 CC(=O)OCC(=O)CCc1ccccc1 1458a_100000183556_100000765856 [0,1,0,0,0,1|1,0,1]=4 12124 B15R1.5919 CC(=O)OCC(C)NCc1ccccc1 270004a_100015324214_100000000629 [0,1,0,0,0,1|2,0,0]=4 12125 B15R1.5919 CC(=O)OCC(O)CNc1ccccc1 34a_100000106764_200000139349 [0,1,0,0,0,1|2,0,0]=4 12126 B15R1.5919 CC(=O)OCC(O)COc1ccccc1 34a_100000210340_200000139349 [0,1,0,0,0,1|2,0,0]=4 12127 B15R1.5919 CC(=O)OCC(O)COc1ccccc1 7a_100000210340_200000139349 [0,1,0,0,0,1|2,0,0]=4 12128 B15R1.5919 CC(=O)OCC(O)CSc1ccccc1 62a_100000719477_200000139349 [0,1,0,0,0,1|2,0,0]=4 12129 B15R1.5919 CC(=O)OCC(O)CSc1ccccc1 62a_200000139349_100000041952 [0,1,0,0,0,1|2,0,0]=4 12130 B15R1.5919 CC(=O)OCN(C)CCc1ccccc1 269982a_100000207497_100000076356 [0,1,0,0,0,1|2,0,0]=4 12131 B15R1.5919 CC(=O)SCC(=O)CCc1ccccc1 1458a_100000049016_100000765856 [0,1,0,0,0,1|1,0,1]=4 12132 B15R1.5919 CC(=O)SCC(C)CNc1ccccc1 34a_100000106764_200000116872 [0,1,0,0,0,1|2,0,0]=4 12133 B15R1.5919 CC(=O)SCC(C)COc1ccccc1 34a_100000210340_200000116872 [0,1,0,0,0,1|2,0,0]=4 12134 B15R1.5919 CC(=O)SCC(C)COc1ccccc1 7a_100000210340_200000116872 [0,1,0,0,0,1|2,0,0]=4 12135 B15R1.5919 CC(=O)SCC(C)CSc1ccccc1 62a_100000719477_200000116872 [0,1,0,0,0,1|2,0,0]=4 12136 B15R1.5919 CC(=O)SCC(C)CSc1ccccc1 62a_200000116872_100000041952 [0,1,0,0,0,1|2,0,0]=4 12137 B15R1.5919 CC(CCc1ccccc1)NCC(=O)N 2230a_100000210798_100000747473 [0,1,0,0,0,1|1,0,0]=3 12138 B15R1.5919 CC(CCc1ccccc1)NCC(=O)N 34a_100000210798_100000187820 [0,1,0,0,0,1|1,0,0]=3 12139 B15R1.5919 CC(CCc1ccccc1)NCC(=O)[O-] 34a_100000210798_100020667443 [0,1,0,0,0,1|0,0,1]=3 12140 B15R1.5919 CC(CCc1ccccc1)NC[C@@H](C)O 2230a_100000210798_100009817552 [0,1,0,0,0,1|1,0,1]=4 12141 B15R1.5919 CC(CCc1ccccc1)NC[C@@H](C)O 34a_100000210798_100009817552 [0,1,0,0,0,1|1,0,1]=4 12142 B15R1.5919 CC(CCc1ccccc1)NC[N+](=O)[O-] 34a_100000210798_100000761209 [0,1,0,0,0,1|1,0,1]=4 12143 B15R1.5919 CC(COc1ccccc1)NCC(=O)N 2230a_100000746794_100000747473 [0,1,0,0,0,1|2,0,0]=4 12144 B15R1.5919 CC(COc1ccccc1)NCC(=O)N 34a_100000746794_100000187820 [0,1,0,0,0,1|2,0,0]=4 12145 B15R1.5919 CC(COc1ccccc1)NCC(=O)[O-] 34a_100000746794_100020667443 [0,1,0,0,0,1|1,0,1]=4 12146 B15R1.5919 CC(COc1ccccc1)OCC(=O)N 34a_100000210911_100000187820 [0,1,0,0,0,1|2,0,0]=4 12147 B15R1.5919 CC(COc1ccccc1)OCC(=O)N 7a_100000210911_100000187820 [0,1,0,0,0,1|2,0,0]=4 12148 B15R1.5919 CC(COc1ccccc1)OCC(=O)[O-] 34a_100000210911_100020667443 [0,1,0,0,0,1|1,0,1]=4 12149 B15R1.5919 CC(O)CCC(=O)CCc1ccccc1 1458a_100000185753_100012276601 [0,1,0,0,0,1|1,0,1]=4 12150 B15R1.5919 CC(O)CCN(C)CCc1ccccc1 2230a_100000207497_100012276601 [0,1,0,0,0,1|1,0,1]=4 12151 B15R1.5919 CC(O)CCN(C)CCc1ccccc1 269982a_100000207497_100012276601 [0,1,0,0,0,1|1,0,1]=4 12152 B15R1.5919 CC(O)CNC(C)CCc1ccccc1 2230a_100000210798_100011218427 [0,1,0,0,0,1|1,0,1]=4 12153 B15R1.5919 CC(O)CNC(C)CCc1ccccc1 270004a_100000210904_100000210092 [0,1,0,0,0,1|1,0,1]=4 12154 B15R1.5919 CC(O)CNC(C)CCc1ccccc1 34a_100000210798_100011218427 [0,1,0,0,0,1|1,0,1]=4 12155 B15R1.5919 CC(O)CO[C@@H](C)CCc1ccccc1 34a_100009815974_100011218427 [0,1,0,0,0,1|1,0,1]=4 12156 B15R1.5919 CC(O)CO[C@@H](C)CCc1ccccc1 7a_100009815974_100011218427 [0,1,0,0,0,1|1,0,1]=4 12157 B15R1.5919 CN(CCC(=O)N)CCc1ccccc1 2230a_100000207497_100000744528 [0,1,0,0,0,1|1,0,0]=3 12158 B15R1.5919 CN(CCC(=O)N)CCc1ccccc1 2230a_100000730477_100000765856 [0,1,0,0,0,1|1,0,0]=3 12159 B15R1.5919 CN(CCC(=O)N)CCc1ccccc1 2230a_200000177543_200000210301 [0,1,0,0,0,1|1,0,0]=3 12160 B15R1.5919 CN(CCC(=O)N)CCc1ccccc1 269982a_100000207497_100000744528 [0,1,0,0,0,1|1,0,0]=3 12161 B15R1.5919 CN(CCC(=O)N)CCc1ccccc1 269982a_200000177543_200000210301 [0,1,0,0,0,1|1,0,0]=3 12162 B15R1.5919 CN(CCC(=O)N)CCc1ccccc1 34a_200000177543_200000210301 [0,1,0,0,0,1|1,0,0]=3 12163 B15R1.5919 CN(CCC(=O)N)CCc1ccccn1 2230a_100000730477_100015183660 [0,1,0,0,0,1|2,0,0]=4 12164 B15R1.5919 CN(CCC(=O)N)CCc1ccccn1 2230a_100000737206_100000744528 [0,1,0,0,0,1|2,0,0]=4 12165 B15R1.5919 CN(CCC(=O)N)CCc1ccccn1 269982a_100000737206_100000744528 [0,1,0,0,0,1|2,0,0]=4 12166 B15R1.5919 CN(CCC(=O)N)CCc1cccnc1 2230a_100000730477_200011713674 [0,1,0,0,0,1|2,0,0]=4 12167 B15R1.5919 CN(CCC(=O)N)CCc1cccnc1 2230a_100000763209_100000744528 [0,1,0,0,0,1|2,0,0]=4 12168 B15R1.5919 CN(CCC(=O)N)CCc1cccnc1 269982a_100000763209_100000744528 [0,1,0,0,0,1|2,0,0]=4 12169 B15R1.5919 CN(CCC(=O)N)CCc1ccncc1 2230a_100000730477_100000723409 [0,1,0,0,0,1|2,0,0]=4 12170 B15R1.5919 CN(CCC(=O)N)CCc1ccncc1 2230a_100000742850_100000744528 [0,1,0,0,0,1|2,0,0]=4 12171 B15R1.5919 CN(CCC(=O)N)CCc1ccncc1 269982a_100000742850_100000744528 [0,1,0,0,0,1|2,0,0]=4 12172 B15R1.5919 CN(CCC(=O)N)CSc1ccccc1 2230a_100000730477_100011218342 [0,1,0,0,0,1|2,0,0]=4 12173 B15R1.5919 C[C@@H](CCc1ccccc1)OCC(=O)N 34a_100009815974_100000187820 [0,1,0,0,0,1|1,0,0]=3 12174 B15R1.5919 C[C@@H](CCc1ccccc1)OCC(=O)N 7a_100009815974_100000187820 [0,1,0,0,0,1|1,0,0]=3 12175 B15R1.5919 C[C@@H](CCc1ccccc1)OCC(=O)[O-] 34a_100009815974_100020667443 [0,1,0,0,0,1|0,0,1]=3 12176 B15R1.5919 C[C@@H](CCc1ccccc1)OC[N+](=O)[O-] 34a_100009815974_100000761209 [0,1,0,0,0,1|1,0,1]=4 12177 B15R1.5919 C[C@@H](O)CO[C@@H](C)CCc1ccccc1 34a_100009815974_100009817552 [0,1,0,0,0,1|1,0,1]=4 12178 B15R1.5919 C[C@@H](O)CO[C@@H](C)CCc1ccccc1 7a_100009815974_100009817552 [0,1,0,0,0,1|1,0,1]=4 12179 B15R1.5919 NC(=O)CCC(=O)CCc1ccccc1 1458a_100011215257_100000765856 [0,1,0,0,0,1|1,0,0]=3 12180 B15R1.5919 NC(=O)CCC(=O)CCc1ccccn1 1458a_100011215257_100015183660 [0,1,0,0,0,1|2,0,0]=4 12181 B15R1.5919 NC(=O)CCC(=O)CCc1cccnc1 1458a_100011215257_200011713674 [0,1,0,0,0,1|2,0,0]=4 12182 B15R1.5919 NC(=O)CCC(=O)CCc1ccncc1 1458a_100011215257_100000723409 [0,1,0,0,0,1|2,0,0]=4 12183 B15R1.5919 NC(=O)CCC(=O)NCc1ccccc1 240690a_100015324214_100011215257 [0,1,0,0,0,1|1,0,1]=4 12184 B15R1.5919 NC(=O)CCC(=O)NCc1ccccc1 527a_100015324214_100011215257 [0,1,0,0,0,1|1,0,1]=4 12185 B15R1.5919 NC(=O)CNC(=O)CCc1ccccc1 11a_100000711301_100000185753 [0,1,0,0,0,1|1,0,1]=4 12186 B15R1.5919 NC(=O)CNC(=O)CCc1ccccc1 240690a_100000711301_100000185753 [0,1,0,0,0,1|1,0,1]=4 12187 B15R1.5919 NC(=O)CNC(=O)CCc1ccccc1 527a_100000711301_100000185753 [0,1,0,0,0,1|1,0,1]=4 12188 B15R1.5919 NC(=O)NCC(=O)CCc1ccccc1 1458a_100000184981_100000765856 [0,1,0,0,0,1|1,0,1]=4 12189 B15R1.5919 O=C(CCc1ccccc1)CC[N+](=O)[O-] 1458a_200000064761_100000765856 [0,1,0,0,0,1|1,0,1]=4 12190 B15R1.5919 [13CH3]C(=O)CCC(=O)NCc1ccccc1 1458a_100000185749_200025704644 [0,1,0,0,0,1|1,0,1]=4 12191 B15R1.5919 [13CH3]C(=O)CCC(=O)OCc1ccccc1 1458a_100000066287_200025704644 [0,1,0,0,0,1|1,0,1]=4 12192 B15R1.5919 [13CH3]C(=O)CNC(=O)CCc1ccccc1 1458a_100000194590_200025704644 [0,1,0,0,0,1|1,0,1]=4 12193 B15R1.5919 [13CH3]N(CCC(=O)N)CCc1ccccc1 2230a_200000177543_200025704644 [0,1,0,0,0,1|1,0,0]=3 12194 B15R1.5919 [13CH3]N(CCC(=O)N)CCc1ccccc1 269982a_200000177543_200025704644 [0,1,0,0,0,1|1,0,0]=3 12195 B15R1.5919 [13CH3]N(CCC(=O)N)CCc1ccccc1 34a_200000177543_200025704644 [0,1,0,0,0,1|1,0,0]=3 12196 B15R1.9084 C=C(C)CC(=O)CCCc1ccccc1 1458a_100011207963_100000748629 [0,1,0,0,0,1|2,0,0]=4 12197 B15R1.9084 C=C(C)CN(C)CCCc1ccccc1 2230a_100000225649_100000211621 [0,1,0,0,0,1|2,0,0]=4 12198 B15R1.9084 C=C(C)CN(C)CCCc1ccccc1 2230a_100000693637_100000748629 [0,1,0,0,0,1|2,0,0]=4 12199 B15R1.9084 C=C(C)CN(C)CCCc1ccccc1 269982a_100000225649_100000211621 [0,1,0,0,0,1|2,0,0]=4 12200 B15R1.9084 C=C(C)CN(C)CCCc1ccccc1 269982a_100000693637_100000748629 [0,1,0,0,0,1|2,0,0]=4 12201 B15R1.9084 C=C(F)CC(=O)CCCc1ccccc1 1458a_100011207963_100009893438 [0,1,0,0,0,1|2,0,0]=4 12202 B15R1.9084 C=C(F)CN(C)CCCc1ccccc1 2230a_100000693637_100009893438 [0,1,0,0,0,1|2,0,0]=4 12203 B15R1.9084 C=C(F)CN(C)CCCc1ccccc1 269982a_100000693637_100009893438 [0,1,0,0,0,1|2,0,0]=4 12204 B15R1.9084 CC(=O)CC(=O)NCCc1ccccc1 1458a_100000070787_100000183012 [0,1,0,0,0,1|1,0,1]=4 12205 B15R1.9084 CC(=O)CC(=O)OCCc1ccccc1 1458a_100000070787_200000077782 [0,1,0,0,0,1|1,0,1]=4 12206 B15R1.9084 CC(=O)CC(C)COCc1ccccc1 1458a_100000070787_100011216253 [0,1,0,0,0,1|1,0,0]=3 12207 B15R1.9084 CC(=O)OC(C)SCCc1ccccc1 62a_100000765856_100009818208 [0,1,0,0,0,1|2,0,0]=4 12208 B15R1.9084 CC(=O)OC(C)SCCc1ccccc1 62a_100009818208_100011218657 [0,1,0,0,0,1|2,0,0]=4 12209 B15R1.9084 CC(O)CC(=O)CCCc1ccccc1 1458a_100011207963_100011218427 [0,1,0,0,0,1|1,0,1]=4 12210 B15R1.9084 CC(O)CN(C)CCCc1ccccc1 2230a_100000227577_100000211621 [0,1,0,0,0,1|1,0,1]=4 12211 B15R1.9084 CC(O)CN(C)CCCc1ccccc1 2230a_100000693637_100011218427 [0,1,0,0,0,1|1,0,1]=4 12212 B15R1.9084 CC(O)CN(C)CCCc1ccccc1 269982a_100000227577_100000211621 [0,1,0,0,0,1|1,0,1]=4 12213 B15R1.9084 CC(O)CN(C)CCCc1ccccc1 269982a_100000693637_100011218427 [0,1,0,0,0,1|1,0,1]=4 12214 B15R1.9084 CN(C/C=C/c1ccccc1)CC(=O)O 269956a_100000746989_100016265936 [0,1,0,0,0,1|0,0,2]=4 12215 B15R1.9084 CN(CC#Cc1ccccc1)CC(=O)O 269956a_100000746989_100011352542 [0,1,0,0,0,1|0,0,2]=4 12216 B15R1.9084 CN(CCCc1ccccc1)CC(=O)N 2230a_100000693637_100000747473 [0,1,0,0,0,1|1,0,0]=3 12217 B15R1.9084 CN(CCCc1ccccc1)CC(=O)N 2230a_100000739694_100000211621 [0,1,0,0,0,1|1,0,0]=3 12218 B15R1.9084 CN(CCCc1ccccc1)CC(=O)N 269982a_100000693637_100000187820 [0,1,0,0,0,1|1,0,0]=3 12219 B15R1.9084 CN(CCCc1ccccc1)CC(=O)O 269956a_100000746989_100000211621 [0,1,0,0,0,1|0,0,0]=2 12220 B15R1.9084 CN(CCCc1ccccc1)CC(=O)[O-] 269982a_100000693637_100020667443 [0,1,0,0,0,1|0,0,1]=3 12221 B15R1.9084 CN(CCCc1ccccc1)C[N+](=O)[O-] 269982a_100000693637_100000761209 [0,1,0,0,0,1|1,0,1]=4 12222 B15R1.9084 CN(CCOc1ccccc1)CC(=O)N 2230a_100000184383_100000747473 [0,1,0,0,0,1|2,0,0]=4 12223 B15R1.9084 CN(CCOc1ccccc1)CC(=O)N 2230a_100000739694_100000184471 [0,1,0,0,0,1|2,0,0]=4 12224 B15R1.9084 CN(CCOc1ccccc1)CC(=O)N 269982a_100000184383_100000187820 [0,1,0,0,0,1|2,0,0]=4 12225 B15R1.9084 CN(CCOc1ccccc1)CC(=O)N 270004a_100000739694_100000758736 [0,1,0,0,0,1|2,0,0]=4 12226 B15R1.9084 CN(CCOc1ccccc1)CC(=O)O 269956a_100000746989_100000184471 [0,1,0,0,0,1|1,0,0]=3 12227 B15R1.9084 CN(CCOc1ccccc1)CC(=O)[O-] 269982a_100000184383_100020667443 [0,1,0,0,0,1|1,0,1]=4 12228 B15R1.9084 CN(CCSc1ccccc1)CC(=O)N 2230a_100000739694_100000246102 [0,1,0,0,0,1|2,0,0]=4 12229 B15R1.9084 CN(CCSc1ccccc1)CC(=O)O 269956a_100000746989_100000246102 [0,1,0,0,0,1|1,0,0]=3 12230 B15R1.9084 CN(COCc1ccccc1)CC(=O)N 2230a_100000739694_100000763385 [0,1,0,0,0,1|2,0,0]=4 12231 B15R1.9084 CN(COCc1ccccc1)CC(=O)O 269956a_100000746989_100000763385 [0,1,0,0,0,1|1,0,0]=3 12232 B15R1.9084 CN(CSCc1ccccc1)CC(=O)N 2230a_100000739694_200011217039 [0,1,0,0,0,1|2,0,0]=4 12233 B15R1.9084 CN(CSCc1ccccc1)CC(=O)O 269956a_100000746989_200011217039 [0,1,0,0,0,1|1,0,0]=3 12234 B15R1.9084 C[C@@H](O)CC(=O)CCCc1ccccc1 1458a_100011933948_100000211621 [0,1,0,0,0,1|1,0,1]=4 12235 B15R1.9084 C[C@@H](O)CN(C)CCCc1ccccc1 2230a_100000693637_100009817552 [0,1,0,0,0,1|1,0,1]=4 12236 B15R1.9084 C[C@@H](O)CN(C)CCCc1ccccc1 269982a_100000693637_100009817552 [0,1,0,0,0,1|1,0,1]=4 12237 B15R1.9084 NC(=O)CC(=O)CCCc1ccccc1 1458a_100011207963_100000187820 [0,1,0,0,0,1|1,0,0]=3 12238 B15R1.9084 NC(=O)CC(=O)CCCc1ccccc1 1458a_100134613110_100000211621 [0,1,0,0,0,1|1,0,0]=3 12239 B15R1.9084 NC(=O)CC(=O)CCCc1ccccn1 1458a_100000752327_100000187820 [0,1,0,0,0,1|2,0,0]=4 12240 B15R1.9084 NC(=O)CC(=O)CCCc1ccncc1 1458a_100020654287_100000187820 [0,1,0,0,0,1|2,0,0]=4 12241 B15R1.9084 NC(=O)CC(=O)CCOc1ccccc1 1458a_100000182761_100000187820 [0,1,0,0,0,1|1,0,1]=4 12242 B15R1.9084 NC(=O)CC(=O)CCOc1ccccc1 1458a_100134613110_100000184471 [0,1,0,0,0,1|1,0,1]=4 12243 B15R1.9084 NC(=O)CC(=O)CCSc1ccccc1 1458a_100000182436_100000187820 [0,1,0,0,0,1|1,0,1]=4 12244 B15R1.9084 NC(=O)CC(=O)CCSc1ccccc1 1458a_100134613110_100000246102 [0,1,0,0,0,1|1,0,1]=4 12245 B15R1.9084 NC(=O)CC(=O)COCc1ccccc1 1458a_100000230186_100000187820 [0,1,0,0,0,1|1,0,1]=4 12246 B15R1.9084 NC(=O)CC(=O)CSCc1ccccc1 1458a_100000150264_100000187820 [0,1,0,0,0,1|1,0,1]=4 12247 B15R1.9084 NC(=O)CC(=O)CSCc1ccccc1 1458a_100134613110_200011217039 [0,1,0,0,0,1|1,0,1]=4 12248 B15R1.9084 NC(=O)CC(=O)NCCc1ccccc1 240690a_100000106460_100134613110 [0,1,0,0,0,1|1,0,1]=4 12249 B15R1.9084 NC(=O)CC(=O)NCCc1ccccc1 527a_100000106460_100134613110 [0,1,0,0,0,1|1,0,1]=4 12250 B15R1.9084 O=C(CCCc1ccccc1)C[N+](=O)[O-] 1458a_100011207963_100000761209 [0,1,0,0,0,1|1,0,1]=4 12251 B15R1.9084 O=C(O)CC(O)CNCc1ccccc1 269956a_100011218706_100015291786 [0,1,0,0,0,1|0,0,0]=2 12252 B15R1.9084 O=C(O)CC(O)CNCc1ccccn1 269956a_100011218706_100000721315 [0,1,0,0,0,1|1,0,0]=3 12253 B15R1.9084 O=C(O)CC(O)CNCc1cccnc1 269956a_100011218706_100000733263 [0,1,0,0,0,1|1,0,0]=3 12254 B15R1.9084 O=C(O)CC(O)CNCc1cccnn1 269956a_100011218706_100016990269 [0,1,0,0,0,1|2,0,0]=4 12255 B15R1.9084 O=C(O)CC(O)CNCc1ccncc1 269956a_100011218706_100015193705 [0,1,0,0,0,1|1,0,0]=3 12256 B15R1.9084 O=C(O)CC(O)CNCc1cnccn1 269956a_100011218706_100016995436 [0,1,0,0,0,1|2,0,0]=4 12257 B15R1.9084 O=C(O)CC(O)CNCc1cncnc1 269956a_100011218706_100016991940 [0,1,0,0,0,1|2,0,0]=4 12258 B15R1.9084 O=C(O)CC(O)CNCc1ncccn1 269956a_100011218706_100000703007 [0,1,0,0,0,1|2,0,0]=4 12259 B15R1.9084 O=C([O-])CC(=O)CCCc1ccccc1 1458a_100011207963_100020667443 [0,1,0,0,0,1|0,0,1]=3 12260 B15R1.9084 O=C([O-])CC(=O)CCCc1ccccn1 1458a_100000752327_100020667443 [0,1,0,0,0,1|1,0,1]=4 12261 B15R1.9084 O=C([O-])CC(=O)CCCc1ccncc1 1458a_100020654287_100020667443 [0,1,0,0,0,1|1,0,1]=4 12262 B15R1.9084 O=C([O-])CC(=O)CCOc1ccccc1 1458a_100000182761_100020667443 [0,1,0,0,0,1|0,0,2]=4 12263 B15R1.9084 O=C([O-])CC(=O)CCSc1ccccc1 1458a_100000182436_100020667443 [0,1,0,0,0,1|0,0,2]=4 12264 B15R1.9084 O=C([O-])CC(=O)COCc1ccccc1 1458a_100000230186_100020667443 [0,1,0,0,0,1|0,0,2]=4 12265 B15R1.9084 O=C([O-])CC(=O)CSCc1ccccc1 1458a_100000150264_100020667443 [0,1,0,0,0,1|0,0,2]=4 12266 B15R1.351 CC(=O)CCCOc1cccccc1=O 34a_100000036025_100000685027 [0,1,0,0,0,1|2,0,0]=4 12267 B15R1.351 CC(=O)CCCOc1cccccc1=O 7a_100000036025_100011215641 [0,1,0,0,0,1|2,0,0]=4 12268 B15R1.351 NC(=O)CCCOc1cccccc1=O 34a_100000036025_100102525003 [0,1,0,0,0,1|2,0,0]=4 12269 B15R1.351 NC(=O)CCCOc1cccccc1=O 7a_100000036025_100102525003 [0,1,0,0,0,1|2,0,0]=4 12270 B15R1.64 C#Cc1cccc(c1)CNCCC(=O)N 207a_100000740010_100011361529 [0,2,0,0,0,0|2,0,0]=4 12271 B15R1.64 C#Cc1cccc(c1)COCCC(=O)C 7a_100010272118_100000053229 [0,2,0,0,0,0|2,0,0]=4 12272 B15R1.64 C#Cc1cccc(c1)COCCC(=O)N 34a_100010272118_100000731001 [0,2,0,0,0,0|2,0,0]=4 12273 B15R1.64 C#Cc1cccc(c1)COCCC(=O)N 7a_100010272118_100000744528 [0,2,0,0,0,0|2,0,0]=4 12274 B15R1.64 C#Cc1cccc(c1)NCCCC(=O)C 34a_100000735509_100000685027 [0,2,0,0,0,0|2,0,0]=4 12275 B15R1.64 C#Cc1cccc(c1)NCCCC(=O)N 34a_100000735509_100102525003 [0,2,0,0,0,0|2,0,0]=4 12276 B15R1.64 C#Cc1cccc(c1)OCCCC(=O)C 34a_100011216014_100000685027 [0,2,0,0,0,0|2,0,0]=4 12277 B15R1.64 C#Cc1cccc(c1)OCCCC(=O)C 7a_100011216014_100011215641 [0,2,0,0,0,0|2,0,0]=4 12278 B15R1.64 C#Cc1cccc(c1)OCCCC(=O)N 34a_100011216014_100102525003 [0,2,0,0,0,0|2,0,0]=4 12279 B15R1.64 C#Cc1cccc(c1)OCCCC(=O)N 7a_100011216014_100102525003 [0,2,0,0,0,0|2,0,0]=4 12280 B15R1.64 C=Cc1cccc(c1)NCCCC(=O)C 34a_100011827668_100000685027 [0,2,0,0,0,0|2,0,0]=4 12281 B15R1.64 C=Cc1cccc(c1)NCCCC(=O)N 34a_100011827668_100102525003 [0,2,0,0,0,0|2,0,0]=4 12282 B15R1.64 C=Cc1cccc(c1)OCCCC(=O)C 34a_100011309434_100000685027 [0,2,0,0,0,0|2,0,0]=4 12283 B15R1.64 C=Cc1cccc(c1)OCCCC(=O)C 7a_100011309434_100011215641 [0,2,0,0,0,0|2,0,0]=4 12284 B15R1.64 C=Cc1cccc(c1)OCCCC(=O)N 34a_100011309434_100102525003 [0,2,0,0,0,0|2,0,0]=4 12285 B15R1.64 C=Cc1cccc(c1)OCCCC(=O)N 7a_100011309434_100102525003 [0,2,0,0,0,0|2,0,0]=4 12286 B15R1.64 C=Cc1cccc(c1)SCCCC(=O)C 62a_100011215241_100011215641 [0,2,0,0,0,0|2,0,0]=4 12287 B15R1.64 C=Cc1cccc(c1)SCCCC(=O)C 62a_100011215641_100011215241 [0,2,0,0,0,0|2,0,0]=4 12288 B15R1.64 C=Cc1cccc(c1)SCCCC(=O)N 62a_100011215241_100102525003 [0,2,0,0,0,0|2,0,0]=4 12289 B15R1.64 C=Cc1cccc(c1)SCCCC(=O)N 62a_100102525003_100011215241 [0,2,0,0,0,0|2,0,0]=4 12290 B15R1.64 CC(=O)CCCNc1cccc(c1)C#N 34a_100000210922_100000685027 [0,2,0,0,0,0|2,0,0]=4 12291 B15R1.64 CC(=O)CCCNc1cccc(c1)C#N 7a_100000210922_100011215641 [0,2,0,0,0,0|2,0,0]=4 12292 B15R1.64 CC(=O)CCCNc1cccc(c1)CF 34a_100000126320_100000685027 [0,2,0,0,0,0|2,0,0]=4 12293 B15R1.64 CC(=O)CCCNc1cccc(c1)CF 7a_100000126320_100011215641 [0,2,0,0,0,0|2,0,0]=4 12294 B15R1.64 CC(=O)CCCNc1cccc(c1)CO 34a_100000211919_100000685027 [0,2,0,0,0,0|2,0,0]=4 12295 B15R1.64 CC(=O)CCCOc1cccc(c1)C#N 34a_100000184713_100000685027 [0,2,0,0,0,0|2,0,0]=4 12296 B15R1.64 CC(=O)CCCOc1cccc(c1)C#N 7a_100000184713_100011215641 [0,2,0,0,0,0|2,0,0]=4 12297 B15R1.64 CC(=O)CCCOc1cccc(c1)CBr 34a_100011660834_100000685027 [0,2,0,0,0,0|2,0,0]=4 12298 B15R1.64 CC(=O)CCCOc1cccc(c1)CBr 7a_100011660834_100011215641 [0,2,0,0,0,0|2,0,0]=4 12299 B15R1.64 CC(=O)CCCOc1cccc(c1)CCl 34a_100000084143_100000685027 [0,2,0,0,0,0|2,0,0]=4 12300 B15R1.64 CC(=O)CCCOc1cccc(c1)CCl 7a_100000084143_100011215641 [0,2,0,0,0,0|2,0,0]=4 12301 B15R1.64 CC(=O)CCCOc1cccc(c1)CN 34a_100000743036_100000685027 [0,2,0,0,0,0|2,0,0]=4 12302 B15R1.64 CC(=O)CCCOc1cccc(c1)CO 34a_100011214949_100000685027 [0,2,0,0,0,0|2,0,0]=4 12303 B15R1.64 CC(=O)CCCOc1cccc(c1)CO 7a_100011214949_100011215641 [0,2,0,0,0,0|2,0,0]=4 12304 B15R1.64 CC(=O)CCCSc1cccc(c1)C#N 62a_100011215641_100000189340 [0,2,0,0,0,0|2,0,0]=4 12305 B15R1.64 CC(=O)CCCSc1cccc(c1)C=O 62a_100000014684_100011215641 [0,2,0,0,0,0|2,0,0]=4 12306 B15R1.64 CC(=O)CCCSc1cccc(c1)C=O 62a_100011215641_100000014684 [0,2,0,0,0,0|2,0,0]=4 12307 B15R1.64 CC(=O)CCCSc1cccc(c1)CF 62a_100010878472_100011215641 [0,2,0,0,0,0|2,0,0]=4 12308 B15R1.64 CC(=O)CCCSc1cccc(c1)CF 62a_100011215641_100010878472 [0,2,0,0,0,0|2,0,0]=4 12309 B15R1.64 CC(=O)CCCSc1cccc(c1)CN 62a_100000106179_100011215641 [0,2,0,0,0,0|2,0,0]=4 12310 B15R1.64 CC(=O)CCCSc1cccc(c1)CN 62a_100011215641_100000106179 [0,2,0,0,0,0|2,0,0]=4 12311 B15R1.64 CC(=O)CCCSc1cccc(c1)CO 62a_100000687537_100011215641 [0,2,0,0,0,0|2,0,0]=4 12312 B15R1.64 CC(=O)CCCSc1cccc(c1)CO 62a_100011215641_100000687537 [0,2,0,0,0,0|2,0,0]=4 12313 B15R1.64 CC(=O)CCCSc1cccc(c1)NN 62a_100000217339_100011215641 [0,2,0,0,0,0|2,0,0]=4 12314 B15R1.64 CC(=O)CCCSc1cccc(c1)NN 62a_100011215641_100000217339 [0,2,0,0,0,0|2,0,0]=4 12315 B15R1.64 CC(=O)CCOCc1cccc(c1)C#N 34a_100000759926_100000233786 [0,2,0,0,0,0|2,0,0]=4 12316 B15R1.64 CC(=O)CCOCc1cccc(c1)C#N 7a_100000753308_100000053229 [0,2,0,0,0,0|2,0,0]=4 12317 B15R1.64 CC(=O)CCOCc1cccc(c1)C#N 7a_100000759926_100000233786 [0,2,0,0,0,0|2,0,0]=4 12318 B15R1.64 CC(=O)CCOCc1cccc(c1)C=O 34a_100000759926_100009816774 [0,2,0,0,0,0|2,0,0]=4 12319 B15R1.64 CC(=O)CCOCc1cccc(c1)C=O 7a_100000759926_100009816774 [0,2,0,0,0,0|2,0,0]=4 12320 B15R1.64 CC(=O)CCOCc1cccc(c1)CBr 7a_100010188025_100000053229 [0,2,0,0,0,0|2,0,0]=4 12321 B15R1.64 CC(=O)CCOCc1cccc(c1)CCl 7a_200000090956_100000053229 [0,2,0,0,0,0|2,0,0]=4 12322 B15R1.64 CC(=O)CCOCc1cccc(c1)CO 34a_100000759926_100010188025 [0,2,0,0,0,0|2,0,0]=4 12323 B15R1.64 CC(=O)CCOCc1cccc(c1)CO 7a_100000759926_100010188025 [0,2,0,0,0,0|2,0,0]=4 12324 B15R1.64 CC(=O)CCSCc1cccc(c1)C#N 62a_100000053229_100000233786 [0,2,0,0,0,0|2,0,0]=4 12325 B15R1.64 CC(=O)CCSCc1cccc(c1)C=O 62a_100000053229_100009816774 [0,2,0,0,0,0|2,0,0]=4 12326 B15R1.64 CC(=O)CCSCc1cccc(c1)C=O 62a_100009816774_100000053229 [0,2,0,0,0,0|2,0,0]=4 12327 B15R1.64 CC(=O)CCSCc1cccc(c1)CO 62a_100000053229_100010188025 [0,2,0,0,0,0|2,0,0]=4 12328 B15R1.64 CC(=O)CCSCc1cccc(c1)CO 62a_100010188025_100000053229 [0,2,0,0,0,0|2,0,0]=4 12329 B15R1.64 CCc1cccc(c1)CNCCC(=O)N 207a_100000740010_100011999841 [0,2,0,0,0,0|2,0,0]=4 12330 B15R1.64 CCc1cccc(c1)NCCCC(=O)C 34a_100000211250_100000685027 [0,2,0,0,0,0|2,0,0]=4 12331 B15R1.64 CCc1cccc(c1)NCCCC(=O)C 7a_100000211250_100011215641 [0,2,0,0,0,0|2,0,0]=4 12332 B15R1.64 CCc1cccc(c1)NCCCC(=O)N 34a_100000211250_100102525003 [0,2,0,0,0,0|2,0,0]=4 12333 B15R1.64 CCc1cccc(c1)NCCCC(=O)N 7a_100000211250_100102525003 [0,2,0,0,0,0|2,0,0]=4 12334 B15R1.64 CCc1cccc(c1)OCCCC(=O)C 34a_100000211550_100000685027 [0,2,0,0,0,0|2,0,0]=4 12335 B15R1.64 CCc1cccc(c1)OCCCC(=O)C 7a_100000211550_100011215641 [0,2,0,0,0,0|2,0,0]=4 12336 B15R1.64 CCc1cccc(c1)OCCCC(=O)N 34a_100000211550_100102525003 [0,2,0,0,0,0|2,0,0]=4 12337 B15R1.64 CCc1cccc(c1)OCCCC(=O)N 7a_100000211550_100102525003 [0,2,0,0,0,0|2,0,0]=4 12338 B15R1.64 CCc1cccc(c1)SCCCC(=O)C 62a_100011215641_100011263222 [0,2,0,0,0,0|2,0,0]=4 12339 B15R1.64 CCc1cccc(c1)SCCCC(=O)C 62a_100011263222_100011215641 [0,2,0,0,0,0|2,0,0]=4 12340 B15R1.64 CCc1cccc(c1)SCCCC(=O)N 62a_100011263222_100102525003 [0,2,0,0,0,0|2,0,0]=4 12341 B15R1.64 CCc1cccc(c1)SCCCC(=O)N 62a_100102525003_100011263222 [0,2,0,0,0,0|2,0,0]=4 12342 B15R1.64 CNc1cccc(c1)OCCCC(=O)C 34a_100000756613_100000685027 [0,2,0,0,0,0|2,0,0]=4 12343 B15R1.64 CNc1cccc(c1)OCCCC(=O)C 7a_100000756613_100011215641 [0,2,0,0,0,0|2,0,0]=4 12344 B15R1.64 CNc1cccc(c1)OCCCC(=O)N 34a_100000756613_100102525003 [0,2,0,0,0,0|2,0,0]=4 12345 B15R1.64 CNc1cccc(c1)OCCCC(=O)N 7a_100000756613_100102525003 [0,2,0,0,0,0|2,0,0]=4 12346 B15R1.64 CNc1cccc(c1)SCCCC(=O)C 62a_100000219648_100011215641 [0,2,0,0,0,0|2,0,0]=4 12347 B15R1.64 CNc1cccc(c1)SCCCC(=O)C 62a_100011215641_100000219648 [0,2,0,0,0,0|2,0,0]=4 12348 B15R1.64 CNc1cccc(c1)SCCCC(=O)N 62a_100000219648_100102525003 [0,2,0,0,0,0|2,0,0]=4 12349 B15R1.64 CNc1cccc(c1)SCCCC(=O)N 62a_100102525003_100000219648 [0,2,0,0,0,0|2,0,0]=4 12350 B15R1.64 COc1cccc(c1)CCCCC(=O)C 1458a_200012348154_200000210301 [0,2,0,0,0,0|1,0,0]=3 12351 B15R1.64 COc1cccc(c1)CCCCC(=O)[13CH3] 1458a_200012348154_200025704644 [0,2,0,0,0,0|1,0,0]=3 12352 B15R1.64 COc1cccc(c1)CCCNC(=O)C 11a_100000750448_100015343762 [0,2,0,0,0,0|2,0,0]=4 12353 B15R1.64 COc1cccc(c1)CCCNC(=O)C 1626a_100000750448_100015343762 [0,2,0,0,0,0|2,0,0]=4 12354 B15R1.64 COc1cccc(c1)CCCNC(=O)C 240690a_100000750448_100015343762 [0,2,0,0,0,0|2,0,0]=4 12355 B15R1.64 COc1cccc(c1)CCCNC(=O)C 527a_100000750448_100103153847 [0,2,0,0,0,0|2,0,0]=4 12356 B15R1.64 COc1cccc(c1)CCNCC(=O)N 2230a_100000711301_100011713679 [0,2,0,0,0,0|2,0,0]=4 12357 B15R1.64 COc1cccc(c1)CCNCC(=O)N 2230a_100000740386_100000747473 [0,2,0,0,0,0|2,0,0]=4 12358 B15R1.64 COc1cccc(c1)CCNCC(=O)N 34a_100000740386_100000187820 [0,2,0,0,0,0|2,0,0]=4 12359 B15R1.64 COc1cccc(c1)CCNCC(=O)O 269956a_100016091260_100011713679 [0,2,0,0,0,0|1,0,0]=3 12360 B15R1.64 COc1cccc(c1)CCNCC(=O)[O-] 34a_100000740386_100020667443 [0,2,0,0,0,0|1,0,1]=4 12361 B15R1.64 COc1cccc(c1)CCOCC(=O)C 34a_100000211253_100011713679 [0,2,0,0,0,0|2,0,0]=4 12362 B15R1.64 COc1cccc(c1)CCOCC(=O)N 34a_100011215300_100000187820 [0,2,0,0,0,0|2,0,0]=4 12363 B15R1.64 COc1cccc(c1)CCOCC(=O)N 7a_100011215300_100000187820 [0,2,0,0,0,0|2,0,0]=4 12364 B15R1.64 COc1cccc(c1)CCOCC(=O)[O-] 34a_100011215300_100020667443 [0,2,0,0,0,0|1,0,1]=4 12365 B15R1.64 COc1cccc(c1)CCSCC(=O)N 62a_100000747473_100011713679 [0,2,0,0,0,0|2,0,0]=4 12366 B15R1.64 COc1cccc(c1)CCSCC(=O)N 62a_100011713679_100000747473 [0,2,0,0,0,0|2,0,0]=4 12367 B15R1.64 COc1cccc(c1)CCSCC(=O)[O-] 62a_100011713679_100020667443 [0,2,0,0,0,0|1,0,1]=4 12368 B15R1.64 COc1cccc(c1)CCSCC(=O)[O-] 62a_100020667443_100011713679 [0,2,0,0,0,0|1,0,1]=4 12369 B15R1.64 COc1cccc(c1)CNCCC(=O)N 207a_100000740010_100000170238 [0,2,0,0,0,0|2,0,0]=4 12370 B15R1.64 COc1cccc(c1)CNCCC(=O)N 2230a_100000174954_100000744528 [0,2,0,0,0,0|2,0,0]=4 12371 B15R1.64 COc1cccc(c1)CNCCC(=O)N 34a_100000174954_100000731001 [0,2,0,0,0,0|2,0,0]=4 12372 B15R1.64 COc1cccc(c1)CNOCC(=O)O 269956a_100000106656_100000211672 [0,2,0,0,0,0|2,0,0]=4 12373 B15R1.64 COc1cccc(c1)COCCC(=O)C 34a_100000759926_100000688526 [0,2,0,0,0,0|2,0,0]=4 12374 B15R1.64 COc1cccc(c1)COCCC(=O)C 7a_100000759926_100000211672 [0,2,0,0,0,0|2,0,0]=4 12375 B15R1.64 COc1cccc(c1)COCCC(=O)N 34a_100000198976_100000731001 [0,2,0,0,0,0|2,0,0]=4 12376 B15R1.64 COc1cccc(c1)COCCC(=O)N 34a_100000757172_100000688526 [0,2,0,0,0,0|2,0,0]=4 12377 B15R1.64 COc1cccc(c1)COCCC(=O)N 7a_100000757172_100000211672 [0,2,0,0,0,0|2,0,0]=4 12378 B15R1.64 COc1cccc(c1)CSCCC(=O)C 62a_100000053229_100000211672 [0,2,0,0,0,0|2,0,0]=4 12379 B15R1.64 COc1cccc(c1)CSCCC(=O)C 62a_100000688526_100000053229 [0,2,0,0,0,0|2,0,0]=4 12380 B15R1.64 COc1cccc(c1)CSCCC(=O)N 62a_100000688526_100000744528 [0,2,0,0,0,0|2,0,0]=4 12381 B15R1.64 COc1cccc(c1)CSCCC(=O)N 62a_100000744528_100000211672 [0,2,0,0,0,0|2,0,0]=4 12382 B15R1.64 COc1cccc(c1)NCCCC(=O)C 34a_100000210024_100000685027 [0,2,0,0,0,0|2,0,0]=4 12383 B15R1.64 COc1cccc(c1)NCCCC(=O)N 34a_100000210024_100102525003 [0,2,0,0,0,0|2,0,0]=4 12384 B15R1.64 COc1cccc(c1)OCCCC(=O)C 34a_100000211255_100000685027 [0,2,0,0,0,0|2,0,0]=4 12385 B15R1.64 COc1cccc(c1)OCCCC(=O)C 7a_100000211255_100011215641 [0,2,0,0,0,0|2,0,0]=4 12386 B15R1.64 COc1cccc(c1)OCCCC(=O)N 34a_100000211255_100102525003 [0,2,0,0,0,0|2,0,0]=4 12387 B15R1.64 COc1cccc(c1)OCCCC(=O)N 7a_100000211255_100102525003 [0,2,0,0,0,0|2,0,0]=4 12388 B15R1.64 COc1cccc(c1)SCCCC(=O)C 62a_100011215641_100000170001 [0,2,0,0,0,0|2,0,0]=4 12389 B15R1.64 COc1cccc(c1)SCCCC(=O)N 62a_100102525003_100000170001 [0,2,0,0,0,0|2,0,0]=4 12390 B15R1.64 CSc1cccc(c1)CNCCC(=O)N 207a_100000740010_100011935093 [0,2,0,0,0,0|2,0,0]=4 12391 B15R1.64 CSc1cccc(c1)NCCCC(=O)C 34a_100000210049_100000685027 [0,2,0,0,0,0|2,0,0]=4 12392 B15R1.64 CSc1cccc(c1)NCCCC(=O)N 34a_100000210049_100102525003 [0,2,0,0,0,0|2,0,0]=4 12393 B15R1.64 CSc1cccc(c1)OCCCC(=O)C 34a_100011265683_100000685027 [0,2,0,0,0,0|2,0,0]=4 12394 B15R1.64 CSc1cccc(c1)OCCCC(=O)C 7a_100011265683_100011215641 [0,2,0,0,0,0|2,0,0]=4 12395 B15R1.64 CSc1cccc(c1)OCCCC(=O)N 34a_100011265683_100102525003 [0,2,0,0,0,0|2,0,0]=4 12396 B15R1.64 CSc1cccc(c1)OCCCC(=O)N 7a_100011265683_100102525003 [0,2,0,0,0,0|2,0,0]=4 12397 B15R1.64 CSc1cccc(c1)SCCCC(=O)C 62a_100011215641_100011215954 [0,2,0,0,0,0|2,0,0]=4 12398 B15R1.64 CSc1cccc(c1)SCCCC(=O)C 62a_100011215954_100011215641 [0,2,0,0,0,0|2,0,0]=4 12399 B15R1.64 CSc1cccc(c1)SCCCC(=O)N 62a_100011215954_100102525003 [0,2,0,0,0,0|2,0,0]=4 12400 B15R1.64 CSc1cccc(c1)SCCCC(=O)N 62a_100102525003_100011215954 [0,2,0,0,0,0|2,0,0]=4 12401 B15R1.64 N#Cc1cccc(c1)CCOCC(=O)N 34a_100012001419_100000187820 [0,2,0,0,0,0|2,0,0]=4 12402 B15R1.64 N#Cc1cccc(c1)CCOCC(=O)N 7a_100012001419_100000187820 [0,2,0,0,0,0|2,0,0]=4 12403 B15R1.64 N#Cc1cccc(c1)CCOCC(=O)[O-] 34a_100012001419_100020667443 [0,2,0,0,0,0|1,0,1]=4 12404 B15R1.64 N#Cc1cccc(c1)CNCCC(=O)N 207a_100000740010_100000241001 [0,2,0,0,0,0|2,0,0]=4 12405 B15R1.64 N#Cc1cccc(c1)CNCCC(=O)N 34a_100000755147_100000731001 [0,2,0,0,0,0|2,0,0]=4 12406 B15R1.64 N#Cc1cccc(c1)CNOCC(=O)O 269956a_100000106656_100000233786 [0,2,0,0,0,0|2,0,0]=4 12407 B15R1.64 N#Cc1cccc(c1)COCCC(=O)N 34a_100000753308_100000731001 [0,2,0,0,0,0|2,0,0]=4 12408 B15R1.64 N#Cc1cccc(c1)COCCC(=O)N 34a_100000757172_100000233786 [0,2,0,0,0,0|2,0,0]=4 12409 B15R1.64 N#Cc1cccc(c1)COCCC(=O)N 7a_100000753308_100000744528 [0,2,0,0,0,0|2,0,0]=4 12410 B15R1.64 N#Cc1cccc(c1)COCCC(=O)N 7a_100000757172_100000233786 [0,2,0,0,0,0|2,0,0]=4 12411 B15R1.64 N#Cc1cccc(c1)CSCCC(=O)N 62a_100000744528_100000233786 [0,2,0,0,0,0|2,0,0]=4 12412 B15R1.64 N#Cc1cccc(c1)NCCCC(=O)N 34a_100000210922_100102525003 [0,2,0,0,0,0|2,0,0]=4 12413 B15R1.64 N#Cc1cccc(c1)NCCCC(=O)N 7a_100000210922_100102525003 [0,2,0,0,0,0|2,0,0]=4 12414 B15R1.64 N#Cc1cccc(c1)OCCCC(=O)N 34a_100000184713_100102525003 [0,2,0,0,0,0|2,0,0]=4 12415 B15R1.64 N#Cc1cccc(c1)OCCCC(=O)N 7a_100000184713_100102525003 [0,2,0,0,0,0|2,0,0]=4 12416 B15R1.64 N#Cc1cccc(c1)SCCCC(=O)N 62a_100102525003_100000189340 [0,2,0,0,0,0|2,0,0]=4 12417 B15R1.64 NC(=O)CCCNc1cccc(c1)CF 34a_100000126320_100102525003 [0,2,0,0,0,0|2,0,0]=4 12418 B15R1.64 NC(=O)CCCNc1cccc(c1)CF 7a_100000126320_100102525003 [0,2,0,0,0,0|2,0,0]=4 12419 B15R1.64 NC(=O)CCCNc1cccc(c1)CO 34a_100000211919_100102525003 [0,2,0,0,0,0|2,0,0]=4 12420 B15R1.64 NC(=O)CCCOc1cccc(c1)CBr 34a_100011660834_100102525003 [0,2,0,0,0,0|2,0,0]=4 12421 B15R1.64 NC(=O)CCCOc1cccc(c1)CBr 7a_100011660834_100102525003 [0,2,0,0,0,0|2,0,0]=4 12422 B15R1.64 NC(=O)CCCOc1cccc(c1)CCl 34a_100000084143_100102525003 [0,2,0,0,0,0|2,0,0]=4 12423 B15R1.64 NC(=O)CCCOc1cccc(c1)CCl 7a_100000084143_100102525003 [0,2,0,0,0,0|2,0,0]=4 12424 B15R1.64 NC(=O)CCCOc1cccc(c1)CO 34a_100011214949_100102525003 [0,2,0,0,0,0|2,0,0]=4 12425 B15R1.64 NC(=O)CCCOc1cccc(c1)CO 7a_100011214949_100102525003 [0,2,0,0,0,0|2,0,0]=4 12426 B15R1.64 NC(=O)CCCSc1cccc(c1)C=O 62a_100000014684_100102525003 [0,2,0,0,0,0|2,0,0]=4 12427 B15R1.64 NC(=O)CCCSc1cccc(c1)C=O 62a_100102525003_100000014684 [0,2,0,0,0,0|2,0,0]=4 12428 B15R1.64 NC(=O)CCCSc1cccc(c1)CF 62a_100010878472_100102525003 [0,2,0,0,0,0|2,0,0]=4 12429 B15R1.64 NC(=O)CCCSc1cccc(c1)CF 62a_100102525003_100010878472 [0,2,0,0,0,0|2,0,0]=4 12430 B15R1.64 NC(=O)CCCSc1cccc(c1)CO 62a_100000687537_100102525003 [0,2,0,0,0,0|2,0,0]=4 12431 B15R1.64 NC(=O)CCCSc1cccc(c1)CO 62a_100102525003_100000687537 [0,2,0,0,0,0|2,0,0]=4 12432 B15R1.64 NC(=O)CCNCc1cccc(c1)CO 207a_100000740010_200000050894 [0,2,0,0,0,0|2,0,0]=4 12433 B15R1.64 NC(=O)CCNCc1cccc(c1)CO 2230a_100011269909_100000744528 [0,2,0,0,0,0|2,0,0]=4 12434 B15R1.64 NC(=O)CCNCc1cccc(c1)CO 34a_100011269909_100000731001 [0,2,0,0,0,0|2,0,0]=4 12435 B15R1.64 NC(=O)CCOCc1cccc(c1)C=O 34a_100000757172_100009816774 [0,2,0,0,0,0|2,0,0]=4 12436 B15R1.64 NC(=O)CCOCc1cccc(c1)C=O 7a_100000757172_100009816774 [0,2,0,0,0,0|2,0,0]=4 12437 B15R1.64 NC(=O)CCOCc1cccc(c1)CBr 34a_100010188025_100000731001 [0,2,0,0,0,0|2,0,0]=4 12438 B15R1.64 NC(=O)CCOCc1cccc(c1)CBr 7a_100010188025_100000744528 [0,2,0,0,0,0|2,0,0]=4 12439 B15R1.64 NC(=O)CCOCc1cccc(c1)CCl 34a_200000090956_100000731001 [0,2,0,0,0,0|2,0,0]=4 12440 B15R1.64 NC(=O)CCOCc1cccc(c1)CCl 7a_200000090956_100000744528 [0,2,0,0,0,0|2,0,0]=4 12441 B15R1.64 NC(=O)CCOCc1cccc(c1)CO 34a_100000757172_100010188025 [0,2,0,0,0,0|2,0,0]=4 12442 B15R1.64 NC(=O)CCOCc1cccc(c1)CO 7a_100000757172_100010188025 [0,2,0,0,0,0|2,0,0]=4 12443 B15R1.64 NC(=O)CCSCc1cccc(c1)C=O 62a_100000744528_100009816774 [0,2,0,0,0,0|2,0,0]=4 12444 B15R1.64 NC(=O)CCSCc1cccc(c1)C=O 62a_100009816774_100000744528 [0,2,0,0,0,0|2,0,0]=4 12445 B15R1.64 NC(=O)CCSCc1cccc(c1)CO 62a_100000744528_100010188025 [0,2,0,0,0,0|2,0,0]=4 12446 B15R1.64 NC(=O)CCSCc1cccc(c1)CO 62a_100010188025_100000744528 [0,2,0,0,0,0|2,0,0]=4 12447 B15R1.64 NCc1cccc(c1)COCCC(=O)N 34a_100011269909_100000731001 [0,2,0,0,0,0|2,0,0]=4 12448 B15R1.64 NCc1cccc(c1)OCCCC(=O)N 34a_100000743036_100102525003 [0,2,0,0,0,0|2,0,0]=4 12449 B15R1.64 NCc1cccc(c1)SCCCC(=O)N 62a_100000106179_100102525003 [0,2,0,0,0,0|2,0,0]=4 12450 B15R1.64 NCc1cccc(c1)SCCCC(=O)N 62a_100102525003_100000106179 [0,2,0,0,0,0|2,0,0]=4 12451 B15R1.64 NNc1cccc(c1)SCCCC(=O)N 62a_100000217339_100102525003 [0,2,0,0,0,0|2,0,0]=4 12452 B15R1.64 NNc1cccc(c1)SCCCC(=O)N 62a_100102525003_100000217339 [0,2,0,0,0,0|2,0,0]=4 12453 B15R1.64 O=C(O)CONCc1cccc(c1)CO 269956a_100000106656_100010188025 [0,2,0,0,0,0|2,0,0]=4 12454 B15R1.64 O=Cc1cccc(c1)CNOCC(=O)O 269956a_100000106656_100009816774 [0,2,0,0,0,0|2,0,0]=4 12455 B15R1.120 CC(=O)CCN(C)Cc1cccc(c1)Br 269982a_100000187585_100000053229 [0,2,0,0,0,0|2,0,0]=4 12456 B15R1.120 CC(=O)CCN(C)Cc1cccc(c1)C 269982a_102495364743_100000053229 [0,2,0,0,0,0|2,0,0]=4 12457 B15R1.120 CC(=O)CCN(C)Cc1cccc(c1)Cl 269982a_100020629429_100000053229 [0,2,0,0,0,0|2,0,0]=4 12458 B15R1.120 CC(=O)CCN(C)Cc1cccc(c1)F 269982a_100000184398_100000053229 [0,2,0,0,0,0|2,0,0]=4 12459 B15R1.120 CC(=O)CCN(C)Cc1cccc(c1)O 269982a_100000207540_100000053229 [0,2,0,0,0,0|2,0,0]=4 12460 B15R1.120 CN(CCC(=O)N)Cc1cccc(c1)Br 2230a_100000187585_100000744528 [0,2,0,0,0,0|2,0,0]=4 12461 B15R1.120 CN(CCC(=O)N)Cc1cccc(c1)Br 2230a_100000730477_100000698116 [0,2,0,0,0,0|2,0,0]=4 12462 B15R1.120 CN(CCC(=O)N)Cc1cccc(c1)Br 269982a_100000187585_100000744528 [0,2,0,0,0,0|2,0,0]=4 12463 B15R1.120 CN(CCC(=O)N)Cc1cccc(c1)Br 270004a_100000730477_100000210085 [0,2,0,0,0,0|2,0,0]=4 12464 B15R1.120 CN(CCC(=O)N)Cc1cccc(c1)Cl 2230a_100000730477_100000181238 [0,2,0,0,0,0|2,0,0]=4 12465 B15R1.120 CN(CCC(=O)N)Cc1cccc(c1)Cl 2230a_100020629429_100000744528 [0,2,0,0,0,0|2,0,0]=4 12466 B15R1.120 CN(CCC(=O)N)Cc1cccc(c1)Cl 269982a_100020629429_100000744528 [0,2,0,0,0,0|2,0,0]=4 12467 B15R1.120 CN(CCC(=O)N)Cc1cccc(c1)Cl 270004a_100000730477_100000210801 [0,2,0,0,0,0|2,0,0]=4 12468 B15R1.120 CN(CCC(=O)N)Cc1cccc(c1)F 2230a_100000184398_100000744528 [0,2,0,0,0,0|2,0,0]=4 12469 B15R1.120 CN(CCC(=O)N)Cc1cccc(c1)F 2230a_100000730477_100000230114 [0,2,0,0,0,0|2,0,0]=4 12470 B15R1.120 CN(CCC(=O)N)Cc1cccc(c1)F 269982a_100000184398_100000744528 [0,2,0,0,0,0|2,0,0]=4 12471 B15R1.120 CN(CCC(=O)N)Cc1cccc(c1)F 270004a_100000730477_100000210812 [0,2,0,0,0,0|2,0,0]=4 12472 B15R1.120 CN(CCC(=O)N)Cc1cccc(c1)F 34a_100000184398_100000731001 [0,2,0,0,0,0|2,0,0]=4 12473 B15R1.120 CN(CCC(=O)N)Cc1cccc(c1)I 2230a_100000730477_100011218688 [0,2,0,0,0,0|2,0,0]=4 12474 B15R1.120 CN(CCC(=O)N)Cc1cccc(c1)I 270004a_100000730477_100000014684 [0,2,0,0,0,0|2,0,0]=4 12475 B15R1.120 CN(CCC(=O)N)Cc1cccc(c1)O 2230a_100000207540_100000744528 [0,2,0,0,0,0|2,0,0]=4 12476 B15R1.120 CN(CCC(=O)N)Cc1cccc(c1)O 2230a_100000730477_100011660834 [0,2,0,0,0,0|2,0,0]=4 12477 B15R1.120 CN(CCC(=O)N)Cc1cccc(c1)O 269982a_100000207540_100000744528 [0,2,0,0,0,0|2,0,0]=4 12478 B15R1.120 CN(CCC(=O)N)Cc1cccc(c1)O 270004a_100000730477_100000188321 [0,2,0,0,0,0|2,0,0]=4 12479 B15R1.120 Cc1cccc(c1)CC(=O)CCC(=O)N 1458a_100011215257_100000211840 [0,2,0,0,0,0|1,0,1]=4 12480 B15R1.120 Cc1cccc(c1)CN(C)CCC(=O)N 2230a_100000730477_100000211840 [0,2,0,0,0,0|2,0,0]=4 12481 B15R1.120 Cc1cccc(c1)CN(C)CCC(=O)N 2230a_102495364743_100000744528 [0,2,0,0,0,0|2,0,0]=4 12482 B15R1.120 Cc1cccc(c1)CN(C)CCC(=O)N 269982a_102495364743_100000744528 [0,2,0,0,0,0|2,0,0]=4 12483 B15R1.120 Cc1cccc(c1)CN(C)CCC(=O)N 270004a_100000730477_100000211157 [0,2,0,0,0,0|2,0,0]=4 12484 B15R1.120 Cc1cccc(c1)CN(C)CCC(=O)N 34a_102495364743_100000731001 [0,2,0,0,0,0|2,0,0]=4 12485 B15R1.120 NC(=O)CCC(=O)Cc1cccc(c1)Br 1458a_100011215257_100000211773 [0,2,0,0,0,0|1,0,1]=4 12486 B15R1.120 NC(=O)CCC(=O)Cc1cccc(c1)Cl 1458a_100011215257_100000181238 [0,2,0,0,0,0|1,0,1]=4 12487 B15R1.120 NC(=O)CCC(=O)Cc1cccc(c1)F 1458a_100011215257_100000230114 [0,2,0,0,0,0|1,0,1]=4 12488 B15R1.120 NC(=O)CCC(=O)Cc1cccc(c1)I 1458a_100011215257_100011218688 [0,2,0,0,0,0|1,0,1]=4 12489 B15R1.120 NC(=O)CCC(=O)Cc1cccc(c1)O 1458a_100011215257_100011660834 [0,2,0,0,0,0|1,0,1]=4 12490 B15R1.121 CC(=O)C(C)COCc1cccc(c1)Br 34a_100000032740_100000698116 [0,2,0,0,0,0|2,0,0]=4 12491 B15R1.121 CC(=O)C(C)COCc1cccc(c1)Br 7a_100000032740_100000211773 [0,2,0,0,0,0|2,0,0]=4 12492 B15R1.121 CC(=O)C(C)COCc1cccc(c1)C 34a_100000032740_100000211840 [0,2,0,0,0,0|2,0,0]=4 12493 B15R1.121 CC(=O)C(C)COCc1cccc(c1)C 7a_100000032740_100000211840 [0,2,0,0,0,0|2,0,0]=4 12494 B15R1.121 CC(=O)C(C)COCc1cccc(c1)Cl 34a_100000032740_100000187163 [0,2,0,0,0,0|2,0,0]=4 12495 B15R1.121 CC(=O)C(C)COCc1cccc(c1)Cl 7a_100000032740_100000187163 [0,2,0,0,0,0|2,0,0]=4 12496 B15R1.121 CC(=O)C(C)COCc1cccc(c1)F 34a_100000032740_100000187166 [0,2,0,0,0,0|2,0,0]=4 12497 B15R1.121 CC(=O)C(C)COCc1cccc(c1)F 7a_100000032740_100000230114 [0,2,0,0,0,0|2,0,0]=4 12498 B15R1.121 CC(=O)C(C)COCc1cccc(c1)I 34a_100000032740_100011218688 [0,2,0,0,0,0|2,0,0]=4 12499 B15R1.121 CC(=O)C(C)COCc1cccc(c1)I 7a_100000032740_100011218688 [0,2,0,0,0,0|2,0,0]=4 12500 B15R1.121 CC(=O)C(C)COCc1cccc(c1)O 34a_100000032740_100011660834 [0,2,0,0,0,0|2,0,0]=4 12501 B15R1.121 CC(=O)C(C)COCc1cccc(c1)O 7a_100000032740_100000084143 [0,2,0,0,0,0|2,0,0]=4 12502 B15R1.121 CC(=O)C(C)NCCc1cccc(c1)Br 2230a_100011207229_100009814033 [0,2,0,0,0,0|2,0,0]=4 12503 B15R1.121 CC(=O)C(C)NCCc1cccc(c1)C 2230a_100000749837_100009814033 [0,2,0,0,0,0|2,0,0]=4 12504 B15R1.121 CC(=O)C(C)NCCc1cccc(c1)Cl 2230a_100000185263_100009814033 [0,2,0,0,0,0|2,0,0]=4 12505 B15R1.121 CC(=O)C(C)NCCc1cccc(c1)F 2230a_100000205154_100009814033 [0,2,0,0,0,0|2,0,0]=4 12506 B15R1.121 CC(=O)C(C)NCCc1cccc(c1)O 2230a_100000747277_100009814033 [0,2,0,0,0,0|2,0,0]=4 12507 B15R1.121 CC(=O)C(C)OCCc1cccc(c1)Br 34a_100000212229_100011740638 [0,2,0,0,0,0|2,0,0]=4 12508 B15R1.121 CC(=O)C(C)OCCc1cccc(c1)Br 7a_100011217444_100000179758 [0,2,0,0,0,0|2,0,0]=4 12509 B15R1.121 CC(=O)C(C)OCCc1cccc(c1)C 34a_100000212229_100011713685 [0,2,0,0,0,0|2,0,0]=4 12510 B15R1.121 CC(=O)C(C)OCCc1cccc(c1)C 7a_100011217157_100000179758 [0,2,0,0,0,0|2,0,0]=4 12511 B15R1.121 CC(=O)C(C)OCCc1cccc(c1)Cl 34a_100000212229_100011713710 [0,2,0,0,0,0|2,0,0]=4 12512 B15R1.121 CC(=O)C(C)OCCc1cccc(c1)Cl 7a_100000754733_100000179758 [0,2,0,0,0,0|2,0,0]=4 12513 B15R1.121 CC(=O)C(C)OCCc1cccc(c1)F 34a_100000212229_100011217235 [0,2,0,0,0,0|2,0,0]=4 12514 B15R1.121 CC(=O)C(C)OCCc1cccc(c1)F 7a_100000763591_100000179758 [0,2,0,0,0,0|2,0,0]=4 12515 B15R1.121 CC(=O)C(C)SCCc1cccc(c1)Br 62a_100009814033_100011740638 [0,2,0,0,0,0|2,0,0]=4 12516 B15R1.121 CC(=O)C(C)SCCc1cccc(c1)Br 62a_100011740638_100009814033 [0,2,0,0,0,0|2,0,0]=4 12517 B15R1.121 CC(=O)C(C)SCCc1cccc(c1)C 62a_100009814033_100011713685 [0,2,0,0,0,0|2,0,0]=4 12518 B15R1.121 CC(=O)C(C)SCCc1cccc(c1)C 62a_100011713685_100009814033 [0,2,0,0,0,0|2,0,0]=4 12519 B15R1.121 CC(=O)C(C)SCCc1cccc(c1)Cl 62a_100009814033_100011713710 [0,2,0,0,0,0|2,0,0]=4 12520 B15R1.121 CC(=O)C(C)SCCc1cccc(c1)Cl 62a_100011713710_100009814033 [0,2,0,0,0,0|2,0,0]=4 12521 B15R1.121 CC(=O)C(C)SCCc1cccc(c1)F 62a_100009814033_100011217235 [0,2,0,0,0,0|2,0,0]=4 12522 B15R1.121 CC(=O)C(C)SCCc1cccc(c1)F 62a_100011217235_100009814033 [0,2,0,0,0,0|2,0,0]=4 12523 B15R1.121 CC(CNCc1cc(ccn1)Br)C(=O)O 269956a_100000749485_100010173614 [0,2,0,0,0,0|2,0,0]=4 12524 B15R1.121 CC(CNCc1cc(ccn1)Cl)C(=O)O 269956a_100000749485_100016988179 [0,2,0,0,0,0|2,0,0]=4 12525 B15R1.121 CC(CNCc1cccc(c1)Br)C(=O)O 269956a_100000749485_100000211773 [0,2,0,0,0,0|1,0,0]=3 12526 B15R1.121 CC(CNCc1cccc(c1)Cl)C(=O)O 269956a_100000749485_100000187163 [0,2,0,0,0,0|1,0,0]=3 12527 B15R1.121 CC(CNCc1cccc(c1)F)C(=O)O 269956a_100000749485_100000230114 [0,2,0,0,0,0|1,0,0]=3 12528 B15R1.121 CC(CNCc1cccc(c1)I)C(=O)O 269956a_100000749485_100011218688 [0,2,0,0,0,0|1,0,0]=3 12529 B15R1.121 CC(CNCc1cccc(c1)O)C(=O)O 269956a_100000749485_100011660834 [0,2,0,0,0,0|1,0,0]=3 12530 B15R1.121 CC(CNCc1cccc(n1)Br)C(=O)O 269956a_100000749485_100009889011 [0,2,0,0,0,0|2,0,0]=4 12531 B15R1.121 CC(CNCc1cccc(n1)Cl)C(=O)O 269956a_100000749485_100000086093 [0,2,0,0,0,0|2,0,0]=4 12532 B15R1.121 CC(CNCc1cccc(n1)F)C(=O)O 269956a_100000749485_100009819644 [0,2,0,0,0,0|2,0,0]=4 12533 B15R1.121 CC(CNCc1ccnc(c1)Br)C(=O)O 269956a_100000749485_100010254460 [0,2,0,0,0,0|2,0,0]=4 12534 B15R1.121 CC(CNCc1ccnc(c1)Cl)C(=O)O 269956a_100000749485_100000764220 [0,2,0,0,0,0|2,0,0]=4 12535 B15R1.121 CC(CNCc1cncc(c1)Br)C(=O)O 269956a_100000749485_100000738771 [0,2,0,0,0,0|2,0,0]=4 12536 B15R1.121 CC(CNCc1cncc(c1)Cl)C(=O)O 269956a_100000749485_100016992070 [0,2,0,0,0,0|2,0,0]=4 12537 B15R1.121 CC(CNCc1cncc(c1)F)C(=O)O 269956a_100000749485_100000725299 [0,2,0,0,0,0|2,0,0]=4 12538 B15R1.121 CC(NCCc1cccc(c1)Br)C(=O)N 2230a_100011207229_100000702099 [0,2,0,0,0,0|2,0,0]=4 12539 B15R1.121 CC(NCCc1cccc(c1)Br)C(=O)N 34a_100011207229_100000702099 [0,2,0,0,0,0|2,0,0]=4 12540 B15R1.121 CC(NCCc1cccc(c1)Cl)C(=O)N 2230a_100000185263_100000702099 [0,2,0,0,0,0|2,0,0]=4 12541 B15R1.121 CC(NCCc1cccc(c1)Cl)C(=O)N 34a_100000185263_100000702099 [0,2,0,0,0,0|2,0,0]=4 12542 B15R1.121 CC(NCCc1cccc(c1)F)C(=O)N 2230a_100000205154_100000702099 [0,2,0,0,0,0|2,0,0]=4 12543 B15R1.121 CC(NCCc1cccc(c1)F)C(=O)N 34a_100000205154_100000702099 [0,2,0,0,0,0|2,0,0]=4 12544 B15R1.121 CC(NCCc1cccc(c1)O)C(=O)N 2230a_100000747277_100000702099 [0,2,0,0,0,0|2,0,0]=4 12545 B15R1.121 CC(NCCc1cccc(c1)O)C(=O)N 34a_100000747277_100000702099 [0,2,0,0,0,0|2,0,0]=4 12546 B15R1.121 CC(OCCc1cccc(c1)Br)C(=O)N 34a_100011217444_100000702099 [0,2,0,0,0,0|2,0,0]=4 12547 B15R1.121 CC(OCCc1cccc(c1)Br)C(=O)N 7a_100011217444_100000702099 [0,2,0,0,0,0|2,0,0]=4 12548 B15R1.121 CC(OCCc1cccc(c1)Cl)C(=O)N 34a_100000754733_100000702099 [0,2,0,0,0,0|2,0,0]=4 12549 B15R1.121 CC(OCCc1cccc(c1)Cl)C(=O)N 7a_100000754733_100000702099 [0,2,0,0,0,0|2,0,0]=4 12550 B15R1.121 CC(OCCc1cccc(c1)F)C(=O)N 34a_100000763591_100000702099 [0,2,0,0,0,0|2,0,0]=4 12551 B15R1.121 CC(OCCc1cccc(c1)F)C(=O)N 7a_100000763591_100000702099 [0,2,0,0,0,0|2,0,0]=4 12552 B15R1.121 CC(OCCc1cccc(c1)N)C(=O)N 34a_100011996697_100000702099 [0,2,0,0,0,0|2,0,0]=4 12553 B15R1.121 CC(SCCc1cccc(c1)Br)C(=O)N 62a_100000702099_100011740638 [0,2,0,0,0,0|2,0,0]=4 12554 B15R1.121 CC(SCCc1cccc(c1)Br)C(=O)N 62a_100011740638_100000702099 [0,2,0,0,0,0|2,0,0]=4 12555 B15R1.121 CC(SCCc1cccc(c1)Cl)C(=O)N 62a_100000702099_100011713710 [0,2,0,0,0,0|2,0,0]=4 12556 B15R1.121 CC(SCCc1cccc(c1)Cl)C(=O)N 62a_100011713710_100000702099 [0,2,0,0,0,0|2,0,0]=4 12557 B15R1.121 CC(SCCc1cccc(c1)F)C(=O)N 62a_100000702099_100011217235 [0,2,0,0,0,0|2,0,0]=4 12558 B15R1.121 CC(SCCc1cccc(c1)F)C(=O)N 62a_100011217235_100000702099 [0,2,0,0,0,0|2,0,0]=4 12559 B15R1.121 C[C@@H](NCCc1cccc(c1)Br)C(=O)N 2230a_100000119354_100011740638 [0,2,0,0,0,0|2,0,0]=4 12560 B15R1.121 C[C@@H](NCCc1cccc(c1)Br)C(=O)N 34a_100000119354_100011740638 [0,2,0,0,0,0|2,0,0]=4 12561 B15R1.121 C[C@@H](NCCc1cccc(c1)Cl)C(=O)N 2230a_100000119354_100011713710 [0,2,0,0,0,0|2,0,0]=4 12562 B15R1.121 C[C@@H](NCCc1cccc(c1)Cl)C(=O)N 34a_100000119354_100011713710 [0,2,0,0,0,0|2,0,0]=4 12563 B15R1.121 C[C@@H](NCCc1cccc(c1)F)C(=O)N 2230a_100000119354_100011217235 [0,2,0,0,0,0|2,0,0]=4 12564 B15R1.121 C[C@@H](NCCc1cccc(c1)F)C(=O)N 34a_100000119354_100011217235 [0,2,0,0,0,0|2,0,0]=4 12565 B15R1.121 C[C@@H](OCCc1cccc(c1)Br)C(=O)N 34a_100000731257_100011740638 [0,2,0,0,0,0|2,0,0]=4 12566 B15R1.121 C[C@@H](OCCc1cccc(c1)Br)C(=O)N 7a_100000731257_100011740638 [0,2,0,0,0,0|2,0,0]=4 12567 B15R1.121 C[C@@H](OCCc1cccc(c1)Cl)C(=O)N 34a_100000731257_100011713710 [0,2,0,0,0,0|2,0,0]=4 12568 B15R1.121 C[C@@H](OCCc1cccc(c1)Cl)C(=O)N 7a_100000731257_100011713710 [0,2,0,0,0,0|2,0,0]=4 12569 B15R1.121 C[C@@H](OCCc1cccc(c1)F)C(=O)N 34a_100000731257_100011217235 [0,2,0,0,0,0|2,0,0]=4 12570 B15R1.121 C[C@@H](OCCc1cccc(c1)F)C(=O)N 7a_100000731257_100011217235 [0,2,0,0,0,0|2,0,0]=4 12571 B15R1.121 C[C@H](NCCc1cccc(c1)Br)C(=O)O 269956a_100000743915_100011740638 [0,2,0,0,0,0|1,0,0]=3 12572 B15R1.121 C[C@H](NCCc1cccc(c1)Cl)C(=O)O 269956a_100000743915_100011713710 [0,2,0,0,0,0|1,0,0]=3 12573 B15R1.121 C[C@H](NCCc1cccc(c1)F)C(=O)O 269956a_100000743915_100011217235 [0,2,0,0,0,0|1,0,0]=3 12574 B15R1.121 C[C@H](OCCc1cccc(c1)Br)C(=O)[O-] 7a_217856618621_100011740638 [0,2,0,0,0,0|1,0,1]=4 12575 B15R1.121 C[C@H](OCCc1cccc(c1)Cl)C(=O)[O-] 7a_217856618621_100011713710 [0,2,0,0,0,0|1,0,1]=4 12576 B15R1.121 C[C@H](OCCc1cccc(c1)F)C(=O)[O-] 7a_217856618621_100011217235 [0,2,0,0,0,0|1,0,1]=4 12577 B15R1.121 Cc1cc(ccn1)CNCC(C)C(=O)O 269956a_100000749485_200020672517 [0,2,0,0,0,0|2,0,0]=4 12578 B15R1.121 Cc1cc(ccn1)CNCC(F)C(=O)O 269956a_100000084737_200020672517 [0,2,0,0,0,0|2,0,0]=4 12579 B15R1.121 Cc1cccc(c1)CCNC(C)C(=O)N 2230a_100000749837_100000702099 [0,2,0,0,0,0|2,0,0]=4 12580 B15R1.121 Cc1cccc(c1)CCNC(C)C(=O)N 34a_100000749837_100000702099 [0,2,0,0,0,0|2,0,0]=4 12581 B15R1.121 Cc1cccc(c1)CCNC(F)C(=O)N 2230a_100000749837_100009813875 [0,2,0,0,0,0|2,0,0]=4 12582 B15R1.121 Cc1cccc(c1)CCNC(F)C(=O)N 34a_100000749837_100009813875 [0,2,0,0,0,0|2,0,0]=4 12583 B15R1.121 Cc1cccc(c1)CCNC(F)C(=O)[O-] 34a_100000749837_100020610796 [0,2,0,0,0,0|1,0,1]=4 12584 B15R1.121 Cc1cccc(c1)CCN[C@@H](C)C(=O)O 269956a_100000743915_100011713685 [0,2,0,0,0,0|1,0,0]=3 12585 B15R1.121 Cc1cccc(c1)CCN[C@H](C)C(=O)N 2230a_100000119354_100011713685 [0,2,0,0,0,0|2,0,0]=4 12586 B15R1.121 Cc1cccc(c1)CCN[C@H](C)C(=O)N 34a_100000119354_100011713685 [0,2,0,0,0,0|2,0,0]=4 12587 B15R1.121 Cc1cccc(c1)CCOC(C)C(=O)N 34a_100011217157_100000702099 [0,2,0,0,0,0|2,0,0]=4 12588 B15R1.121 Cc1cccc(c1)CCOC(C)C(=O)N 7a_100011217157_100000702099 [0,2,0,0,0,0|2,0,0]=4 12589 B15R1.121 Cc1cccc(c1)CCOC(F)C(=O)N 34a_100011217157_100009813875 [0,2,0,0,0,0|2,0,0]=4 12590 B15R1.121 Cc1cccc(c1)CCOC(F)C(=O)N 7a_100011217157_100009813875 [0,2,0,0,0,0|2,0,0]=4 12591 B15R1.121 Cc1cccc(c1)CCOC(F)C(=O)[O-] 34a_100011217157_100020610796 [0,2,0,0,0,0|1,0,1]=4 12592 B15R1.121 Cc1cccc(c1)CCO[C@@H](C)C(=O)[O-] 7a_217856618621_100011713685 [0,2,0,0,0,0|1,0,1]=4 12593 B15R1.121 Cc1cccc(c1)CCO[C@H](C)C(=O)N 34a_100000731257_100011713685 [0,2,0,0,0,0|2,0,0]=4 12594 B15R1.121 Cc1cccc(c1)CCO[C@H](C)C(=O)N 7a_100000731257_100011713685 [0,2,0,0,0,0|2,0,0]=4 12595 B15R1.121 Cc1cccc(c1)CCSC(C)C(=O)N 62a_100000702099_100011713685 [0,2,0,0,0,0|2,0,0]=4 12596 B15R1.121 Cc1cccc(c1)CCSC(C)C(=O)N 62a_100011713685_100000702099 [0,2,0,0,0,0|2,0,0]=4 12597 B15R1.121 Cc1cccc(c1)CCSC(F)C(=O)N 62a_100009813875_100011713685 [0,2,0,0,0,0|2,0,0]=4 12598 B15R1.121 Cc1cccc(c1)CCSC(F)C(=O)N 62a_100011713685_100009813875 [0,2,0,0,0,0|2,0,0]=4 12599 B15R1.121 Cc1cccc(c1)CCSC(F)C(=O)[O-] 62a_100011713685_100020610796 [0,2,0,0,0,0|1,0,1]=4 12600 B15R1.121 Cc1cccc(c1)CCSC(F)C(=O)[O-] 62a_100020610796_100011713685 [0,2,0,0,0,0|1,0,1]=4 12601 B15R1.121 Cc1cccc(c1)CNCC(C)C(=O)O 269956a_100000749485_100000005736 [0,2,0,0,0,0|1,0,0]=3 12602 B15R1.121 Cc1cccc(c1)CNCC(F)C(=O)O 269956a_100000084737_100000005736 [0,2,0,0,0,0|1,0,0]=3 12603 B15R1.121 Cc1cccc(c1)COC[C@H](N)C(=O)N 34a_100000729942_100000211840 [0,2,0,0,0,0|2,0,0]=4 12604 B15R1.121 Cc1cccc(n1)CNCC(C)C(=O)O 269956a_100000749485_100000757606 [0,2,0,0,0,0|2,0,0]=4 12605 B15R1.121 Cc1cccc(n1)CNCC(F)C(=O)O 269956a_100000084737_100000757606 [0,2,0,0,0,0|2,0,0]=4 12606 B15R1.121 Cc1ccnc(c1)CNCC(C)C(=O)O 269956a_100000749485_100000718516 [0,2,0,0,0,0|2,0,0]=4 12607 B15R1.121 Cc1ccnc(c1)CNCC(F)C(=O)O 269956a_100000084737_100000718516 [0,2,0,0,0,0|2,0,0]=4 12608 B15R1.121 Cc1cncc(c1)CNCC(C)C(=O)O 269956a_100000749485_100016988603 [0,2,0,0,0,0|2,0,0]=4 12609 B15R1.121 Cc1cncc(c1)CNCC(F)C(=O)O 269956a_100000084737_100016988603 [0,2,0,0,0,0|2,0,0]=4 12610 B15R1.121 NC(=O)C(F)NCCc1cccc(c1)Br 2230a_100011207229_100009813875 [0,2,0,0,0,0|2,0,0]=4 12611 B15R1.121 NC(=O)C(F)NCCc1cccc(c1)Br 34a_100011207229_100009813875 [0,2,0,0,0,0|2,0,0]=4 12612 B15R1.121 NC(=O)C(F)NCCc1cccc(c1)Cl 2230a_100000185263_100009813875 [0,2,0,0,0,0|2,0,0]=4 12613 B15R1.121 NC(=O)C(F)NCCc1cccc(c1)Cl 34a_100000185263_100009813875 [0,2,0,0,0,0|2,0,0]=4 12614 B15R1.121 NC(=O)C(F)NCCc1cccc(c1)F 2230a_100000205154_100009813875 [0,2,0,0,0,0|2,0,0]=4 12615 B15R1.121 NC(=O)C(F)NCCc1cccc(c1)F 34a_100000205154_100009813875 [0,2,0,0,0,0|2,0,0]=4 12616 B15R1.121 NC(=O)C(F)NCCc1cccc(c1)O 2230a_100000747277_100009813875 [0,2,0,0,0,0|2,0,0]=4 12617 B15R1.121 NC(=O)C(F)NCCc1cccc(c1)O 34a_100000747277_100009813875 [0,2,0,0,0,0|2,0,0]=4 12618 B15R1.121 NC(=O)C(F)OCCc1cccc(c1)Br 34a_100011217444_100009813875 [0,2,0,0,0,0|2,0,0]=4 12619 B15R1.121 NC(=O)C(F)OCCc1cccc(c1)Br 7a_100011217444_100009813875 [0,2,0,0,0,0|2,0,0]=4 12620 B15R1.121 NC(=O)C(F)OCCc1cccc(c1)Cl 34a_100000754733_100009813875 [0,2,0,0,0,0|2,0,0]=4 12621 B15R1.121 NC(=O)C(F)OCCc1cccc(c1)Cl 7a_100000754733_100009813875 [0,2,0,0,0,0|2,0,0]=4 12622 B15R1.121 NC(=O)C(F)OCCc1cccc(c1)F 34a_100000763591_100009813875 [0,2,0,0,0,0|2,0,0]=4 12623 B15R1.121 NC(=O)C(F)OCCc1cccc(c1)F 7a_100000763591_100009813875 [0,2,0,0,0,0|2,0,0]=4 12624 B15R1.121 NC(=O)C(F)OCCc1cccc(c1)N 34a_100011996697_100009813875 [0,2,0,0,0,0|2,0,0]=4 12625 B15R1.121 NC(=O)C(F)SCCc1cccc(c1)Br 62a_100009813875_100011740638 [0,2,0,0,0,0|2,0,0]=4 12626 B15R1.121 NC(=O)C(F)SCCc1cccc(c1)Br 62a_100011740638_100009813875 [0,2,0,0,0,0|2,0,0]=4 12627 B15R1.121 NC(=O)C(F)SCCc1cccc(c1)Cl 62a_100009813875_100011713710 [0,2,0,0,0,0|2,0,0]=4 12628 B15R1.121 NC(=O)C(F)SCCc1cccc(c1)Cl 62a_100011713710_100009813875 [0,2,0,0,0,0|2,0,0]=4 12629 B15R1.121 NC(=O)C(F)SCCc1cccc(c1)F 62a_100009813875_100011217235 [0,2,0,0,0,0|2,0,0]=4 12630 B15R1.121 NC(=O)C(F)SCCc1cccc(c1)F 62a_100011217235_100009813875 [0,2,0,0,0,0|2,0,0]=4 12631 B15R1.121 NC(=O)[C@@H](N)COCc1cccc(c1)Br 34a_100000729942_100000698116 [0,2,0,0,0,0|2,0,0]=4 12632 B15R1.121 NC(=O)[C@@H](N)COCc1cccc(c1)Cl 34a_100000729942_100000187163 [0,2,0,0,0,0|2,0,0]=4 12633 B15R1.121 NC(=O)[C@@H](N)COCc1cccc(c1)F 34a_100000729942_100000187166 [0,2,0,0,0,0|2,0,0]=4 12634 B15R1.121 NC(=O)[C@@H](N)COCc1cccc(c1)I 34a_100000729942_100011218688 [0,2,0,0,0,0|2,0,0]=4 12635 B15R1.121 NC(=O)[C@@H](N)COCc1cccc(c1)O 34a_100000729942_100011660834 [0,2,0,0,0,0|2,0,0]=4 12636 B15R1.121 Nc1cccc(c1)CCOC(F)C(=O)[O-] 34a_100011996697_100020610796 [0,2,0,0,0,0|1,0,1]=4 12637 B15R1.121 O=C(O)C(F)CNCc1cc(ccn1)Br 269956a_100000084737_100010173614 [0,2,0,0,0,0|2,0,0]=4 12638 B15R1.121 O=C(O)C(F)CNCc1cc(ccn1)Cl 269956a_100000084737_100016988179 [0,2,0,0,0,0|2,0,0]=4 12639 B15R1.121 O=C(O)C(F)CNCc1cccc(c1)Br 269956a_100000084737_100000211773 [0,2,0,0,0,0|1,0,0]=3 12640 B15R1.121 O=C(O)C(F)CNCc1cccc(c1)Cl 269956a_100000084737_100000187163 [0,2,0,0,0,0|1,0,0]=3 12641 B15R1.121 O=C(O)C(F)CNCc1cccc(c1)F 269956a_100000084737_100000230114 [0,2,0,0,0,0|1,0,0]=3 12642 B15R1.121 O=C(O)C(F)CNCc1cccc(c1)I 269956a_100000084737_100011218688 [0,2,0,0,0,0|1,0,0]=3 12643 B15R1.121 O=C(O)C(F)CNCc1cccc(c1)O 269956a_100000084737_100011660834 [0,2,0,0,0,0|1,0,0]=3 12644 B15R1.121 O=C(O)C(F)CNCc1cccc(n1)Br 269956a_100000084737_100009889011 [0,2,0,0,0,0|2,0,0]=4 12645 B15R1.121 O=C(O)C(F)CNCc1cccc(n1)Cl 269956a_100000084737_100000086093 [0,2,0,0,0,0|2,0,0]=4 12646 B15R1.121 O=C(O)C(F)CNCc1cccc(n1)F 269956a_100000084737_100009819644 [0,2,0,0,0,0|2,0,0]=4 12647 B15R1.121 O=C(O)C(F)CNCc1ccnc(c1)Br 269956a_100000084737_100010254460 [0,2,0,0,0,0|2,0,0]=4 12648 B15R1.121 O=C(O)C(F)CNCc1ccnc(c1)Cl 269956a_100000084737_100000764220 [0,2,0,0,0,0|2,0,0]=4 12649 B15R1.121 O=C(O)C(F)CNCc1cncc(c1)Br 269956a_100000084737_100000738771 [0,2,0,0,0,0|2,0,0]=4 12650 B15R1.121 O=C(O)C(F)CNCc1cncc(c1)Cl 269956a_100000084737_100016992070 [0,2,0,0,0,0|2,0,0]=4 12651 B15R1.121 O=C(O)C(F)CNCc1cncc(c1)F 269956a_100000084737_100000725299 [0,2,0,0,0,0|2,0,0]=4 12652 B15R1.121 O=C([O-])C(F)NCCc1cccc(c1)Br 34a_100011207229_100020610796 [0,2,0,0,0,0|1,0,1]=4 12653 B15R1.121 O=C([O-])C(F)NCCc1cccc(c1)Cl 34a_100000185263_100020610796 [0,2,0,0,0,0|1,0,1]=4 12654 B15R1.121 O=C([O-])C(F)NCCc1cccc(c1)F 34a_100000205154_100020610796 [0,2,0,0,0,0|1,0,1]=4 12655 B15R1.121 O=C([O-])C(F)NCCc1cccc(c1)O 34a_100000747277_100020610796 [0,2,0,0,0,0|1,0,1]=4 12656 B15R1.121 O=C([O-])C(F)OCCc1cccc(c1)Br 34a_100011217444_100020610796 [0,2,0,0,0,0|1,0,1]=4 12657 B15R1.121 O=C([O-])C(F)OCCc1cccc(c1)Cl 34a_100000754733_100020610796 [0,2,0,0,0,0|1,0,1]=4 12658 B15R1.121 O=C([O-])C(F)OCCc1cccc(c1)F 34a_100000763591_100020610796 [0,2,0,0,0,0|1,0,1]=4 12659 B15R1.121 O=C([O-])C(F)SCCc1cccc(c1)Br 62a_100011740638_100020610796 [0,2,0,0,0,0|1,0,1]=4 12660 B15R1.121 O=C([O-])C(F)SCCc1cccc(c1)Br 62a_100020610796_100011740638 [0,2,0,0,0,0|1,0,1]=4 12661 B15R1.121 O=C([O-])C(F)SCCc1cccc(c1)Cl 62a_100011713710_100020610796 [0,2,0,0,0,0|1,0,1]=4 12662 B15R1.121 O=C([O-])C(F)SCCc1cccc(c1)Cl 62a_100020610796_100011713710 [0,2,0,0,0,0|1,0,1]=4 12663 B15R1.121 O=C([O-])C(F)SCCc1cccc(c1)F 62a_100011217235_100020610796 [0,2,0,0,0,0|1,0,1]=4 12664 B15R1.121 O=C([O-])C(F)SCCc1cccc(c1)F 62a_100020610796_100011217235 [0,2,0,0,0,0|1,0,1]=4 12665 B15R1.123 CC(=O)CCCNc1cccc(c1Br)C 34a_100000684715_100000685027 [0,2,0,0,0,0|2,0,0]=4 12666 B15R1.123 CC(=O)CCCNc1cccc(c1Br)Cl 34a_100000687072_100000685027 [0,2,0,0,0,0|2,0,0]=4 12667 B15R1.123 CC(=O)CCCNc1cccc(c1Br)F 34a_100011934729_100000685027 [0,2,0,0,0,0|2,0,0]=4 12668 B15R1.123 CC(=O)CCCNc1cccc(c1Br)O 34a_100012183704_100000685027 [0,2,0,0,0,0|2,0,0]=4 12669 B15R1.123 CC(=O)CCCNc1cccc(c1Br)O 7a_100012183704_100011215641 [0,2,0,0,0,0|2,0,0]=4 12670 B15R1.123 CC(=O)CCCNc1cccc(c1C)Br 34a_100000750434_100000685027 [0,2,0,0,0,0|2,0,0]=4 12671 B15R1.123 CC(=O)CCCNc1cccc(c1C)C 34a_100000210026_100000685027 [0,2,0,0,0,0|2,0,0]=4 12672 B15R1.123 CC(=O)CCCNc1cccc(c1C)C 7a_100000210026_100011215641 [0,2,0,0,0,0|2,0,0]=4 12673 B15R1.123 CC(=O)CCCNc1cccc(c1C)Cl 34a_100000210441_100000685027 [0,2,0,0,0,0|2,0,0]=4 12674 B15R1.123 CC(=O)CCCNc1cccc(c1C)Cl 7a_100000210441_100011215641 [0,2,0,0,0,0|2,0,0]=4 12675 B15R1.123 CC(=O)CCCNc1cccc(c1C)F 34a_100000745574_100000685027 [0,2,0,0,0,0|2,0,0]=4 12676 B15R1.123 CC(=O)CCCNc1cccc(c1C)F 7a_100000745574_100011215641 [0,2,0,0,0,0|2,0,0]=4 12677 B15R1.123 CC(=O)CCCNc1cccc(c1C)I 34a_100000761887_100000685027 [0,2,0,0,0,0|2,0,0]=4 12678 B15R1.123 CC(=O)CCCNc1cccc(c1C)O 34a_100011216573_100000685027 [0,2,0,0,0,0|2,0,0]=4 12679 B15R1.123 CC(=O)CCCNc1cccc(c1C)O 7a_100011216573_100011215641 [0,2,0,0,0,0|2,0,0]=4 12680 B15R1.123 CC(=O)CCCNc1cccc(c1Cl)Br 34a_100000687075_100000685027 [0,2,0,0,0,0|2,0,0]=4 12681 B15R1.123 CC(=O)CCCNc1cccc(c1Cl)C 34a_100000765562_100000685027 [0,2,0,0,0,0|2,0,0]=4 12682 B15R1.123 CC(=O)CCCNc1cccc(c1Cl)C 7a_100000765562_100011215641 [0,2,0,0,0,0|2,0,0]=4 12683 B15R1.123 CC(=O)CCCNc1cccc(c1Cl)Cl 34a_100000185733_100000685027 [0,2,0,0,0,0|2,0,0]=4 12684 B15R1.123 CC(=O)CCCNc1cccc(c1Cl)F 34a_100000692321_100000685027 [0,2,0,0,0,0|2,0,0]=4 12685 B15R1.123 CC(=O)CCCNc1cccc(c1Cl)O 34a_100012002038_100000685027 [0,2,0,0,0,0|2,0,0]=4 12686 B15R1.123 CC(=O)CCCNc1cccc(c1Cl)O 7a_100012002038_100011215641 [0,2,0,0,0,0|2,0,0]=4 12687 B15R1.123 CC(=O)CCCNc1cccc(c1F)Br 34a_100011935091_100000685027 [0,2,0,0,0,0|2,0,0]=4 12688 B15R1.123 CC(=O)CCCNc1cccc(c1F)C 34a_100000697159_100000685027 [0,2,0,0,0,0|2,0,0]=4 12689 B15R1.123 CC(=O)CCCNc1cccc(c1F)C 7a_100000697159_100011215641 [0,2,0,0,0,0|2,0,0]=4 12690 B15R1.123 CC(=O)CCCNc1cccc(c1F)Cl 34a_100000199060_100000685027 [0,2,0,0,0,0|2,0,0]=4 12691 B15R1.123 CC(=O)CCCNc1cccc(c1F)F 34a_100000743855_100000685027 [0,2,0,0,0,0|2,0,0]=4 12692 B15R1.123 CC(=O)CCCNc1cccc(c1I)Br 34a_100020590159_100000685027 [0,2,0,0,0,0|2,0,0]=4 12693 B15R1.123 CC(=O)CCCNc1cccc(c1I)C 34a_100000761888_100000685027 [0,2,0,0,0,0|2,0,0]=4 12694 B15R1.123 CC(=O)CCCNc1cccc(c1I)Cl 34a_100000049713_100000685027 [0,2,0,0,0,0|2,0,0]=4 12695 B15R1.123 CC(=O)CCCNc1cccc(c1I)F 34a_100000690935_100000685027 [0,2,0,0,0,0|2,0,0]=4 12696 B15R1.123 CC(=O)CCCNc1cccc(c1O)Br 34a_100011934915_100000685027 [0,2,0,0,0,0|2,0,0]=4 12697 B15R1.123 CC(=O)CCCNc1cccc(c1O)C 34a_100000756359_100000685027 [0,2,0,0,0,0|2,0,0]=4 12698 B15R1.123 CC(=O)CCCNc1cccc(c1O)Cl 34a_100000754742_100000685027 [0,2,0,0,0,0|2,0,0]=4 12699 B15R1.123 CC(=O)CCCNc1cccc(c1O)F 34a_100011934987_100000685027 [0,2,0,0,0,0|2,0,0]=4 12700 B15R1.123 CC(=O)CCCOc1cccc(c1Br)Br 34a_100010187966_100000685027 [0,2,0,0,0,0|2,0,0]=4 12701 B15R1.123 CC(=O)CCCOc1cccc(c1Br)Br 7a_100010187966_100011215641 [0,2,0,0,0,0|2,0,0]=4 12702 B15R1.123 CC(=O)CCCOc1cccc(c1Br)C 34a_100000686692_100000685027 [0,2,0,0,0,0|2,0,0]=4 12703 B15R1.123 CC(=O)CCCOc1cccc(c1Br)C 7a_100000686692_100011215641 [0,2,0,0,0,0|2,0,0]=4 12704 B15R1.123 CC(=O)CCCOc1cccc(c1Br)Cl 34a_100012348804_100000685027 [0,2,0,0,0,0|2,0,0]=4 12705 B15R1.123 CC(=O)CCCOc1cccc(c1Br)Cl 7a_100012348804_100011215641 [0,2,0,0,0,0|2,0,0]=4 12706 B15R1.123 CC(=O)CCCOc1cccc(c1Br)F 34a_100009820682_100000685027 [0,2,0,0,0,0|2,0,0]=4 12707 B15R1.123 CC(=O)CCCOc1cccc(c1Br)F 7a_100009820682_100011215641 [0,2,0,0,0,0|2,0,0]=4 12708 B15R1.123 CC(=O)CCCOc1cccc(c1Br)I 34a_100010187914_100000685027 [0,2,0,0,0,0|2,0,0]=4 12709 B15R1.123 CC(=O)CCCOc1cccc(c1Br)I 7a_100010187914_100011215641 [0,2,0,0,0,0|2,0,0]=4 12710 B15R1.123 CC(=O)CCCOc1cccc(c1Br)N 34a_100012183704_100000685027 [0,2,0,0,0,0|2,0,0]=4 12711 B15R1.123 CC(=O)CCCOc1cccc(c1Br)N 7a_100012183704_100011215641 [0,2,0,0,0,0|2,0,0]=4 12712 B15R1.123 CC(=O)CCCOc1cccc(c1C)Br 34a_100012002258_100000685027 [0,2,0,0,0,0|2,0,0]=4 12713 B15R1.123 CC(=O)CCCOc1cccc(c1C)Br 7a_100012002258_100011215641 [0,2,0,0,0,0|2,0,0]=4 12714 B15R1.123 CC(=O)CCCOc1cccc(c1C)C 34a_100000185855_100000685027 [0,2,0,0,0,0|2,0,0]=4 12715 B15R1.123 CC(=O)CCCOc1cccc(c1C)C 7a_100000185855_100011215641 [0,2,0,0,0,0|2,0,0]=4 12716 B15R1.123 CC(=O)CCCOc1cccc(c1C)Cl 34a_100011265684_100000685027 [0,2,0,0,0,0|2,0,0]=4 12717 B15R1.123 CC(=O)CCCOc1cccc(c1C)Cl 7a_100011265684_100011215641 [0,2,0,0,0,0|2,0,0]=4 12718 B15R1.123 CC(=O)CCCOc1cccc(c1C)F 34a_100011217231_100000685027 [0,2,0,0,0,0|2,0,0]=4 12719 B15R1.123 CC(=O)CCCOc1cccc(c1C)F 7a_100011217231_100011215641 [0,2,0,0,0,0|2,0,0]=4 12720 B15R1.123 CC(=O)CCCOc1cccc(c1C)N 34a_100011216573_100000685027 [0,2,0,0,0,0|2,0,0]=4 12721 B15R1.123 CC(=O)CCCOc1cccc(c1C)N 7a_100011216573_100011215641 [0,2,0,0,0,0|2,0,0]=4 12722 B15R1.123 CC(=O)CCCOc1cccc(c1Cl)Br 34a_100010187913_100000685027 [0,2,0,0,0,0|2,0,0]=4 12723 B15R1.123 CC(=O)CCCOc1cccc(c1Cl)Br 7a_100010187913_100011215641 [0,2,0,0,0,0|2,0,0]=4 12724 B15R1.123 CC(=O)CCCOc1cccc(c1Cl)C 34a_100000695629_100000685027 [0,2,0,0,0,0|2,0,0]=4 12725 B15R1.123 CC(=O)CCCOc1cccc(c1Cl)C 7a_100000695629_100011215641 [0,2,0,0,0,0|2,0,0]=4 12726 B15R1.123 CC(=O)CCCOc1cccc(c1Cl)Cl 1458a_100000746216_200000210301 [0,2,0,0,0,0|2,0,0]=4 12727 B15R1.123 CC(=O)CCCOc1cccc(c1Cl)Cl 34a_100000211076_100000685027 [0,2,0,0,0,0|2,0,0]=4 12728 B15R1.123 CC(=O)CCCOc1cccc(c1Cl)Cl 7a_100000211076_100011215641 [0,2,0,0,0,0|2,0,0]=4 12729 B15R1.123 CC(=O)CCCOc1cccc(c1Cl)F 34a_100000087408_100000685027 [0,2,0,0,0,0|2,0,0]=4 12730 B15R1.123 CC(=O)CCCOc1cccc(c1Cl)F 7a_100000087408_100011215641 [0,2,0,0,0,0|2,0,0]=4 12731 B15R1.123 CC(=O)CCCOc1cccc(c1Cl)I 34a_100000049636_100000685027 [0,2,0,0,0,0|2,0,0]=4 12732 B15R1.123 CC(=O)CCCOc1cccc(c1Cl)I 7a_100000049636_100011215641 [0,2,0,0,0,0|2,0,0]=4 12733 B15R1.123 CC(=O)CCCOc1cccc(c1Cl)N 34a_100012002038_100000685027 [0,2,0,0,0,0|2,0,0]=4 12734 B15R1.123 CC(=O)CCCOc1cccc(c1Cl)N 7a_100012002038_100011215641 [0,2,0,0,0,0|2,0,0]=4 12735 B15R1.123 CC(=O)CCCOc1cccc(c1F)Br 34a_100009817021_100000685027 [0,2,0,0,0,0|2,0,0]=4 12736 B15R1.123 CC(=O)CCCOc1cccc(c1F)Br 7a_100009817021_100011215641 [0,2,0,0,0,0|2,0,0]=4 12737 B15R1.123 CC(=O)CCCOc1cccc(c1F)C 34a_100000751311_100000685027 [0,2,0,0,0,0|2,0,0]=4 12738 B15R1.123 CC(=O)CCCOc1cccc(c1F)C 7a_100000751311_100011215641 [0,2,0,0,0,0|2,0,0]=4 12739 B15R1.123 CC(=O)CCCOc1cccc(c1F)Cl 34a_100000687438_100000685027 [0,2,0,0,0,0|2,0,0]=4 12740 B15R1.123 CC(=O)CCCOc1cccc(c1F)Cl 7a_100000687438_100011215641 [0,2,0,0,0,0|2,0,0]=4 12741 B15R1.123 CC(=O)CCCOc1cccc(c1F)F 34a_100000751161_100000685027 [0,2,0,0,0,0|2,0,0]=4 12742 B15R1.123 CC(=O)CCCOc1cccc(c1F)F 7a_100000751161_100011215641 [0,2,0,0,0,0|2,0,0]=4 12743 B15R1.123 CC(=O)CCCOc1cccc(c1I)Br 34a_100010187912_100000685027 [0,2,0,0,0,0|2,0,0]=4 12744 B15R1.123 CC(=O)CCCOc1cccc(c1I)Br 7a_100010187912_100011215641 [0,2,0,0,0,0|2,0,0]=4 12745 B15R1.123 CC(=O)CCCOc1cccc(c1I)C 34a_100010083724_100000685027 [0,2,0,0,0,0|2,0,0]=4 12746 B15R1.123 CC(=O)CCCOc1cccc(c1I)C 7a_100010083724_100011215641 [0,2,0,0,0,0|2,0,0]=4 12747 B15R1.123 CC(=O)CCCOc1cccc(c1I)Cl 34a_100000050174_100000685027 [0,2,0,0,0,0|2,0,0]=4 12748 B15R1.123 CC(=O)CCCOc1cccc(c1I)Cl 7a_100000050174_100011215641 [0,2,0,0,0,0|2,0,0]=4 12749 B15R1.123 CC(=O)CCCOc1cccc(c1I)F 34a_100000690913_100000685027 [0,2,0,0,0,0|2,0,0]=4 12750 B15R1.123 CC(=O)CCCOc1cccc(c1I)F 7a_100000690913_100011215641 [0,2,0,0,0,0|2,0,0]=4 12751 B15R1.123 CC(=O)CCCOc1cccc(c1N)Br 34a_100011934926_100000685027 [0,2,0,0,0,0|2,0,0]=4 12752 B15R1.123 CC(=O)CCCOc1cccc(c1N)Br 7a_100011934926_100011215641 [0,2,0,0,0,0|2,0,0]=4 12753 B15R1.123 CC(=O)CCCOc1cccc(c1N)C 34a_100000743429_100000685027 [0,2,0,0,0,0|2,0,0]=4 12754 B15R1.123 CC(=O)CCCOc1cccc(c1N)C 7a_100000743429_100011215641 [0,2,0,0,0,0|2,0,0]=4 12755 B15R1.123 CC(=O)CCCOc1cccc(c1N)Cl 34a_100012022510_100000685027 [0,2,0,0,0,0|2,0,0]=4 12756 B15R1.123 CC(=O)CCCOc1cccc(c1N)Cl 7a_100012022510_100011215641 [0,2,0,0,0,0|2,0,0]=4 12757 B15R1.123 CC(=O)CCCOc1cccc(c1N)F 34a_100020591140_100000685027 [0,2,0,0,0,0|2,0,0]=4 12758 B15R1.123 CC(=O)CCCOc1cccc(c1N)F 7a_100020591140_100011215641 [0,2,0,0,0,0|2,0,0]=4 12759 B15R1.123 CC(=O)CCCOc1cccc(c1N)I 34a_200000049512_100000685027 [0,2,0,0,0,0|2,0,0]=4 12760 B15R1.123 CC(=O)CCCOc1cccc(c1N)I 7a_200000049512_100011215641 [0,2,0,0,0,0|2,0,0]=4 12761 B15R1.123 CC(=O)CCCOc1cccc(c1N)N 34a_100000033209_100000685027 [0,2,0,0,0,0|2,0,0]=4 12762 B15R1.123 CC(=O)CCCSc1cccc(c1Br)Br 62a_100010175083_100011215641 [0,2,0,0,0,0|2,0,0]=4 12763 B15R1.123 CC(=O)CCCSc1cccc(c1Br)Br 62a_100011215641_100010175083 [0,2,0,0,0,0|2,0,0]=4 12764 B15R1.123 CC(=O)CCCSc1cccc(c1Br)C 62a_100011215641_100012362457 [0,2,0,0,0,0|2,0,0]=4 12765 B15R1.123 CC(=O)CCCSc1cccc(c1Br)C 62a_100012362457_100011215641 [0,2,0,0,0,0|2,0,0]=4 12766 B15R1.123 CC(=O)CCCSc1cccc(c1Br)Cl 62a_100011215641_100014021842 [0,2,0,0,0,0|2,0,0]=4 12767 B15R1.123 CC(=O)CCCSc1cccc(c1Br)Cl 62a_100014021842_100011215641 [0,2,0,0,0,0|2,0,0]=4 12768 B15R1.123 CC(=O)CCCSc1cccc(c1Br)F 62a_100010202630_100011215641 [0,2,0,0,0,0|2,0,0]=4 12769 B15R1.123 CC(=O)CCCSc1cccc(c1Br)F 62a_100011215641_100010202630 [0,2,0,0,0,0|2,0,0]=4 12770 B15R1.123 CC(=O)CCCSc1cccc(c1Br)O 62a_100010187914_100011215641 [0,2,0,0,0,0|2,0,0]=4 12771 B15R1.123 CC(=O)CCCSc1cccc(c1Br)O 62a_100011215641_100010187914 [0,2,0,0,0,0|2,0,0]=4 12772 B15R1.123 CC(=O)CCCSc1cccc(c1C)Br 62a_100011215641_100012353703 [0,2,0,0,0,0|2,0,0]=4 12773 B15R1.123 CC(=O)CCCSc1cccc(c1C)Br 62a_100012353703_100011215641 [0,2,0,0,0,0|2,0,0]=4 12774 B15R1.123 CC(=O)CCCSc1cccc(c1C)C 62a_100011214922_100011215641 [0,2,0,0,0,0|2,0,0]=4 12775 B15R1.123 CC(=O)CCCSc1cccc(c1C)C 62a_100011215641_100011214922 [0,2,0,0,0,0|2,0,0]=4 12776 B15R1.123 CC(=O)CCCSc1cccc(c1C)Cl 62a_100000726075_100011215641 [0,2,0,0,0,0|2,0,0]=4 12777 B15R1.123 CC(=O)CCCSc1cccc(c1C)Cl 62a_100011215641_100000726075 [0,2,0,0,0,0|2,0,0]=4 12778 B15R1.123 CC(=O)CCCSc1cccc(c1C)F 62a_100011215641_100011216893 [0,2,0,0,0,0|2,0,0]=4 12779 B15R1.123 CC(=O)CCCSc1cccc(c1C)F 62a_100011216893_100011215641 [0,2,0,0,0,0|2,0,0]=4 12780 B15R1.123 CC(=O)CCCSc1cccc(c1C)N 62a_100000761887_100011215641 [0,2,0,0,0,0|2,0,0]=4 12781 B15R1.123 CC(=O)CCCSc1cccc(c1C)N 62a_100011215641_100000761887 [0,2,0,0,0,0|2,0,0]=4 12782 B15R1.123 CC(=O)CCCSc1cccc(c1C)O 62a_100011215641_100012002258 [0,2,0,0,0,0|2,0,0]=4 12783 B15R1.123 CC(=O)CCCSc1cccc(c1C)O 62a_100012002258_100011215641 [0,2,0,0,0,0|2,0,0]=4 12784 B15R1.123 CC(=O)CCCSc1cccc(c1Cl)Br 62a_100010142854_100011215641 [0,2,0,0,0,0|2,0,0]=4 12785 B15R1.123 CC(=O)CCCSc1cccc(c1Cl)Br 62a_100011215641_100010142854 [0,2,0,0,0,0|2,0,0]=4 12786 B15R1.123 CC(=O)CCCSc1cccc(c1Cl)C 62a_100011215641_200012352035 [0,2,0,0,0,0|2,0,0]=4 12787 B15R1.123 CC(=O)CCCSc1cccc(c1Cl)C 62a_200012352035_100011215641 [0,2,0,0,0,0|2,0,0]=4 12788 B15R1.123 CC(=O)CCCSc1cccc(c1Cl)Cl 62a_100011215384_100011215641 [0,2,0,0,0,0|2,0,0]=4 12789 B15R1.123 CC(=O)CCCSc1cccc(c1Cl)Cl 62a_100011215641_100011215384 [0,2,0,0,0,0|2,0,0]=4 12790 B15R1.123 CC(=O)CCCSc1cccc(c1Cl)F 62a_100011215641_200010234923 [0,2,0,0,0,0|2,0,0]=4 12791 B15R1.123 CC(=O)CCCSc1cccc(c1Cl)F 62a_200010234923_100011215641 [0,2,0,0,0,0|2,0,0]=4 12792 B15R1.123 CC(=O)CCCSc1cccc(c1Cl)O 62a_100011215641_100000049636 [0,2,0,0,0,0|2,0,0]=4 12793 B15R1.123 CC(=O)CCCSc1cccc(c1F)Br 62a_100000702267_100011215641 [0,2,0,0,0,0|2,0,0]=4 12794 B15R1.123 CC(=O)CCCSc1cccc(c1F)Br 62a_100011215641_100000702267 [0,2,0,0,0,0|2,0,0]=4 12795 B15R1.123 CC(=O)CCCSc1cccc(c1F)C 62a_100000717567_100011215641 [0,2,0,0,0,0|2,0,0]=4 12796 B15R1.123 CC(=O)CCCSc1cccc(c1F)C 62a_100011215641_100000717567 [0,2,0,0,0,0|2,0,0]=4 12797 B15R1.123 CC(=O)CCCSc1cccc(c1F)Cl 62a_100011215641_100011217346 [0,2,0,0,0,0|2,0,0]=4 12798 B15R1.123 CC(=O)CCCSc1cccc(c1F)Cl 62a_100011217346_100011215641 [0,2,0,0,0,0|2,0,0]=4 12799 B15R1.123 CC(=O)CCCSc1cccc(c1F)F 62a_100000694657_100011215641 [0,2,0,0,0,0|2,0,0]=4 12800 B15R1.123 CC(=O)CCCSc1cccc(c1F)F 62a_100011215641_100000694657 [0,2,0,0,0,0|2,0,0]=4 12801 B15R1.123 CC(=O)CCCSc1cccc(c1F)N 62a_100011215641_100011935091 [0,2,0,0,0,0|2,0,0]=4 12802 B15R1.123 CC(=O)CCCSc1cccc(c1F)N 62a_100011935091_100011215641 [0,2,0,0,0,0|2,0,0]=4 12803 B15R1.123 CC(=O)CCCSc1cccc(c1F)O 62a_100009817021_100011215641 [0,2,0,0,0,0|2,0,0]=4 12804 B15R1.123 CC(=O)CCCSc1cccc(c1F)O 62a_100011215641_100009817021 [0,2,0,0,0,0|2,0,0]=4 12805 B15R1.123 CC(=O)CCCSc1cccc(c1N)Br 62a_100010146558_100011215641 [0,2,0,0,0,0|2,0,0]=4 12806 B15R1.123 CC(=O)CCCSc1cccc(c1N)Br 62a_100011215641_100010146558 [0,2,0,0,0,0|2,0,0]=4 12807 B15R1.123 CC(=O)CCCSc1cccc(c1N)C 62a_100011215641_100011834072 [0,2,0,0,0,0|2,0,0]=4 12808 B15R1.123 CC(=O)CCCSc1cccc(c1N)C 62a_100011834072_100011215641 [0,2,0,0,0,0|2,0,0]=4 12809 B15R1.123 CC(=O)CCCSc1cccc(c1N)Cl 62a_100010190421_100011215641 [0,2,0,0,0,0|2,0,0]=4 12810 B15R1.123 CC(=O)CCCSc1cccc(c1N)Cl 62a_100011215641_100010190421 [0,2,0,0,0,0|2,0,0]=4 12811 B15R1.123 CC(=O)CCCSc1cccc(c1N)F 62a_100000042321_100011215641 [0,2,0,0,0,0|2,0,0]=4 12812 B15R1.123 CC(=O)CCCSc1cccc(c1N)F 62a_100011215641_100000042321 [0,2,0,0,0,0|2,0,0]=4 12813 B15R1.123 CC(=O)CCCSc1cccc(c1N)N 62a_100015191791_100011215641 [0,2,0,0,0,0|2,0,0]=4 12814 B15R1.123 CC(=O)CCCSc1cccc(c1N)O 62a_100011215641_100011934926 [0,2,0,0,0,0|2,0,0]=4 12815 B15R1.123 CC(=O)CCCSc1cccc(c1O)Br 62a_100010084509_100011215641 [0,2,0,0,0,0|2,0,0]=4 12816 B15R1.123 CC(=O)CCCSc1cccc(c1O)Br 62a_100011215641_100010084509 [0,2,0,0,0,0|2,0,0]=4 12817 B15R1.123 CC(=O)CCCSc1cccc(c1O)C 62a_100009817157_100011215641 [0,2,0,0,0,0|2,0,0]=4 12818 B15R1.123 CC(=O)CCCSc1cccc(c1O)C 62a_100011215641_100009817157 [0,2,0,0,0,0|2,0,0]=4 12819 B15R1.123 CC(=O)CCCSc1cccc(c1O)Cl 62a_100010202889_100011215641 [0,2,0,0,0,0|2,0,0]=4 12820 B15R1.123 CC(=O)CCCSc1cccc(c1O)Cl 62a_100011215641_100010202889 [0,2,0,0,0,0|2,0,0]=4 12821 B15R1.123 CC(=O)CCCSc1cccc(c1O)F 62a_100009813666_100011215641 [0,2,0,0,0,0|2,0,0]=4 12822 B15R1.123 CC(=O)CCCSc1cccc(c1O)F 62a_100011215641_100009813666 [0,2,0,0,0,0|2,0,0]=4 12823 B15R1.123 CC(=O)CCCSc1cccc(c1O)N 62a_100011215641_100010084371 [0,2,0,0,0,0|2,0,0]=4 12824 B15R1.123 CC(=O)CCCSc1cccc(c1O)N 62a_100011934915_100011215641 [0,2,0,0,0,0|2,0,0]=4 12825 B15R1.123 CC(=O)CCCSc1cccc(c1O)O 62a_100011215641_100009815950 [0,2,0,0,0,0|2,0,0]=4 12826 B15R1.123 CC(=O)CCOCc1cccc(c1Br)C 34a_100000759926_200012349612 [0,2,0,0,0,0|2,0,0]=4 12827 B15R1.123 CC(=O)CCOCc1cccc(c1Br)C 7a_100000759926_200012349612 [0,2,0,0,0,0|2,0,0]=4 12828 B15R1.123 CC(=O)CCOCc1cccc(c1Br)C 7a_100011659289_100000053229 [0,2,0,0,0,0|2,0,0]=4 12829 B15R1.123 CC(=O)CCOCc1cccc(c1Br)Cl 34a_100000759926_100010145525 [0,2,0,0,0,0|2,0,0]=4 12830 B15R1.123 CC(=O)CCOCc1cccc(c1Br)Cl 7a_100000759926_100010145525 [0,2,0,0,0,0|2,0,0]=4 12831 B15R1.123 CC(=O)CCOCc1cccc(c1Br)Cl 7a_100010168166_100000053229 [0,2,0,0,0,0|2,0,0]=4 12832 B15R1.123 CC(=O)CCOCc1cccc(c1Br)F 34a_100000759926_100012351116 [0,2,0,0,0,0|2,0,0]=4 12833 B15R1.123 CC(=O)CCOCc1cccc(c1Br)F 7a_100000759926_100012351116 [0,2,0,0,0,0|2,0,0]=4 12834 B15R1.123 CC(=O)CCOCc1cccc(c1Br)F 7a_100012351117_100000053229 [0,2,0,0,0,0|2,0,0]=4 12835 B15R1.123 CC(=O)CCOCc1cccc(c1Br)I 34a_100000759926_100010254545 [0,2,0,0,0,0|2,0,0]=4 12836 B15R1.123 CC(=O)CCOCc1cccc(c1Br)I 7a_100000759926_100010254545 [0,2,0,0,0,0|2,0,0]=4 12837 B15R1.123 CC(=O)CCOCc1cccc(c1Br)I 7a_100010240205_100000053229 [0,2,0,0,0,0|2,0,0]=4 12838 B15R1.123 CC(=O)CCOCc1cccc(c1C)Br 34a_100000759926_100000694682 [0,2,0,0,0,0|2,0,0]=4 12839 B15R1.123 CC(=O)CCOCc1cccc(c1C)Br 7a_100000694458_100000053229 [0,2,0,0,0,0|2,0,0]=4 12840 B15R1.123 CC(=O)CCOCc1cccc(c1C)Br 7a_100000759926_100000694682 [0,2,0,0,0,0|2,0,0]=4 12841 B15R1.123 CC(=O)CCOCc1cccc(c1C)C 34a_100000759926_100011273979 [0,2,0,0,0,0|2,0,0]=4 12842 B15R1.123 CC(=O)CCOCc1cccc(c1C)C 7a_100000759926_100011515928 [0,2,0,0,0,0|2,0,0]=4 12843 B15R1.123 CC(=O)CCOCc1cccc(c1C)C 7a_100011219135_100000053229 [0,2,0,0,0,0|2,0,0]=4 12844 B15R1.123 CC(=O)CCOCc1cccc(c1C)Cl 34a_100000759926_100012186920 [0,2,0,0,0,0|2,0,0]=4 12845 B15R1.123 CC(=O)CCOCc1cccc(c1C)Cl 7a_100000759926_100012186920 [0,2,0,0,0,0|2,0,0]=4 12846 B15R1.123 CC(=O)CCOCc1cccc(c1C)Cl 7a_100012000165_100000053229 [0,2,0,0,0,0|2,0,0]=4 12847 B15R1.123 CC(=O)CCOCc1cccc(c1C)F 34a_100000759926_100009813626 [0,2,0,0,0,0|2,0,0]=4 12848 B15R1.123 CC(=O)CCOCc1cccc(c1C)F 7a_100000042775_100000053229 [0,2,0,0,0,0|2,0,0]=4 12849 B15R1.123 CC(=O)CCOCc1cccc(c1C)F 7a_100000759926_100009813626 [0,2,0,0,0,0|2,0,0]=4 12850 B15R1.123 CC(=O)CCOCc1cccc(c1C)I 34a_100000759926_100010150147 [0,2,0,0,0,0|2,0,0]=4 12851 B15R1.123 CC(=O)CCOCc1cccc(c1C)I 7a_100000759926_100010150147 [0,2,0,0,0,0|2,0,0]=4 12852 B15R1.123 CC(=O)CCOCc1cccc(c1C)I 7a_100010150139_100000053229 [0,2,0,0,0,0|2,0,0]=4 12853 B15R1.123 CC(=O)CCOCc1cccc(c1C)N 7a_102495339961_100000053229 [0,2,0,0,0,0|2,0,0]=4 12854 B15R1.123 CC(=O)CCOCc1cccc(c1Cl)Br 34a_100000759926_100012349491 [0,2,0,0,0,0|2,0,0]=4 12855 B15R1.123 CC(=O)CCOCc1cccc(c1Cl)Br 7a_100000759926_100012349491 [0,2,0,0,0,0|2,0,0]=4 12856 B15R1.123 CC(=O)CCOCc1cccc(c1Cl)Br 7a_100012351182_100000053229 [0,2,0,0,0,0|2,0,0]=4 12857 B15R1.123 CC(=O)CCOCc1cccc(c1Cl)C 7a_100000710031_100000053229 [0,2,0,0,0,0|2,0,0]=4 12858 B15R1.123 CC(=O)CCOCc1cccc(c1Cl)Cl 34a_100000759926_100000723366 [0,2,0,0,0,0|2,0,0]=4 12859 B15R1.123 CC(=O)CCOCc1cccc(c1Cl)Cl 7a_100000720469_100000053229 [0,2,0,0,0,0|2,0,0]=4 12860 B15R1.123 CC(=O)CCOCc1cccc(c1Cl)Cl 7a_100000759926_100000723366 [0,2,0,0,0,0|2,0,0]=4 12861 B15R1.123 CC(=O)CCOCc1cccc(c1Cl)F 34a_100000759926_100000696688 [0,2,0,0,0,0|2,0,0]=4 12862 B15R1.123 CC(=O)CCOCc1cccc(c1Cl)F 7a_100000696319_100000053229 [0,2,0,0,0,0|2,0,0]=4 12863 B15R1.123 CC(=O)CCOCc1cccc(c1Cl)F 7a_100000759926_100000696688 [0,2,0,0,0,0|2,0,0]=4 12864 B15R1.123 CC(=O)CCOCc1cccc(c1F)Br 34a_100000759926_100012356506 [0,2,0,0,0,0|2,0,0]=4 12865 B15R1.123 CC(=O)CCOCc1cccc(c1F)Br 7a_100000759926_100012356506 [0,2,0,0,0,0|2,0,0]=4 12866 B15R1.123 CC(=O)CCOCc1cccc(c1F)Br 7a_100011935076_100000053229 [0,2,0,0,0,0|2,0,0]=4 12867 B15R1.123 CC(=O)CCOCc1cccc(c1F)C 34a_100000759926_100011216058 [0,2,0,0,0,0|2,0,0]=4 12868 B15R1.123 CC(=O)CCOCc1cccc(c1F)C 7a_100000759926_100011216058 [0,2,0,0,0,0|2,0,0]=4 12869 B15R1.123 CC(=O)CCOCc1cccc(c1F)C 7a_200011219517_100000053229 [0,2,0,0,0,0|2,0,0]=4 12870 B15R1.123 CC(=O)CCOCc1cccc(c1F)Cl 34a_100000759926_100000716733 [0,2,0,0,0,0|2,0,0]=4 12871 B15R1.123 CC(=O)CCOCc1cccc(c1F)Cl 7a_100000759926_100000716733 [0,2,0,0,0,0|2,0,0]=4 12872 B15R1.123 CC(=O)CCOCc1cccc(c1F)Cl 7a_100011216988_100000053229 [0,2,0,0,0,0|2,0,0]=4 12873 B15R1.123 CC(=O)CCOCc1cccc(c1F)F 34a_100000759926_100000217499 [0,2,0,0,0,0|2,0,0]=4 12874 B15R1.123 CC(=O)CCOCc1cccc(c1F)F 7a_100000759926_100000217499 [0,2,0,0,0,0|2,0,0]=4 12875 B15R1.123 CC(=O)CCOCc1cccc(c1F)F 7a_100011218644_100000053229 [0,2,0,0,0,0|2,0,0]=4 12876 B15R1.123 CC(=O)CCOCc1cccc(c1F)I 7a_200010235739_100000053229 [0,2,0,0,0,0|2,0,0]=4 12877 B15R1.123 CC(=O)CCOCc1cccc(c1I)Br 7a_100010146604_100000053229 [0,2,0,0,0,0|2,0,0]=4 12878 B15R1.123 CC(=O)CCOCc1cccc(c1I)C 7a_100012349780_100000053229 [0,2,0,0,0,0|2,0,0]=4 12879 B15R1.123 CC(=O)CCOCc1cccc(c1I)F 34a_100000759926_100010149603 [0,2,0,0,0,0|2,0,0]=4 12880 B15R1.123 CC(=O)CCOCc1cccc(c1I)F 7a_100000692438_100000053229 [0,2,0,0,0,0|2,0,0]=4 12881 B15R1.123 CC(=O)CCOCc1cccc(c1I)F 7a_100000759926_100010149603 [0,2,0,0,0,0|2,0,0]=4 12882 B15R1.123 CC(=O)CCSCc1cccc(c1Br)C 62a_100000053229_200012349612 [0,2,0,0,0,0|2,0,0]=4 12883 B15R1.123 CC(=O)CCSCc1cccc(c1Br)C 62a_200012349612_100000053229 [0,2,0,0,0,0|2,0,0]=4 12884 B15R1.123 CC(=O)CCSCc1cccc(c1Br)Cl 62a_100000053229_100010145525 [0,2,0,0,0,0|2,0,0]=4 12885 B15R1.123 CC(=O)CCSCc1cccc(c1Br)Cl 62a_100010145525_100000053229 [0,2,0,0,0,0|2,0,0]=4 12886 B15R1.123 CC(=O)CCSCc1cccc(c1Br)F 62a_100000053229_100012351116 [0,2,0,0,0,0|2,0,0]=4 12887 B15R1.123 CC(=O)CCSCc1cccc(c1Br)F 62a_100012351116_100000053229 [0,2,0,0,0,0|2,0,0]=4 12888 B15R1.123 CC(=O)CCSCc1cccc(c1Br)I 62a_100000053229_100010254545 [0,2,0,0,0,0|2,0,0]=4 12889 B15R1.123 CC(=O)CCSCc1cccc(c1Br)I 62a_100010254545_100000053229 [0,2,0,0,0,0|2,0,0]=4 12890 B15R1.123 CC(=O)CCSCc1cccc(c1C)Br 62a_100000053229_100000694682 [0,2,0,0,0,0|2,0,0]=4 12891 B15R1.123 CC(=O)CCSCc1cccc(c1C)Br 62a_100000694682_100000053229 [0,2,0,0,0,0|2,0,0]=4 12892 B15R1.123 CC(=O)CCSCc1cccc(c1C)C 62a_100000053229_100011515928 [0,2,0,0,0,0|2,0,0]=4 12893 B15R1.123 CC(=O)CCSCc1cccc(c1C)C 62a_100011515928_100000053229 [0,2,0,0,0,0|2,0,0]=4 12894 B15R1.123 CC(=O)CCSCc1cccc(c1C)Cl 62a_100000053229_100012186920 [0,2,0,0,0,0|2,0,0]=4 12895 B15R1.123 CC(=O)CCSCc1cccc(c1C)Cl 62a_100012186920_100000053229 [0,2,0,0,0,0|2,0,0]=4 12896 B15R1.123 CC(=O)CCSCc1cccc(c1C)F 62a_100000053229_100009813626 [0,2,0,0,0,0|2,0,0]=4 12897 B15R1.123 CC(=O)CCSCc1cccc(c1C)F 62a_100009813626_100000053229 [0,2,0,0,0,0|2,0,0]=4 12898 B15R1.123 CC(=O)CCSCc1cccc(c1C)I 62a_100000053229_100010150147 [0,2,0,0,0,0|2,0,0]=4 12899 B15R1.123 CC(=O)CCSCc1cccc(c1C)I 62a_100010150147_100000053229 [0,2,0,0,0,0|2,0,0]=4 12900 B15R1.123 CC(=O)CCSCc1cccc(c1Cl)Br 62a_100000053229_100012349491 [0,2,0,0,0,0|2,0,0]=4 12901 B15R1.123 CC(=O)CCSCc1cccc(c1Cl)Br 62a_100012349491_100000053229 [0,2,0,0,0,0|2,0,0]=4 12902 B15R1.123 CC(=O)CCSCc1cccc(c1Cl)Cl 62a_100000053229_100000723366 [0,2,0,0,0,0|2,0,0]=4 12903 B15R1.123 CC(=O)CCSCc1cccc(c1Cl)Cl 62a_100000720918_100000053229 [0,2,0,0,0,0|2,0,0]=4 12904 B15R1.123 CC(=O)CCSCc1cccc(c1Cl)F 62a_100000053229_100000696688 [0,2,0,0,0,0|2,0,0]=4 12905 B15R1.123 CC(=O)CCSCc1cccc(c1Cl)F 62a_100000696688_100000053229 [0,2,0,0,0,0|2,0,0]=4 12906 B15R1.123 CC(=O)CCSCc1cccc(c1F)Br 62a_100000053229_100012356506 [0,2,0,0,0,0|2,0,0]=4 12907 B15R1.123 CC(=O)CCSCc1cccc(c1F)Br 62a_100012356506_100000053229 [0,2,0,0,0,0|2,0,0]=4 12908 B15R1.123 CC(=O)CCSCc1cccc(c1F)C 62a_100000053229_100011216058 [0,2,0,0,0,0|2,0,0]=4 12909 B15R1.123 CC(=O)CCSCc1cccc(c1F)C 62a_100011216058_100000053229 [0,2,0,0,0,0|2,0,0]=4 12910 B15R1.123 CC(=O)CCSCc1cccc(c1F)Cl 62a_100000053229_100000716733 [0,2,0,0,0,0|2,0,0]=4 12911 B15R1.123 CC(=O)CCSCc1cccc(c1F)Cl 62a_100000716733_100000053229 [0,2,0,0,0,0|2,0,0]=4 12912 B15R1.123 CC(=O)CCSCc1cccc(c1F)F 62a_100000053229_100000217499 [0,2,0,0,0,0|2,0,0]=4 12913 B15R1.123 CC(=O)CCSCc1cccc(c1F)F 62a_100000217499_100000053229 [0,2,0,0,0,0|2,0,0]=4 12914 B15R1.123 CC(=O)CCSCc1cccc(c1I)F 62a_100000053229_100010149603 [0,2,0,0,0,0|2,0,0]=4 12915 B15R1.123 CC(=O)CCSCc1cccc(c1I)F 62a_100010149603_100000053229 [0,2,0,0,0,0|2,0,0]=4 12916 B15R1.123 CC(=O)COCCc1cccc(c1Cl)Cl 34a_100000211253_100000723033 [0,2,0,0,0,0|2,0,0]=4 12917 B15R1.123 Cc1c(cccc1CCNCC(=O)N)Br 2230a_100161000114_100000747473 [0,2,0,0,0,0|2,0,0]=4 12918 B15R1.123 Cc1c(cccc1CCNCC(=O)N)Br 34a_100161000114_100000187820 [0,2,0,0,0,0|2,0,0]=4 12919 B15R1.123 Cc1c(cccc1CCNCC(=O)[O-])Br 34a_100161000114_100020667443 [0,2,0,0,0,0|1,0,1]=4 12920 B15R1.123 Cc1c(cccc1CNCCC(=O)N)Br 207a_100000740010_100012179384 [0,2,0,0,0,0|2,0,0]=4 12921 B15R1.123 Cc1c(cccc1CNCCC(=O)N)Br 34a_100000724210_100000731001 [0,2,0,0,0,0|2,0,0]=4 12922 B15R1.123 Cc1c(cccc1CNCCC(=O)N)Cl 207a_100000740010_100012002129 [0,2,0,0,0,0|2,0,0]=4 12923 B15R1.123 Cc1c(cccc1CNCCC(=O)N)Cl 2230a_100020639605_100000744528 [0,2,0,0,0,0|2,0,0]=4 12924 B15R1.123 Cc1c(cccc1CNCCC(=O)N)Cl 34a_100020639605_100000731001 [0,2,0,0,0,0|2,0,0]=4 12925 B15R1.123 Cc1c(cccc1CNCCC(=O)N)F 207a_100000740010_100000037668 [0,2,0,0,0,0|2,0,0]=4 12926 B15R1.123 Cc1c(cccc1CNCCC(=O)N)F 2230a_100132306986_100000744528 [0,2,0,0,0,0|2,0,0]=4 12927 B15R1.123 Cc1c(cccc1CNCCC(=O)N)F 34a_100132306986_100000731001 [0,2,0,0,0,0|2,0,0]=4 12928 B15R1.123 Cc1c(cccc1CNOCC(=O)O)Br 269956a_100000106656_100000694682 [0,2,0,0,0,0|2,0,0]=4 12929 B15R1.123 Cc1c(cccc1CNOCC(=O)O)Cl 269956a_100000106656_100012186920 [0,2,0,0,0,0|2,0,0]=4 12930 B15R1.123 Cc1c(cccc1CNOCC(=O)O)F 269956a_100000106656_100009813626 [0,2,0,0,0,0|2,0,0]=4 12931 B15R1.123 Cc1c(cccc1CNOCC(=O)O)I 269956a_100000106656_100010150147 [0,2,0,0,0,0|2,0,0]=4 12932 B15R1.123 Cc1c(cccc1COCCC(=O)N)Br 34a_100000694458_100000731001 [0,2,0,0,0,0|2,0,0]=4 12933 B15R1.123 Cc1c(cccc1COCCC(=O)N)Br 34a_100000757172_100000694682 [0,2,0,0,0,0|2,0,0]=4 12934 B15R1.123 Cc1c(cccc1COCCC(=O)N)Br 7a_100000694458_100000744528 [0,2,0,0,0,0|2,0,0]=4 12935 B15R1.123 Cc1c(cccc1COCCC(=O)N)Br 7a_100000757172_100000694682 [0,2,0,0,0,0|2,0,0]=4 12936 B15R1.123 Cc1c(cccc1COCCC(=O)N)Cl 34a_100000757172_100012186920 [0,2,0,0,0,0|2,0,0]=4 12937 B15R1.123 Cc1c(cccc1COCCC(=O)N)Cl 34a_100012000165_100000731001 [0,2,0,0,0,0|2,0,0]=4 12938 B15R1.123 Cc1c(cccc1COCCC(=O)N)Cl 7a_100000757172_100012186920 [0,2,0,0,0,0|2,0,0]=4 12939 B15R1.123 Cc1c(cccc1COCCC(=O)N)Cl 7a_100012000165_100000744528 [0,2,0,0,0,0|2,0,0]=4 12940 B15R1.123 Cc1c(cccc1COCCC(=O)N)F 34a_100000042775_100000731001 [0,2,0,0,0,0|2,0,0]=4 12941 B15R1.123 Cc1c(cccc1COCCC(=O)N)F 34a_100000757172_100009813626 [0,2,0,0,0,0|2,0,0]=4 12942 B15R1.123 Cc1c(cccc1COCCC(=O)N)F 7a_100000042775_100000744528 [0,2,0,0,0,0|2,0,0]=4 12943 B15R1.123 Cc1c(cccc1COCCC(=O)N)F 7a_100000757172_100009813626 [0,2,0,0,0,0|2,0,0]=4 12944 B15R1.123 Cc1c(cccc1COCCC(=O)N)I 34a_100000757172_100010150147 [0,2,0,0,0,0|2,0,0]=4 12945 B15R1.123 Cc1c(cccc1COCCC(=O)N)I 34a_100010150139_100000731001 [0,2,0,0,0,0|2,0,0]=4 12946 B15R1.123 Cc1c(cccc1COCCC(=O)N)I 7a_100000757172_100010150147 [0,2,0,0,0,0|2,0,0]=4 12947 B15R1.123 Cc1c(cccc1COCCC(=O)N)I 7a_100010150139_100000744528 [0,2,0,0,0,0|2,0,0]=4 12948 B15R1.123 Cc1c(cccc1COCCC(=O)N)N 34a_102495339961_100000731001 [0,2,0,0,0,0|2,0,0]=4 12949 B15R1.123 Cc1c(cccc1COCCC(=O)N)N 7a_102495339961_100000744528 [0,2,0,0,0,0|2,0,0]=4 12950 B15R1.123 Cc1c(cccc1CSCCC(=O)N)Br 62a_100000694682_100000744528 [0,2,0,0,0,0|2,0,0]=4 12951 B15R1.123 Cc1c(cccc1CSCCC(=O)N)Br 62a_100000744528_100000694682 [0,2,0,0,0,0|2,0,0]=4 12952 B15R1.123 Cc1c(cccc1CSCCC(=O)N)Cl 62a_100000744528_100012186920 [0,2,0,0,0,0|2,0,0]=4 12953 B15R1.123 Cc1c(cccc1CSCCC(=O)N)Cl 62a_100012186920_100000744528 [0,2,0,0,0,0|2,0,0]=4 12954 B15R1.123 Cc1c(cccc1CSCCC(=O)N)F 62a_100000744528_100009813626 [0,2,0,0,0,0|2,0,0]=4 12955 B15R1.123 Cc1c(cccc1CSCCC(=O)N)F 62a_100009813626_100000744528 [0,2,0,0,0,0|2,0,0]=4 12956 B15R1.123 Cc1c(cccc1CSCCC(=O)N)I 62a_100000744528_100010150147 [0,2,0,0,0,0|2,0,0]=4 12957 B15R1.123 Cc1c(cccc1CSCCC(=O)N)I 62a_100010150147_100000744528 [0,2,0,0,0,0|2,0,0]=4 12958 B15R1.123 Cc1c(cccc1NCCCC(=O)N)Br 34a_100000750434_100102525003 [0,2,0,0,0,0|2,0,0]=4 12959 B15R1.123 Cc1c(cccc1NCCCC(=O)N)Cl 34a_100000210441_100102525003 [0,2,0,0,0,0|2,0,0]=4 12960 B15R1.123 Cc1c(cccc1NCCCC(=O)N)Cl 7a_100000210441_100102525003 [0,2,0,0,0,0|2,0,0]=4 12961 B15R1.123 Cc1c(cccc1NCCCC(=O)N)F 34a_100000745574_100102525003 [0,2,0,0,0,0|2,0,0]=4 12962 B15R1.123 Cc1c(cccc1NCCCC(=O)N)F 7a_100000745574_100102525003 [0,2,0,0,0,0|2,0,0]=4 12963 B15R1.123 Cc1c(cccc1NCCCC(=O)N)I 34a_100000761887_100102525003 [0,2,0,0,0,0|2,0,0]=4 12964 B15R1.123 Cc1c(cccc1NCCCC(=O)N)O 34a_100011216573_100102525003 [0,2,0,0,0,0|2,0,0]=4 12965 B15R1.123 Cc1c(cccc1NCCCC(=O)N)O 7a_100011216573_100102525003 [0,2,0,0,0,0|2,0,0]=4 12966 B15R1.123 Cc1c(cccc1OCCCC(=O)N)Br 34a_100012002258_100102525003 [0,2,0,0,0,0|2,0,0]=4 12967 B15R1.123 Cc1c(cccc1OCCCC(=O)N)Br 7a_100012002258_100102525003 [0,2,0,0,0,0|2,0,0]=4 12968 B15R1.123 Cc1c(cccc1OCCCC(=O)N)Cl 34a_100011265684_100102525003 [0,2,0,0,0,0|2,0,0]=4 12969 B15R1.123 Cc1c(cccc1OCCCC(=O)N)Cl 7a_100011265684_100102525003 [0,2,0,0,0,0|2,0,0]=4 12970 B15R1.123 Cc1c(cccc1OCCCC(=O)N)F 34a_100011217231_100102525003 [0,2,0,0,0,0|2,0,0]=4 12971 B15R1.123 Cc1c(cccc1OCCCC(=O)N)F 7a_100011217231_100102525003 [0,2,0,0,0,0|2,0,0]=4 12972 B15R1.123 Cc1c(cccc1OCCCC(=O)N)N 34a_100011216573_100102525003 [0,2,0,0,0,0|2,0,0]=4 12973 B15R1.123 Cc1c(cccc1OCCCC(=O)N)N 7a_100011216573_100102525003 [0,2,0,0,0,0|2,0,0]=4 12974 B15R1.123 Cc1c(cccc1SCCCC(=O)N)Br 62a_100012353703_100102525003 [0,2,0,0,0,0|2,0,0]=4 12975 B15R1.123 Cc1c(cccc1SCCCC(=O)N)Br 62a_100102525003_100012353703 [0,2,0,0,0,0|2,0,0]=4 12976 B15R1.123 Cc1c(cccc1SCCCC(=O)N)Cl 62a_100000726075_100102525003 [0,2,0,0,0,0|2,0,0]=4 12977 B15R1.123 Cc1c(cccc1SCCCC(=O)N)Cl 62a_100102525003_100000726075 [0,2,0,0,0,0|2,0,0]=4 12978 B15R1.123 Cc1c(cccc1SCCCC(=O)N)F 62a_100011216893_100102525003 [0,2,0,0,0,0|2,0,0]=4 12979 B15R1.123 Cc1c(cccc1SCCCC(=O)N)F 62a_100102525003_100011216893 [0,2,0,0,0,0|2,0,0]=4 12980 B15R1.123 Cc1c(cccc1SCCCC(=O)N)N 62a_100000761887_100102525003 [0,2,0,0,0,0|2,0,0]=4 12981 B15R1.123 Cc1c(cccc1SCCCC(=O)N)N 62a_100102525003_100000761887 [0,2,0,0,0,0|2,0,0]=4 12982 B15R1.123 Cc1c(cccc1SCCCC(=O)N)O 62a_100012002258_100102525003 [0,2,0,0,0,0|2,0,0]=4 12983 B15R1.123 Cc1c(cccc1SCCCC(=O)N)O 62a_100102525003_100012002258 [0,2,0,0,0,0|2,0,0]=4 12984 B15R1.123 Cc1cccc(c1Br)CNCCC(=O)N 207a_100000740010_100012186367 [0,2,0,0,0,0|2,0,0]=4 12985 B15R1.123 Cc1cccc(c1Br)CNOCC(=O)O 269956a_100000106656_200012349612 [0,2,0,0,0,0|2,0,0]=4 12986 B15R1.123 Cc1cccc(c1Br)COCCC(=O)N 34a_100000757172_200012349612 [0,2,0,0,0,0|2,0,0]=4 12987 B15R1.123 Cc1cccc(c1Br)COCCC(=O)N 34a_100011659289_100000731001 [0,2,0,0,0,0|2,0,0]=4 12988 B15R1.123 Cc1cccc(c1Br)COCCC(=O)N 7a_100000757172_200012349612 [0,2,0,0,0,0|2,0,0]=4 12989 B15R1.123 Cc1cccc(c1Br)COCCC(=O)N 7a_100011659289_100000744528 [0,2,0,0,0,0|2,0,0]=4 12990 B15R1.123 Cc1cccc(c1Br)CSCCC(=O)N 62a_100000744528_200012349612 [0,2,0,0,0,0|2,0,0]=4 12991 B15R1.123 Cc1cccc(c1Br)CSCCC(=O)N 62a_200012349612_100000744528 [0,2,0,0,0,0|2,0,0]=4 12992 B15R1.123 Cc1cccc(c1Br)NCCCC(=O)N 34a_100000684715_100102525003 [0,2,0,0,0,0|2,0,0]=4 12993 B15R1.123 Cc1cccc(c1Br)OCCCC(=O)N 34a_100000686692_100102525003 [0,2,0,0,0,0|2,0,0]=4 12994 B15R1.123 Cc1cccc(c1Br)OCCCC(=O)N 7a_100000686692_100102525003 [0,2,0,0,0,0|2,0,0]=4 12995 B15R1.123 Cc1cccc(c1Br)SCCCC(=O)N 62a_100012362457_100102525003 [0,2,0,0,0,0|2,0,0]=4 12996 B15R1.123 Cc1cccc(c1Br)SCCCC(=O)N 62a_100102525003_100012362457 [0,2,0,0,0,0|2,0,0]=4 12997 B15R1.123 Cc1cccc(c1C)CNCCC(=O)N 207a_100000740010_100000229941 [0,2,0,0,0,0|2,0,0]=4 12998 B15R1.123 Cc1cccc(c1C)CNCCC(=O)N 2230a_100011211637_100000744528 [0,2,0,0,0,0|2,0,0]=4 12999 B15R1.123 Cc1cccc(c1C)CNCCC(=O)N 34a_100011211637_100000731001 [0,2,0,0,0,0|2,0,0]=4 13000 B15R1.123 Cc1cccc(c1C)CNOCC(=O)O 269956a_100000106656_100011515928 [0,2,0,0,0,0|2,0,0]=4 13001 B15R1.123 Cc1cccc(c1C)COCCC(=O)N 34a_100000757172_100011273979 [0,2,0,0,0,0|2,0,0]=4 13002 B15R1.123 Cc1cccc(c1C)COCCC(=O)N 34a_100011219135_100000731001 [0,2,0,0,0,0|2,0,0]=4 13003 B15R1.123 Cc1cccc(c1C)COCCC(=O)N 7a_100000757172_100011515928 [0,2,0,0,0,0|2,0,0]=4 13004 B15R1.123 Cc1cccc(c1C)COCCC(=O)N 7a_100011219135_100000744528 [0,2,0,0,0,0|2,0,0]=4 13005 B15R1.123 Cc1cccc(c1C)CSCCC(=O)N 62a_100000744528_100011515928 [0,2,0,0,0,0|2,0,0]=4 13006 B15R1.123 Cc1cccc(c1C)CSCCC(=O)N 62a_100011515928_100000744528 [0,2,0,0,0,0|2,0,0]=4 13007 B15R1.123 Cc1cccc(c1C)NCCCC(=O)N 34a_100000210026_100102525003 [0,2,0,0,0,0|2,0,0]=4 13008 B15R1.123 Cc1cccc(c1C)NCCCC(=O)N 7a_100000210026_100102525003 [0,2,0,0,0,0|2,0,0]=4 13009 B15R1.123 Cc1cccc(c1C)OCCCC(=O)N 34a_100000185855_100102525003 [0,2,0,0,0,0|2,0,0]=4 13010 B15R1.123 Cc1cccc(c1C)OCCCC(=O)N 7a_100000185855_100102525003 [0,2,0,0,0,0|2,0,0]=4 13011 B15R1.123 Cc1cccc(c1C)SCCCC(=O)N 62a_100011214922_100102525003 [0,2,0,0,0,0|2,0,0]=4 13012 B15R1.123 Cc1cccc(c1C)SCCCC(=O)N 62a_100102525003_100011214922 [0,2,0,0,0,0|2,0,0]=4 13013 B15R1.123 Cc1cccc(c1Cl)CNCCC(=O)N 207a_100000740010_100012017286 [0,2,0,0,0,0|2,0,0]=4 13014 B15R1.123 Cc1cccc(c1Cl)CNCCC(=O)N 2230a_100025705714_100000744528 [0,2,0,0,0,0|2,0,0]=4 13015 B15R1.123 Cc1cccc(c1Cl)CNCCC(=O)N 34a_100025705714_100000731001 [0,2,0,0,0,0|2,0,0]=4 13016 B15R1.123 Cc1cccc(c1Cl)COCCC(=O)N 34a_100000710031_100000731001 [0,2,0,0,0,0|2,0,0]=4 13017 B15R1.123 Cc1cccc(c1Cl)COCCC(=O)N 7a_100000710031_100000744528 [0,2,0,0,0,0|2,0,0]=4 13018 B15R1.123 Cc1cccc(c1Cl)NCCCC(=O)N 34a_100000765562_100102525003 [0,2,0,0,0,0|2,0,0]=4 13019 B15R1.123 Cc1cccc(c1Cl)NCCCC(=O)N 7a_100000765562_100102525003 [0,2,0,0,0,0|2,0,0]=4 13020 B15R1.123 Cc1cccc(c1Cl)OCCCC(=O)N 34a_100000695629_100102525003 [0,2,0,0,0,0|2,0,0]=4 13021 B15R1.123 Cc1cccc(c1Cl)OCCCC(=O)N 7a_100000695629_100102525003 [0,2,0,0,0,0|2,0,0]=4 13022 B15R1.123 Cc1cccc(c1Cl)SCCCC(=O)N 62a_100102525003_200012352035 [0,2,0,0,0,0|2,0,0]=4 13023 B15R1.123 Cc1cccc(c1Cl)SCCCC(=O)N 62a_200012352035_100102525003 [0,2,0,0,0,0|2,0,0]=4 13024 B15R1.123 Cc1cccc(c1F)CNCCC(=O)N 207a_100000740010_100011219516 [0,2,0,0,0,0|2,0,0]=4 13025 B15R1.123 Cc1cccc(c1F)CNCCC(=O)N 2230a_100012002060_100000744528 [0,2,0,0,0,0|2,0,0]=4 13026 B15R1.123 Cc1cccc(c1F)CNCCC(=O)N 34a_100012002060_100000731001 [0,2,0,0,0,0|2,0,0]=4 13027 B15R1.123 Cc1cccc(c1F)CNOCC(=O)O 269956a_100000106656_100011216058 [0,2,0,0,0,0|2,0,0]=4 13028 B15R1.123 Cc1cccc(c1F)COCCC(=O)N 34a_100000757172_100011216058 [0,2,0,0,0,0|2,0,0]=4 13029 B15R1.123 Cc1cccc(c1F)COCCC(=O)N 34a_200011219517_100000731001 [0,2,0,0,0,0|2,0,0]=4 13030 B15R1.123 Cc1cccc(c1F)COCCC(=O)N 7a_100000757172_100011216058 [0,2,0,0,0,0|2,0,0]=4 13031 B15R1.123 Cc1cccc(c1F)COCCC(=O)N 7a_200011219517_100000744528 [0,2,0,0,0,0|2,0,0]=4 13032 B15R1.123 Cc1cccc(c1F)CSCCC(=O)N 62a_100000744528_100011216058 [0,2,0,0,0,0|2,0,0]=4 13033 B15R1.123 Cc1cccc(c1F)CSCCC(=O)N 62a_100011216058_100000744528 [0,2,0,0,0,0|2,0,0]=4 13034 B15R1.123 Cc1cccc(c1F)NCCCC(=O)N 34a_100000697159_100102525003 [0,2,0,0,0,0|2,0,0]=4 13035 B15R1.123 Cc1cccc(c1F)NCCCC(=O)N 7a_100000697159_100102525003 [0,2,0,0,0,0|2,0,0]=4 13036 B15R1.123 Cc1cccc(c1F)OCCCC(=O)N 34a_100000751311_100102525003 [0,2,0,0,0,0|2,0,0]=4 13037 B15R1.123 Cc1cccc(c1F)OCCCC(=O)N 7a_100000751311_100102525003 [0,2,0,0,0,0|2,0,0]=4 13038 B15R1.123 Cc1cccc(c1F)SCCCC(=O)N 62a_100000717567_100102525003 [0,2,0,0,0,0|2,0,0]=4 13039 B15R1.123 Cc1cccc(c1F)SCCCC(=O)N 62a_100102525003_100000717567 [0,2,0,0,0,0|2,0,0]=4 13040 B15R1.123 Cc1cccc(c1I)COCCC(=O)N 34a_100012349780_100000731001 [0,2,0,0,0,0|2,0,0]=4 13041 B15R1.123 Cc1cccc(c1I)COCCC(=O)N 7a_100012349780_100000744528 [0,2,0,0,0,0|2,0,0]=4 13042 B15R1.123 Cc1cccc(c1I)NCCCC(=O)N 34a_100000761888_100102525003 [0,2,0,0,0,0|2,0,0]=4 13043 B15R1.123 Cc1cccc(c1I)OCCCC(=O)N 34a_100010083724_100102525003 [0,2,0,0,0,0|2,0,0]=4 13044 B15R1.123 Cc1cccc(c1I)OCCCC(=O)N 7a_100010083724_100102525003 [0,2,0,0,0,0|2,0,0]=4 13045 B15R1.123 Cc1cccc(c1N)COCCC(=O)N 34a_100011215590_100000731001 [0,2,0,0,0,0|2,0,0]=4 13046 B15R1.123 Cc1cccc(c1N)OCCCC(=O)N 34a_100000743429_100102525003 [0,2,0,0,0,0|2,0,0]=4 13047 B15R1.123 Cc1cccc(c1N)OCCCC(=O)N 7a_100000743429_100102525003 [0,2,0,0,0,0|2,0,0]=4 13048 B15R1.123 Cc1cccc(c1N)SCCCC(=O)N 62a_100011834072_100102525003 [0,2,0,0,0,0|2,0,0]=4 13049 B15R1.123 Cc1cccc(c1N)SCCCC(=O)N 62a_100102525003_100011834072 [0,2,0,0,0,0|2,0,0]=4 13050 B15R1.123 Cc1cccc(c1O)CNCCC(=O)N 34a_100020639391_100000731001 [0,2,0,0,0,0|2,0,0]=4 13051 B15R1.123 Cc1cccc(c1O)NCCCC(=O)N 34a_100000756359_100102525003 [0,2,0,0,0,0|2,0,0]=4 13052 B15R1.123 Cc1cccc(c1O)SCCCC(=O)N 62a_100009817157_100102525003 [0,2,0,0,0,0|2,0,0]=4 13053 B15R1.123 Cc1cccc(c1O)SCCCC(=O)N 62a_100102525003_100009817157 [0,2,0,0,0,0|2,0,0]=4 13054 B15R1.123 NC(=O)CCCNc1cccc(c1Br)Cl 34a_100000687072_100102525003 [0,2,0,0,0,0|2,0,0]=4 13055 B15R1.123 NC(=O)CCCNc1cccc(c1Br)F 34a_100011934729_100102525003 [0,2,0,0,0,0|2,0,0]=4 13056 B15R1.123 NC(=O)CCCNc1cccc(c1Br)O 34a_100012183704_100102525003 [0,2,0,0,0,0|2,0,0]=4 13057 B15R1.123 NC(=O)CCCNc1cccc(c1Br)O 7a_100012183704_100102525003 [0,2,0,0,0,0|2,0,0]=4 13058 B15R1.123 NC(=O)CCCNc1cccc(c1Cl)Br 34a_100000687075_100102525003 [0,2,0,0,0,0|2,0,0]=4 13059 B15R1.123 NC(=O)CCCNc1cccc(c1Cl)Cl 34a_100000185733_100102525003 [0,2,0,0,0,0|2,0,0]=4 13060 B15R1.123 NC(=O)CCCNc1cccc(c1Cl)F 34a_100000692321_100102525003 [0,2,0,0,0,0|2,0,0]=4 13061 B15R1.123 NC(=O)CCCNc1cccc(c1Cl)O 34a_100012002038_100102525003 [0,2,0,0,0,0|2,0,0]=4 13062 B15R1.123 NC(=O)CCCNc1cccc(c1Cl)O 7a_100012002038_100102525003 [0,2,0,0,0,0|2,0,0]=4 13063 B15R1.123 NC(=O)CCCNc1cccc(c1F)Br 34a_100011935091_100102525003 [0,2,0,0,0,0|2,0,0]=4 13064 B15R1.123 NC(=O)CCCNc1cccc(c1F)Cl 34a_100000199060_100102525003 [0,2,0,0,0,0|2,0,0]=4 13065 B15R1.123 NC(=O)CCCNc1cccc(c1F)F 34a_100000743855_100102525003 [0,2,0,0,0,0|2,0,0]=4 13066 B15R1.123 NC(=O)CCCNc1cccc(c1I)Br 34a_100020590159_100102525003 [0,2,0,0,0,0|2,0,0]=4 13067 B15R1.123 NC(=O)CCCNc1cccc(c1I)Cl 34a_100000049713_100102525003 [0,2,0,0,0,0|2,0,0]=4 13068 B15R1.123 NC(=O)CCCNc1cccc(c1I)F 34a_100000690935_100102525003 [0,2,0,0,0,0|2,0,0]=4 13069 B15R1.123 NC(=O)CCCNc1cccc(c1O)Br 34a_100011934915_100102525003 [0,2,0,0,0,0|2,0,0]=4 13070 B15R1.123 NC(=O)CCCNc1cccc(c1O)Cl 34a_100000754742_100102525003 [0,2,0,0,0,0|2,0,0]=4 13071 B15R1.123 NC(=O)CCCNc1cccc(c1O)F 34a_100011934987_100102525003 [0,2,0,0,0,0|2,0,0]=4 13072 B15R1.123 NC(=O)CCCOc1cccc(c1Br)Br 34a_100010187966_100102525003 [0,2,0,0,0,0|2,0,0]=4 13073 B15R1.123 NC(=O)CCCOc1cccc(c1Br)Br 7a_100010187966_100102525003 [0,2,0,0,0,0|2,0,0]=4 13074 B15R1.123 NC(=O)CCCOc1cccc(c1Br)Cl 34a_100012348804_100102525003 [0,2,0,0,0,0|2,0,0]=4 13075 B15R1.123 NC(=O)CCCOc1cccc(c1Br)Cl 7a_100012348804_100102525003 [0,2,0,0,0,0|2,0,0]=4 13076 B15R1.123 NC(=O)CCCOc1cccc(c1Br)F 34a_100009820682_100102525003 [0,2,0,0,0,0|2,0,0]=4 13077 B15R1.123 NC(=O)CCCOc1cccc(c1Br)F 7a_100009820682_100102525003 [0,2,0,0,0,0|2,0,0]=4 13078 B15R1.123 NC(=O)CCCOc1cccc(c1Br)I 34a_100010187914_100102525003 [0,2,0,0,0,0|2,0,0]=4 13079 B15R1.123 NC(=O)CCCOc1cccc(c1Br)I 7a_100010187914_100102525003 [0,2,0,0,0,0|2,0,0]=4 13080 B15R1.123 NC(=O)CCCOc1cccc(c1Br)N 34a_100012183704_100102525003 [0,2,0,0,0,0|2,0,0]=4 13081 B15R1.123 NC(=O)CCCOc1cccc(c1Br)N 7a_100012183704_100102525003 [0,2,0,0,0,0|2,0,0]=4 13082 B15R1.123 NC(=O)CCCOc1cccc(c1Cl)Br 34a_100010187913_100102525003 [0,2,0,0,0,0|2,0,0]=4 13083 B15R1.123 NC(=O)CCCOc1cccc(c1Cl)Br 7a_100010187913_100102525003 [0,2,0,0,0,0|2,0,0]=4 13084 B15R1.123 NC(=O)CCCOc1cccc(c1Cl)Cl 34a_100000211076_100102525003 [0,2,0,0,0,0|2,0,0]=4 13085 B15R1.123 NC(=O)CCCOc1cccc(c1Cl)Cl 7a_100000211076_100102525003 [0,2,0,0,0,0|2,0,0]=4 13086 B15R1.123 NC(=O)CCCOc1cccc(c1Cl)F 34a_100000087408_100102525003 [0,2,0,0,0,0|2,0,0]=4 13087 B15R1.123 NC(=O)CCCOc1cccc(c1Cl)F 7a_100000087408_100102525003 [0,2,0,0,0,0|2,0,0]=4 13088 B15R1.123 NC(=O)CCCOc1cccc(c1Cl)I 34a_100000049636_100102525003 [0,2,0,0,0,0|2,0,0]=4 13089 B15R1.123 NC(=O)CCCOc1cccc(c1Cl)I 7a_100000049636_100102525003 [0,2,0,0,0,0|2,0,0]=4 13090 B15R1.123 NC(=O)CCCOc1cccc(c1Cl)N 34a_100012002038_100102525003 [0,2,0,0,0,0|2,0,0]=4 13091 B15R1.123 NC(=O)CCCOc1cccc(c1Cl)N 7a_100012002038_100102525003 [0,2,0,0,0,0|2,0,0]=4 13092 B15R1.123 NC(=O)CCCOc1cccc(c1F)Br 34a_100009817021_100102525003 [0,2,0,0,0,0|2,0,0]=4 13093 B15R1.123 NC(=O)CCCOc1cccc(c1F)Br 7a_100009817021_100102525003 [0,2,0,0,0,0|2,0,0]=4 13094 B15R1.123 NC(=O)CCCOc1cccc(c1F)Cl 34a_100000687438_100102525003 [0,2,0,0,0,0|2,0,0]=4 13095 B15R1.123 NC(=O)CCCOc1cccc(c1F)Cl 7a_100000687438_100102525003 [0,2,0,0,0,0|2,0,0]=4 13096 B15R1.123 NC(=O)CCCOc1cccc(c1F)F 34a_100000751161_100102525003 [0,2,0,0,0,0|2,0,0]=4 13097 B15R1.123 NC(=O)CCCOc1cccc(c1F)F 7a_100000751161_100102525003 [0,2,0,0,0,0|2,0,0]=4 13098 B15R1.123 NC(=O)CCCOc1cccc(c1I)Br 34a_100010187912_100102525003 [0,2,0,0,0,0|2,0,0]=4 13099 B15R1.123 NC(=O)CCCOc1cccc(c1I)Br 7a_100010187912_100102525003 [0,2,0,0,0,0|2,0,0]=4 13100 B15R1.123 NC(=O)CCCOc1cccc(c1I)Cl 34a_100000050174_100102525003 [0,2,0,0,0,0|2,0,0]=4 13101 B15R1.123 NC(=O)CCCOc1cccc(c1I)Cl 7a_100000050174_100102525003 [0,2,0,0,0,0|2,0,0]=4 13102 B15R1.123 NC(=O)CCCOc1cccc(c1I)F 34a_100000690913_100102525003 [0,2,0,0,0,0|2,0,0]=4 13103 B15R1.123 NC(=O)CCCOc1cccc(c1I)F 7a_100000690913_100102525003 [0,2,0,0,0,0|2,0,0]=4 13104 B15R1.123 NC(=O)CCCOc1cccc(c1N)Br 34a_100011934926_100102525003 [0,2,0,0,0,0|2,0,0]=4 13105 B15R1.123 NC(=O)CCCOc1cccc(c1N)Br 7a_100011934926_100102525003 [0,2,0,0,0,0|2,0,0]=4 13106 B15R1.123 NC(=O)CCCOc1cccc(c1N)Cl 34a_100012022510_100102525003 [0,2,0,0,0,0|2,0,0]=4 13107 B15R1.123 NC(=O)CCCOc1cccc(c1N)Cl 7a_100012022510_100102525003 [0,2,0,0,0,0|2,0,0]=4 13108 B15R1.123 NC(=O)CCCOc1cccc(c1N)F 34a_100020591140_100102525003 [0,2,0,0,0,0|2,0,0]=4 13109 B15R1.123 NC(=O)CCCOc1cccc(c1N)F 7a_100020591140_100102525003 [0,2,0,0,0,0|2,0,0]=4 13110 B15R1.123 NC(=O)CCCOc1cccc(c1N)I 34a_200000049512_100102525003 [0,2,0,0,0,0|2,0,0]=4 13111 B15R1.123 NC(=O)CCCOc1cccc(c1N)I 7a_200000049512_100102525003 [0,2,0,0,0,0|2,0,0]=4 13112 B15R1.123 NC(=O)CCCOc1cccc(c1N)N 34a_100000033209_100102525003 [0,2,0,0,0,0|2,0,0]=4 13113 B15R1.123 NC(=O)CCCSc1cccc(c1Br)Br 62a_100010175083_100102525003 [0,2,0,0,0,0|2,0,0]=4 13114 B15R1.123 NC(=O)CCCSc1cccc(c1Br)Br 62a_100102525003_100010175083 [0,2,0,0,0,0|2,0,0]=4 13115 B15R1.123 NC(=O)CCCSc1cccc(c1Br)Cl 62a_100014021842_100102525003 [0,2,0,0,0,0|2,0,0]=4 13116 B15R1.123 NC(=O)CCCSc1cccc(c1Br)Cl 62a_100102525003_100014021842 [0,2,0,0,0,0|2,0,0]=4 13117 B15R1.123 NC(=O)CCCSc1cccc(c1Br)F 62a_100010202630_100102525003 [0,2,0,0,0,0|2,0,0]=4 13118 B15R1.123 NC(=O)CCCSc1cccc(c1Br)F 62a_100102525003_100010202630 [0,2,0,0,0,0|2,0,0]=4 13119 B15R1.123 NC(=O)CCCSc1cccc(c1Br)O 62a_100010187914_100102525003 [0,2,0,0,0,0|2,0,0]=4 13120 B15R1.123 NC(=O)CCCSc1cccc(c1Br)O 62a_100102525003_100010187914 [0,2,0,0,0,0|2,0,0]=4 13121 B15R1.123 NC(=O)CCCSc1cccc(c1Cl)Br 62a_100010142854_100102525003 [0,2,0,0,0,0|2,0,0]=4 13122 B15R1.123 NC(=O)CCCSc1cccc(c1Cl)Br 62a_100102525003_100010142854 [0,2,0,0,0,0|2,0,0]=4 13123 B15R1.123 NC(=O)CCCSc1cccc(c1Cl)Cl 62a_100011215384_100102525003 [0,2,0,0,0,0|2,0,0]=4 13124 B15R1.123 NC(=O)CCCSc1cccc(c1Cl)Cl 62a_100102525003_100011215384 [0,2,0,0,0,0|2,0,0]=4 13125 B15R1.123 NC(=O)CCCSc1cccc(c1Cl)F 62a_100102525003_200010234923 [0,2,0,0,0,0|2,0,0]=4 13126 B15R1.123 NC(=O)CCCSc1cccc(c1Cl)F 62a_200010234923_100102525003 [0,2,0,0,0,0|2,0,0]=4 13127 B15R1.123 NC(=O)CCCSc1cccc(c1Cl)O 62a_100102525003_100000049636 [0,2,0,0,0,0|2,0,0]=4 13128 B15R1.123 NC(=O)CCCSc1cccc(c1F)Br 62a_100000702267_100102525003 [0,2,0,0,0,0|2,0,0]=4 13129 B15R1.123 NC(=O)CCCSc1cccc(c1F)Br 62a_100102525003_100000702267 [0,2,0,0,0,0|2,0,0]=4 13130 B15R1.123 NC(=O)CCCSc1cccc(c1F)Cl 62a_100011217346_100102525003 [0,2,0,0,0,0|2,0,0]=4 13131 B15R1.123 NC(=O)CCCSc1cccc(c1F)Cl 62a_100102525003_100011217346 [0,2,0,0,0,0|2,0,0]=4 13132 B15R1.123 NC(=O)CCCSc1cccc(c1F)F 62a_100000694657_100102525003 [0,2,0,0,0,0|2,0,0]=4 13133 B15R1.123 NC(=O)CCCSc1cccc(c1F)F 62a_100102525003_100000694657 [0,2,0,0,0,0|2,0,0]=4 13134 B15R1.123 NC(=O)CCCSc1cccc(c1F)N 62a_100011935091_100102525003 [0,2,0,0,0,0|2,0,0]=4 13135 B15R1.123 NC(=O)CCCSc1cccc(c1F)N 62a_100102525003_100011935091 [0,2,0,0,0,0|2,0,0]=4 13136 B15R1.123 NC(=O)CCCSc1cccc(c1F)O 62a_100009817021_100102525003 [0,2,0,0,0,0|2,0,0]=4 13137 B15R1.123 NC(=O)CCCSc1cccc(c1F)O 62a_100102525003_100009817021 [0,2,0,0,0,0|2,0,0]=4 13138 B15R1.123 NC(=O)CCCSc1cccc(c1N)Br 62a_100010146558_100102525003 [0,2,0,0,0,0|2,0,0]=4 13139 B15R1.123 NC(=O)CCCSc1cccc(c1N)Br 62a_100102525003_100010146558 [0,2,0,0,0,0|2,0,0]=4 13140 B15R1.123 NC(=O)CCCSc1cccc(c1N)Cl 62a_100010190421_100102525003 [0,2,0,0,0,0|2,0,0]=4 13141 B15R1.123 NC(=O)CCCSc1cccc(c1N)Cl 62a_100102525003_100010190421 [0,2,0,0,0,0|2,0,0]=4 13142 B15R1.123 NC(=O)CCCSc1cccc(c1N)F 62a_100000042321_100102525003 [0,2,0,0,0,0|2,0,0]=4 13143 B15R1.123 NC(=O)CCCSc1cccc(c1N)F 62a_100102525003_100000042321 [0,2,0,0,0,0|2,0,0]=4 13144 B15R1.123 NC(=O)CCCSc1cccc(c1N)N 62a_100015191791_100102525003 [0,2,0,0,0,0|2,0,0]=4 13145 B15R1.123 NC(=O)CCCSc1cccc(c1N)O 62a_100102525003_100011934926 [0,2,0,0,0,0|2,0,0]=4 13146 B15R1.123 NC(=O)CCCSc1cccc(c1O)Br 62a_100010084509_100102525003 [0,2,0,0,0,0|2,0,0]=4 13147 B15R1.123 NC(=O)CCCSc1cccc(c1O)Br 62a_100102525003_100010084509 [0,2,0,0,0,0|2,0,0]=4 13148 B15R1.123 NC(=O)CCCSc1cccc(c1O)Cl 62a_100010202889_100102525003 [0,2,0,0,0,0|2,0,0]=4 13149 B15R1.123 NC(=O)CCCSc1cccc(c1O)Cl 62a_100102525003_100010202889 [0,2,0,0,0,0|2,0,0]=4 13150 B15R1.123 NC(=O)CCCSc1cccc(c1O)F 62a_100009813666_100102525003 [0,2,0,0,0,0|2,0,0]=4 13151 B15R1.123 NC(=O)CCCSc1cccc(c1O)F 62a_100102525003_100009813666 [0,2,0,0,0,0|2,0,0]=4 13152 B15R1.123 NC(=O)CCCSc1cccc(c1O)N 62a_100011934915_100102525003 [0,2,0,0,0,0|2,0,0]=4 13153 B15R1.123 NC(=O)CCCSc1cccc(c1O)N 62a_100102525003_100010084371 [0,2,0,0,0,0|2,0,0]=4 13154 B15R1.123 NC(=O)CCCSc1cccc(c1O)O 62a_100102525003_100009815950 [0,2,0,0,0,0|2,0,0]=4 13155 B15R1.123 NC(=O)CCNCc1cccc(c1Br)Br 207a_100000740010_100010240334 [0,2,0,0,0,0|2,0,0]=4 13156 B15R1.123 NC(=O)CCNCc1cccc(c1Br)Cl 207a_100000740010_100010232083 [0,2,0,0,0,0|2,0,0]=4 13157 B15R1.123 NC(=O)CCNCc1cccc(c1Br)F 207a_100000740010_100011934749 [0,2,0,0,0,0|2,0,0]=4 13158 B15R1.123 NC(=O)CCNCc1cccc(c1Br)F 2230a_100020638964_100000744528 [0,2,0,0,0,0|2,0,0]=4 13159 B15R1.123 NC(=O)CCNCc1cccc(c1Br)F 34a_100020638964_100000731001 [0,2,0,0,0,0|2,0,0]=4 13160 B15R1.123 NC(=O)CCNCc1cccc(c1Cl)Br 207a_100000740010_100012362481 [0,2,0,0,0,0|2,0,0]=4 13161 B15R1.123 NC(=O)CCNCc1cccc(c1Cl)Cl 207a_100000740010_100000210504 [0,2,0,0,0,0|2,0,0]=4 13162 B15R1.123 NC(=O)CCNCc1cccc(c1Cl)Cl 2230a_100011211633_100000744528 [0,2,0,0,0,0|2,0,0]=4 13163 B15R1.123 NC(=O)CCNCc1cccc(c1Cl)Cl 34a_100011211633_100000731001 [0,2,0,0,0,0|2,0,0]=4 13164 B15R1.123 NC(=O)CCNCc1cccc(c1Cl)F 207a_100000740010_100011998484 [0,2,0,0,0,0|2,0,0]=4 13165 B15R1.123 NC(=O)CCNCc1cccc(c1Cl)F 2230a_100012001614_100000744528 [0,2,0,0,0,0|2,0,0]=4 13166 B15R1.123 NC(=O)CCNCc1cccc(c1Cl)F 34a_100012001614_100000731001 [0,2,0,0,0,0|2,0,0]=4 13167 B15R1.123 NC(=O)CCNCc1cccc(c1F)Br 207a_100000740010_100011361543 [0,2,0,0,0,0|2,0,0]=4 13168 B15R1.123 NC(=O)CCNCc1cccc(c1F)Br 2230a_100015189953_100000744528 [0,2,0,0,0,0|2,0,0]=4 13169 B15R1.123 NC(=O)CCNCc1cccc(c1F)Br 34a_100015189953_100000731001 [0,2,0,0,0,0|2,0,0]=4 13170 B15R1.123 NC(=O)CCNCc1cccc(c1F)Cl 207a_100000740010_100000766533 [0,2,0,0,0,0|2,0,0]=4 13171 B15R1.123 NC(=O)CCNCc1cccc(c1F)Cl 2230a_100000764326_100000744528 [0,2,0,0,0,0|2,0,0]=4 13172 B15R1.123 NC(=O)CCNCc1cccc(c1F)Cl 34a_100000764326_100000731001 [0,2,0,0,0,0|2,0,0]=4 13173 B15R1.123 NC(=O)CCNCc1cccc(c1F)F 207a_100000740010_100000753312 [0,2,0,0,0,0|2,0,0]=4 13174 B15R1.123 NC(=O)CCNCc1cccc(c1F)F 2230a_100011199105_100000744528 [0,2,0,0,0,0|2,0,0]=4 13175 B15R1.123 NC(=O)CCNCc1cccc(c1F)F 34a_100011199105_100000731001 [0,2,0,0,0,0|2,0,0]=4 13176 B15R1.123 NC(=O)CCNCc1cccc(c1F)I 207a_100000740010_100010202174 [0,2,0,0,0,0|2,0,0]=4 13177 B15R1.123 NC(=O)CCNCc1cccc(c1F)O 34a_100025773512_100000731001 [0,2,0,0,0,0|2,0,0]=4 13178 B15R1.123 NC(=O)CCNCc1cccc(c1I)F 207a_100000740010_100010186293 [0,2,0,0,0,0|2,0,0]=4 13179 B15R1.123 NC(=O)CCOCc1cccc(c1Br)Cl 34a_100000757172_100010145525 [0,2,0,0,0,0|2,0,0]=4 13180 B15R1.123 NC(=O)CCOCc1cccc(c1Br)Cl 34a_100010168166_100000731001 [0,2,0,0,0,0|2,0,0]=4 13181 B15R1.123 NC(=O)CCOCc1cccc(c1Br)Cl 7a_100000757172_100010145525 [0,2,0,0,0,0|2,0,0]=4 13182 B15R1.123 NC(=O)CCOCc1cccc(c1Br)Cl 7a_100010168166_100000744528 [0,2,0,0,0,0|2,0,0]=4 13183 B15R1.123 NC(=O)CCOCc1cccc(c1Br)F 34a_100000757172_100012351116 [0,2,0,0,0,0|2,0,0]=4 13184 B15R1.123 NC(=O)CCOCc1cccc(c1Br)F 34a_100012351117_100000731001 [0,2,0,0,0,0|2,0,0]=4 13185 B15R1.123 NC(=O)CCOCc1cccc(c1Br)F 7a_100000757172_100012351116 [0,2,0,0,0,0|2,0,0]=4 13186 B15R1.123 NC(=O)CCOCc1cccc(c1Br)F 7a_100012351117_100000744528 [0,2,0,0,0,0|2,0,0]=4 13187 B15R1.123 NC(=O)CCOCc1cccc(c1Br)I 34a_100000757172_100010254545 [0,2,0,0,0,0|2,0,0]=4 13188 B15R1.123 NC(=O)CCOCc1cccc(c1Br)I 34a_100010240205_100000731001 [0,2,0,0,0,0|2,0,0]=4 13189 B15R1.123 NC(=O)CCOCc1cccc(c1Br)I 7a_100000757172_100010254545 [0,2,0,0,0,0|2,0,0]=4 13190 B15R1.123 NC(=O)CCOCc1cccc(c1Br)I 7a_100010240205_100000744528 [0,2,0,0,0,0|2,0,0]=4 13191 B15R1.123 NC(=O)CCOCc1cccc(c1Cl)Br 34a_100000757172_100012349491 [0,2,0,0,0,0|2,0,0]=4 13192 B15R1.123 NC(=O)CCOCc1cccc(c1Cl)Br 34a_100012351182_100000731001 [0,2,0,0,0,0|2,0,0]=4 13193 B15R1.123 NC(=O)CCOCc1cccc(c1Cl)Br 7a_100000757172_100012349491 [0,2,0,0,0,0|2,0,0]=4 13194 B15R1.123 NC(=O)CCOCc1cccc(c1Cl)Br 7a_100012351182_100000744528 [0,2,0,0,0,0|2,0,0]=4 13195 B15R1.123 NC(=O)CCOCc1cccc(c1Cl)Cl 34a_100000720469_100000731001 [0,2,0,0,0,0|2,0,0]=4 13196 B15R1.123 NC(=O)CCOCc1cccc(c1Cl)Cl 34a_100000757172_100000723366 [0,2,0,0,0,0|2,0,0]=4 13197 B15R1.123 NC(=O)CCOCc1cccc(c1Cl)Cl 7a_100000720469_100000744528 [0,2,0,0,0,0|2,0,0]=4 13198 B15R1.123 NC(=O)CCOCc1cccc(c1Cl)Cl 7a_100000757172_100000723366 [0,2,0,0,0,0|2,0,0]=4 13199 B15R1.123 NC(=O)CCOCc1cccc(c1Cl)F 34a_100000696319_100000731001 [0,2,0,0,0,0|2,0,0]=4 13200 B15R1.123 NC(=O)CCOCc1cccc(c1Cl)F 34a_100000757172_100000696688 [0,2,0,0,0,0|2,0,0]=4 13201 B15R1.123 NC(=O)CCOCc1cccc(c1Cl)F 7a_100000696319_100000744528 [0,2,0,0,0,0|2,0,0]=4 13202 B15R1.123 NC(=O)CCOCc1cccc(c1Cl)F 7a_100000757172_100000696688 [0,2,0,0,0,0|2,0,0]=4 13203 B15R1.123 NC(=O)CCOCc1cccc(c1F)Br 34a_100000757172_100012356506 [0,2,0,0,0,0|2,0,0]=4 13204 B15R1.123 NC(=O)CCOCc1cccc(c1F)Br 34a_100011935076_100000731001 [0,2,0,0,0,0|2,0,0]=4 13205 B15R1.123 NC(=O)CCOCc1cccc(c1F)Br 7a_100000757172_100012356506 [0,2,0,0,0,0|2,0,0]=4 13206 B15R1.123 NC(=O)CCOCc1cccc(c1F)Br 7a_100011935076_100000744528 [0,2,0,0,0,0|2,0,0]=4 13207 B15R1.123 NC(=O)CCOCc1cccc(c1F)Cl 34a_100000757172_100000716733 [0,2,0,0,0,0|2,0,0]=4 13208 B15R1.123 NC(=O)CCOCc1cccc(c1F)Cl 34a_100011216988_100000731001 [0,2,0,0,0,0|2,0,0]=4 13209 B15R1.123 NC(=O)CCOCc1cccc(c1F)Cl 7a_100000757172_100000716733 [0,2,0,0,0,0|2,0,0]=4 13210 B15R1.123 NC(=O)CCOCc1cccc(c1F)Cl 7a_100011216988_100000744528 [0,2,0,0,0,0|2,0,0]=4 13211 B15R1.123 NC(=O)CCOCc1cccc(c1F)F 34a_100000757172_100000217499 [0,2,0,0,0,0|2,0,0]=4 13212 B15R1.123 NC(=O)CCOCc1cccc(c1F)F 34a_100011218644_100000731001 [0,2,0,0,0,0|2,0,0]=4 13213 B15R1.123 NC(=O)CCOCc1cccc(c1F)F 7a_100000757172_100000217499 [0,2,0,0,0,0|2,0,0]=4 13214 B15R1.123 NC(=O)CCOCc1cccc(c1F)F 7a_100011218644_100000744528 [0,2,0,0,0,0|2,0,0]=4 13215 B15R1.123 NC(=O)CCOCc1cccc(c1F)I 34a_200010235739_100000731001 [0,2,0,0,0,0|2,0,0]=4 13216 B15R1.123 NC(=O)CCOCc1cccc(c1F)I 7a_200010235739_100000744528 [0,2,0,0,0,0|2,0,0]=4 13217 B15R1.123 NC(=O)CCOCc1cccc(c1F)N 34a_100012023829_100000731001 [0,2,0,0,0,0|2,0,0]=4 13218 B15R1.123 NC(=O)CCOCc1cccc(c1I)Br 34a_100010146604_100000731001 [0,2,0,0,0,0|2,0,0]=4 13219 B15R1.123 NC(=O)CCOCc1cccc(c1I)Br 7a_100010146604_100000744528 [0,2,0,0,0,0|2,0,0]=4 13220 B15R1.123 NC(=O)CCOCc1cccc(c1I)F 34a_100000692438_100000731001 [0,2,0,0,0,0|2,0,0]=4 13221 B15R1.123 NC(=O)CCOCc1cccc(c1I)F 34a_100000757172_100010149603 [0,2,0,0,0,0|2,0,0]=4 13222 B15R1.123 NC(=O)CCOCc1cccc(c1I)F 7a_100000692438_100000744528 [0,2,0,0,0,0|2,0,0]=4 13223 B15R1.123 NC(=O)CCOCc1cccc(c1I)F 7a_100000757172_100010149603 [0,2,0,0,0,0|2,0,0]=4 13224 B15R1.123 NC(=O)CCOCc1cccc(c1N)Br 34a_100012349457_100000731001 [0,2,0,0,0,0|2,0,0]=4 13225 B15R1.123 NC(=O)CCOCc1cccc(c1N)Cl 34a_100012182729_100000731001 [0,2,0,0,0,0|2,0,0]=4 13226 B15R1.123 NC(=O)CCOCc1cccc(c1N)F 34a_100000692437_100000731001 [0,2,0,0,0,0|2,0,0]=4 13227 B15R1.123 NC(=O)CCSCc1cccc(c1Br)Cl 62a_100000744528_100010145525 [0,2,0,0,0,0|2,0,0]=4 13228 B15R1.123 NC(=O)CCSCc1cccc(c1Br)Cl 62a_100010145525_100000744528 [0,2,0,0,0,0|2,0,0]=4 13229 B15R1.123 NC(=O)CCSCc1cccc(c1Br)F 62a_100000744528_100012351116 [0,2,0,0,0,0|2,0,0]=4 13230 B15R1.123 NC(=O)CCSCc1cccc(c1Br)F 62a_100012351116_100000744528 [0,2,0,0,0,0|2,0,0]=4 13231 B15R1.123 NC(=O)CCSCc1cccc(c1Br)I 62a_100000744528_100010254545 [0,2,0,0,0,0|2,0,0]=4 13232 B15R1.123 NC(=O)CCSCc1cccc(c1Br)I 62a_100010254545_100000744528 [0,2,0,0,0,0|2,0,0]=4 13233 B15R1.123 NC(=O)CCSCc1cccc(c1Cl)Br 62a_100000744528_100012349491 [0,2,0,0,0,0|2,0,0]=4 13234 B15R1.123 NC(=O)CCSCc1cccc(c1Cl)Br 62a_100012349491_100000744528 [0,2,0,0,0,0|2,0,0]=4 13235 B15R1.123 NC(=O)CCSCc1cccc(c1Cl)Cl 62a_100000720918_100000744528 [0,2,0,0,0,0|2,0,0]=4 13236 B15R1.123 NC(=O)CCSCc1cccc(c1Cl)Cl 62a_100000744528_100000723366 [0,2,0,0,0,0|2,0,0]=4 13237 B15R1.123 NC(=O)CCSCc1cccc(c1Cl)F 62a_100000696688_100000744528 [0,2,0,0,0,0|2,0,0]=4 13238 B15R1.123 NC(=O)CCSCc1cccc(c1Cl)F 62a_100000744528_100000696688 [0,2,0,0,0,0|2,0,0]=4 13239 B15R1.123 NC(=O)CCSCc1cccc(c1F)Br 62a_100000744528_100012356506 [0,2,0,0,0,0|2,0,0]=4 13240 B15R1.123 NC(=O)CCSCc1cccc(c1F)Br 62a_100012356506_100000744528 [0,2,0,0,0,0|2,0,0]=4 13241 B15R1.123 NC(=O)CCSCc1cccc(c1F)Cl 62a_100000716733_100000744528 [0,2,0,0,0,0|2,0,0]=4 13242 B15R1.123 NC(=O)CCSCc1cccc(c1F)Cl 62a_100000744528_100000716733 [0,2,0,0,0,0|2,0,0]=4 13243 B15R1.123 NC(=O)CCSCc1cccc(c1F)F 62a_100000217499_100000744528 [0,2,0,0,0,0|2,0,0]=4 13244 B15R1.123 NC(=O)CCSCc1cccc(c1F)F 62a_100000744528_100000217499 [0,2,0,0,0,0|2,0,0]=4 13245 B15R1.123 NC(=O)CCSCc1cccc(c1I)F 62a_100000744528_100010149603 [0,2,0,0,0,0|2,0,0]=4 13246 B15R1.123 NC(=O)CCSCc1cccc(c1I)F 62a_100010149603_100000744528 [0,2,0,0,0,0|2,0,0]=4 13247 B15R1.123 NC(=O)CNCCc1cccc(c1Cl)Cl 2230a_100000711301_100000723033 [0,2,0,0,0,0|2,0,0]=4 13248 B15R1.123 NC(=O)CNCCc1cccc(c1Cl)Cl 2230a_100000741019_100000747473 [0,2,0,0,0,0|2,0,0]=4 13249 B15R1.123 NC(=O)CNCCc1cccc(c1Cl)Cl 34a_100000741019_100000187820 [0,2,0,0,0,0|2,0,0]=4 13250 B15R1.123 NC(=O)COCCc1cccc(c1Cl)Cl 34a_100011754357_100000187820 [0,2,0,0,0,0|2,0,0]=4 13251 B15R1.123 NC(=O)COCCc1cccc(c1Cl)Cl 7a_100011754357_100000187820 [0,2,0,0,0,0|2,0,0]=4 13252 B15R1.123 NC(=O)COCCc1cccc(c1F)Cl 34a_100011830271_100000187820 [0,2,0,0,0,0|2,0,0]=4 13253 B15R1.123 NC(=O)COCCc1cccc(c1F)Cl 7a_100011830271_100000187820 [0,2,0,0,0,0|2,0,0]=4 13254 B15R1.123 NC(=O)COCCc1cccc(c1F)F 34a_100000698707_100000187820 [0,2,0,0,0,0|2,0,0]=4 13255 B15R1.123 NC(=O)COCCc1cccc(c1F)F 7a_100000698707_100000187820 [0,2,0,0,0,0|2,0,0]=4 13256 B15R1.123 NC(=O)CSCCc1cccc(c1Cl)Cl 62a_100000723033_100000747473 [0,2,0,0,0,0|2,0,0]=4 13257 B15R1.123 NC(=O)CSCCc1cccc(c1Cl)Cl 62a_100000747473_100000723033 [0,2,0,0,0,0|2,0,0]=4 13258 B15R1.123 O=C(O)CNCCc1cccc(c1Cl)Cl 269956a_100016091260_100000723033 [0,2,0,0,0,0|1,0,0]=3 13259 B15R1.123 O=C(O)CONCc1cccc(c1Br)Cl 269956a_100000106656_100010145525 [0,2,0,0,0,0|2,0,0]=4 13260 B15R1.123 O=C(O)CONCc1cccc(c1Br)F 269956a_100000106656_100012351116 [0,2,0,0,0,0|2,0,0]=4 13261 B15R1.123 O=C(O)CONCc1cccc(c1Br)I 269956a_100000106656_100010254545 [0,2,0,0,0,0|2,0,0]=4 13262 B15R1.123 O=C(O)CONCc1cccc(c1Cl)Br 269956a_100000106656_100012349491 [0,2,0,0,0,0|2,0,0]=4 13263 B15R1.123 O=C(O)CONCc1cccc(c1Cl)Cl 269956a_100000106656_100000720918 [0,2,0,0,0,0|2,0,0]=4 13264 B15R1.123 O=C(O)CONCc1cccc(c1Cl)F 269956a_100000106656_100000696688 [0,2,0,0,0,0|2,0,0]=4 13265 B15R1.123 O=C(O)CONCc1cccc(c1F)Br 269956a_100000106656_100012356506 [0,2,0,0,0,0|2,0,0]=4 13266 B15R1.123 O=C(O)CONCc1cccc(c1F)Cl 269956a_100000106656_100000716733 [0,2,0,0,0,0|2,0,0]=4 13267 B15R1.123 O=C(O)CONCc1cccc(c1F)F 269956a_100000106656_100000217499 [0,2,0,0,0,0|2,0,0]=4 13268 B15R1.123 O=C(O)CONCc1cccc(c1I)F 269956a_100000106656_100010149603 [0,2,0,0,0,0|2,0,0]=4 13269 B15R1.123 O=C([O-])CNCCc1cccc(c1Cl)Cl 34a_100000741019_100020667443 [0,2,0,0,0,0|1,0,1]=4 13270 B15R1.123 O=C([O-])COCCc1cccc(c1Cl)Cl 34a_100011754357_100020667443 [0,2,0,0,0,0|1,0,1]=4 13271 B15R1.123 O=C([O-])COCCc1cccc(c1F)Cl 34a_100011830271_100020667443 [0,2,0,0,0,0|1,0,1]=4 13272 B15R1.123 O=C([O-])COCCc1cccc(c1F)F 34a_100000698707_100020667443 [0,2,0,0,0,0|1,0,1]=4 13273 B15R1.123 O=C([O-])CSCCc1cccc(c1Cl)Cl 62a_100000723033_100020667443 [0,2,0,0,0,0|1,0,1]=4 13274 B15R1.123 O=C([O-])CSCCc1cccc(c1Cl)Cl 62a_100020667443_100000723033 [0,2,0,0,0,0|1,0,1]=4 13275 B15R1.123 [13CH3]C(=O)CCCOc1cccc(c1Cl)Cl 1458a_100000746216_200025704644 [0,2,0,0,0,0|2,0,0]=4 13276 B15R1.888 CC(=O)CCCNc1ccc(c(c1)Br)Br 34a_100011306057_100000685027 [0,2,0,0,0,0|2,0,0]=4 13277 B15R1.888 CC(=O)CCCNc1ccc(c(c1)Br)Br 7a_100011306057_100011215641 [0,2,0,0,0,0|2,0,0]=4 13278 B15R1.888 CC(=O)CCCNc1ccc(c(c1)Br)C 34a_100000736455_100000685027 [0,2,0,0,0,0|2,0,0]=4 13279 B15R1.888 CC(=O)CCCNc1ccc(c(c1)Br)C 7a_100000736455_100011215641 [0,2,0,0,0,0|2,0,0]=4 13280 B15R1.888 CC(=O)CCCNc1ccc(c(c1)Br)Cl 34a_100000686031_100000685027 [0,2,0,0,0,0|2,0,0]=4 13281 B15R1.888 CC(=O)CCCNc1ccc(c(c1)Br)F 34a_100000760356_100000685027 [0,2,0,0,0,0|2,0,0]=4 13282 B15R1.888 CC(=O)CCCNc1ccc(c(c1)Br)F 7a_100000760356_100011215641 [0,2,0,0,0,0|2,0,0]=4 13283 B15R1.888 CC(=O)CCCNc1ccc(c(c1)Br)I 34a_100000750458_100000685027 [0,2,0,0,0,0|2,0,0]=4 13284 B15R1.888 CC(=O)CCCNc1ccc(c(c1)Br)O 34a_100011534360_100000685027 [0,2,0,0,0,0|2,0,0]=4 13285 B15R1.888 CC(=O)CCCNc1ccc(c(c1)C)Br 34a_100000210723_100000685027 [0,2,0,0,0,0|2,0,0]=4 13286 B15R1.888 CC(=O)CCCNc1ccc(c(c1)C)Br 7a_100000210723_100011215641 [0,2,0,0,0,0|2,0,0]=4 13287 B15R1.888 CC(=O)CCCNc1ccc(c(c1)C)C 34a_100000724040_100000685027 [0,2,0,0,0,0|2,0,0]=4 13288 B15R1.888 CC(=O)CCCNc1ccc(c(c1)C)C 7a_100000724040_100011215641 [0,2,0,0,0,0|2,0,0]=4 13289 B15R1.888 CC(=O)CCCNc1ccc(c(c1)C)Cl 34a_100000187808_100000685027 [0,2,0,0,0,0|2,0,0]=4 13290 B15R1.888 CC(=O)CCCNc1ccc(c(c1)C)Cl 7a_100000187808_100011215641 [0,2,0,0,0,0|2,0,0]=4 13291 B15R1.888 CC(=O)CCCNc1ccc(c(c1)C)F 34a_100000750164_100000685027 [0,2,0,0,0,0|2,0,0]=4 13292 B15R1.888 CC(=O)CCCNc1ccc(c(c1)C)F 7a_100000750164_100011215641 [0,2,0,0,0,0|2,0,0]=4 13293 B15R1.888 CC(=O)CCCNc1ccc(c(c1)C)I 34a_100000198070_100000685027 [0,2,0,0,0,0|2,0,0]=4 13294 B15R1.888 CC(=O)CCCNc1ccc(c(c1)C)I 7a_100000198070_100011215641 [0,2,0,0,0,0|2,0,0]=4 13295 B15R1.888 CC(=O)CCCNc1ccc(c(c1)C)O 34a_100011218179_100000685027 [0,2,0,0,0,0|2,0,0]=4 13296 B15R1.888 CC(=O)CCCNc1ccc(c(c1)C)O 7a_100011218179_100011215641 [0,2,0,0,0,0|2,0,0]=4 13297 B15R1.888 CC(=O)CCCNc1ccc(c(c1)Cl)Br 34a_100000687081_100000685027 [0,2,0,0,0,0|2,0,0]=4 13298 B15R1.888 CC(=O)CCCNc1ccc(c(c1)Cl)Br 7a_100000687081_100011215641 [0,2,0,0,0,0|2,0,0]=4 13299 B15R1.888 CC(=O)CCCNc1ccc(c(c1)Cl)C 34a_100000188892_100000685027 [0,2,0,0,0,0|2,0,0]=4 13300 B15R1.888 CC(=O)CCCNc1ccc(c(c1)Cl)C 7a_100000188892_100011215641 [0,2,0,0,0,0|2,0,0]=4 13301 B15R1.888 CC(=O)CCCNc1ccc(c(c1)Cl)Cl 34a_100000184108_100000685027 [0,2,0,0,0,0|2,0,0]=4 13302 B15R1.888 CC(=O)CCCNc1ccc(c(c1)Cl)F 34a_100000211060_100000685027 [0,2,0,0,0,0|2,0,0]=4 13303 B15R1.888 CC(=O)CCCNc1ccc(c(c1)Cl)F 7a_100000211060_100011215641 [0,2,0,0,0,0|2,0,0]=4 13304 B15R1.888 CC(=O)CCCNc1ccc(c(c1)Cl)I 34a_100000761885_100000685027 [0,2,0,0,0,0|2,0,0]=4 13305 B15R1.888 CC(=O)CCCNc1ccc(c(c1)Cl)O 34a_100000744943_100000685027 [0,2,0,0,0,0|2,0,0]=4 13306 B15R1.888 CC(=O)CCCNc1ccc(c(c1)F)Br 34a_100000759894_100000685027 [0,2,0,0,0,0|2,0,0]=4 13307 B15R1.888 CC(=O)CCCNc1ccc(c(c1)F)Br 7a_100000759894_100011215641 [0,2,0,0,0,0|2,0,0]=4 13308 B15R1.888 CC(=O)CCCNc1ccc(c(c1)F)C 34a_100000210958_100000685027 [0,2,0,0,0,0|2,0,0]=4 13309 B15R1.888 CC(=O)CCCNc1ccc(c(c1)F)C 7a_100000210958_100011215641 [0,2,0,0,0,0|2,0,0]=4 13310 B15R1.888 CC(=O)CCCNc1ccc(c(c1)F)Cl 34a_100000739366_100000685027 [0,2,0,0,0,0|2,0,0]=4 13311 B15R1.888 CC(=O)CCCNc1ccc(c(c1)F)Cl 7a_100000739366_100011215641 [0,2,0,0,0,0|2,0,0]=4 13312 B15R1.888 CC(=O)CCCNc1ccc(c(c1)F)F 34a_100000210724_100000685027 [0,2,0,0,0,0|2,0,0]=4 13313 B15R1.888 CC(=O)CCCNc1ccc(c(c1)F)F 7a_100000210724_100011215641 [0,2,0,0,0,0|2,0,0]=4 13314 B15R1.888 CC(=O)CCCNc1ccc(c(c1)F)I 34a_100011356925_100000685027 [0,2,0,0,0,0|2,0,0]=4 13315 B15R1.888 CC(=O)CCCNc1ccc(c(c1)F)I 7a_100011356925_100011215641 [0,2,0,0,0,0|2,0,0]=4 13316 B15R1.888 CC(=O)CCCNc1ccc(c(c1)F)O 34a_100011220035_100000685027 [0,2,0,0,0,0|2,0,0]=4 13317 B15R1.888 CC(=O)CCCNc1ccc(c(c1)F)O 7a_100011220035_100011215641 [0,2,0,0,0,0|2,0,0]=4 13318 B15R1.888 CC(=O)CCCNc1ccc(c(c1)I)Br 34a_100000750459_100000685027 [0,2,0,0,0,0|2,0,0]=4 13319 B15R1.888 CC(=O)CCCNc1ccc(c(c1)I)C 34a_100000184131_100000685027 [0,2,0,0,0,0|2,0,0]=4 13320 B15R1.888 CC(=O)CCCNc1ccc(c(c1)I)C 7a_100000184131_100011215641 [0,2,0,0,0,0|2,0,0]=4 13321 B15R1.888 CC(=O)CCCNc1ccc(c(c1)I)Cl 34a_100012360549_100000685027 [0,2,0,0,0,0|2,0,0]=4 13322 B15R1.888 CC(=O)CCCNc1ccc(c(c1)I)F 34a_114828291077_100000685027 [0,2,0,0,0,0|2,0,0]=4 13323 B15R1.888 CC(=O)CCCNc1ccc(c(c1)I)F 7a_114828291077_100011215641 [0,2,0,0,0,0|2,0,0]=4 13324 B15R1.888 CC(=O)CCCNc1ccc(c(c1)O)C 34a_100000759471_100000685027 [0,2,0,0,0,0|2,0,0]=4 13325 B15R1.888 CC(=O)CCCNc1ccc(c(c1)O)C 7a_100000759471_100011215641 [0,2,0,0,0,0|2,0,0]=4 13326 B15R1.888 CC(=O)CCCNc1ccc(c(c1)O)Cl 34a_100011934209_100000685027 [0,2,0,0,0,0|2,0,0]=4 13327 B15R1.888 CC(=O)CCCNc1ccc(c(c1)O)F 34a_100012017398_100000685027 [0,2,0,0,0,0|2,0,0]=4 13328 B15R1.888 CC(=O)CCCNc1ccc(c(c1)O)F 7a_100012017398_100011215641 [0,2,0,0,0,0|2,0,0]=4 13329 B15R1.888 CC(=O)CCCNc1ccc(c(c1)O)O 34a_100102946323_100000685027 [0,2,0,0,0,0|2,0,0]=4 13330 B15R1.888 CC(=O)CCCOc1ccc(c(c1)Br)C 34a_100011380479_100000685027 [0,2,0,0,0,0|2,0,0]=4 13331 B15R1.888 CC(=O)CCCOc1ccc(c(c1)Br)C 7a_100011380479_100011215641 [0,2,0,0,0,0|2,0,0]=4 13332 B15R1.888 CC(=O)CCCOc1ccc(c(c1)Br)Cl 34a_100011933957_100000685027 [0,2,0,0,0,0|2,0,0]=4 13333 B15R1.888 CC(=O)CCCOc1ccc(c(c1)Br)Cl 7a_100011933957_100011215641 [0,2,0,0,0,0|2,0,0]=4 13334 B15R1.888 CC(=O)CCCOc1ccc(c(c1)Br)F 34a_100000693481_100000685027 [0,2,0,0,0,0|2,0,0]=4 13335 B15R1.888 CC(=O)CCCOc1ccc(c(c1)Br)F 7a_100000693481_100011215641 [0,2,0,0,0,0|2,0,0]=4 13336 B15R1.888 CC(=O)CCCOc1ccc(c(c1)Br)I 34a_100000701344_100000685027 [0,2,0,0,0,0|2,0,0]=4 13337 B15R1.888 CC(=O)CCCOc1ccc(c(c1)Br)I 7a_100000701344_100011215641 [0,2,0,0,0,0|2,0,0]=4 13338 B15R1.888 CC(=O)CCCOc1ccc(c(c1)Br)N 34a_100012001276_100000685027 [0,2,0,0,0,0|2,0,0]=4 13339 B15R1.888 CC(=O)CCCOc1ccc(c(c1)Br)N 7a_100012001276_100011215641 [0,2,0,0,0,0|2,0,0]=4 13340 B15R1.888 CC(=O)CCCOc1ccc(c(c1)C)Br 34a_100000690111_100000685027 [0,2,0,0,0,0|2,0,0]=4 13341 B15R1.888 CC(=O)CCCOc1ccc(c(c1)C)Br 7a_100000690111_100011215641 [0,2,0,0,0,0|2,0,0]=4 13342 B15R1.888 CC(=O)CCCOc1ccc(c(c1)C)C 1458a_100000070787_100000737685 [0,2,0,0,0,0|2,0,0]=4 13343 B15R1.888 CC(=O)CCCOc1ccc(c(c1)C)C 1458a_100000766245_200000210301 [0,2,0,0,0,0|2,0,0]=4 13344 B15R1.888 CC(=O)CCCOc1ccc(c(c1)C)C 34a_100000210932_100000685027 [0,2,0,0,0,0|2,0,0]=4 13345 B15R1.888 CC(=O)CCCOc1ccc(c(c1)C)C 7a_100000210932_100011215641 [0,2,0,0,0,0|2,0,0]=4 13346 B15R1.888 CC(=O)CCCOc1ccc(c(c1)C)Cl 1458a_100000182829_200000210301 [0,2,0,0,0,0|2,0,0]=4 13347 B15R1.888 CC(=O)CCCOc1ccc(c(c1)C)Cl 34a_100000211092_100000685027 [0,2,0,0,0,0|2,0,0]=4 13348 B15R1.888 CC(=O)CCCOc1ccc(c(c1)C)Cl 7a_100000211092_100011215641 [0,2,0,0,0,0|2,0,0]=4 13349 B15R1.888 CC(=O)CCCOc1ccc(c(c1)C)F 34a_100000751312_100000685027 [0,2,0,0,0,0|2,0,0]=4 13350 B15R1.888 CC(=O)CCCOc1ccc(c(c1)C)F 7a_100000751312_100011215641 [0,2,0,0,0,0|2,0,0]=4 13351 B15R1.888 CC(=O)CCCOc1ccc(c(c1)C)I 34a_100000729255_100000685027 [0,2,0,0,0,0|2,0,0]=4 13352 B15R1.888 CC(=O)CCCOc1ccc(c(c1)C)I 7a_100000729255_100011215641 [0,2,0,0,0,0|2,0,0]=4 13353 B15R1.888 CC(=O)CCCOc1ccc(c(c1)C)N 34a_100000756630_100000685027 [0,2,0,0,0,0|2,0,0]=4 13354 B15R1.888 CC(=O)CCCOc1ccc(c(c1)C)N 7a_100000756630_100011215641 [0,2,0,0,0,0|2,0,0]=4 13355 B15R1.888 CC(=O)CCCOc1ccc(c(c1)Cl)Br 34a_100011215161_100000685027 [0,2,0,0,0,0|2,0,0]=4 13356 B15R1.888 CC(=O)CCCOc1ccc(c(c1)Cl)Br 7a_100011215161_100011215641 [0,2,0,0,0,0|2,0,0]=4 13357 B15R1.888 CC(=O)CCCOc1ccc(c(c1)Cl)C 34a_100011265682_100000685027 [0,2,0,0,0,0|2,0,0]=4 13358 B15R1.888 CC(=O)CCCOc1ccc(c(c1)Cl)C 7a_100011265682_100011215641 [0,2,0,0,0,0|2,0,0]=4 13359 B15R1.888 CC(=O)CCCOc1ccc(c(c1)Cl)Cl 34a_100000211054_100000685027 [0,2,0,0,0,0|2,0,0]=4 13360 B15R1.888 CC(=O)CCCOc1ccc(c(c1)Cl)Cl 7a_100000211054_100011215641 [0,2,0,0,0,0|2,0,0]=4 13361 B15R1.888 CC(=O)CCCOc1ccc(c(c1)Cl)F 34a_100000211030_100000685027 [0,2,0,0,0,0|2,0,0]=4 13362 B15R1.888 CC(=O)CCCOc1ccc(c(c1)Cl)F 7a_100000211030_100011215641 [0,2,0,0,0,0|2,0,0]=4 13363 B15R1.888 CC(=O)CCCOc1ccc(c(c1)Cl)I 34a_100000047559_100000685027 [0,2,0,0,0,0|2,0,0]=4 13364 B15R1.888 CC(=O)CCCOc1ccc(c(c1)Cl)I 7a_100000047559_100011215641 [0,2,0,0,0,0|2,0,0]=4 13365 B15R1.888 CC(=O)CCCOc1ccc(c(c1)Cl)N 34a_100011215599_100000685027 [0,2,0,0,0,0|2,0,0]=4 13366 B15R1.888 CC(=O)CCCOc1ccc(c(c1)Cl)N 7a_100011215599_100011215641 [0,2,0,0,0,0|2,0,0]=4 13367 B15R1.888 CC(=O)CCCOc1ccc(c(c1)F)Br 34a_100000755031_100000685027 [0,2,0,0,0,0|2,0,0]=4 13368 B15R1.888 CC(=O)CCCOc1ccc(c(c1)F)Br 7a_100000755031_100011215641 [0,2,0,0,0,0|2,0,0]=4 13369 B15R1.888 CC(=O)CCCOc1ccc(c(c1)F)C 34a_100000722560_100000685027 [0,2,0,0,0,0|2,0,0]=4 13370 B15R1.888 CC(=O)CCCOc1ccc(c(c1)F)C 7a_100000722560_100011215641 [0,2,0,0,0,0|2,0,0]=4 13371 B15R1.888 CC(=O)CCCOc1ccc(c(c1)F)Cl 34a_100000691581_100000685027 [0,2,0,0,0,0|2,0,0]=4 13372 B15R1.888 CC(=O)CCCOc1ccc(c(c1)F)Cl 7a_100000691581_100011215641 [0,2,0,0,0,0|2,0,0]=4 13373 B15R1.888 CC(=O)CCCOc1ccc(c(c1)F)F 34a_100000181275_100000685027 [0,2,0,0,0,0|2,0,0]=4 13374 B15R1.888 CC(=O)CCCOc1ccc(c(c1)F)F 7a_100000181275_100011215641 [0,2,0,0,0,0|2,0,0]=4 13375 B15R1.888 CC(=O)CCCOc1ccc(c(c1)F)I 34a_100009990212_100000685027 [0,2,0,0,0,0|2,0,0]=4 13376 B15R1.888 CC(=O)CCCOc1ccc(c(c1)F)I 7a_100009990212_100011215641 [0,2,0,0,0,0|2,0,0]=4 13377 B15R1.888 CC(=O)CCCOc1ccc(c(c1)F)N 34a_100000759473_100000685027 [0,2,0,0,0,0|2,0,0]=4 13378 B15R1.888 CC(=O)CCCOc1ccc(c(c1)F)N 7a_100000759473_100011215641 [0,2,0,0,0,0|2,0,0]=4 13379 B15R1.888 CC(=O)CCCOc1ccc(c(c1)I)Br 34a_100012339312_100000685027 [0,2,0,0,0,0|2,0,0]=4 13380 B15R1.888 CC(=O)CCCOc1ccc(c(c1)I)Br 7a_100012339312_100011215641 [0,2,0,0,0,0|2,0,0]=4 13381 B15R1.888 CC(=O)CCCOc1ccc(c(c1)I)Cl 34a_100000049588_100000685027 [0,2,0,0,0,0|2,0,0]=4 13382 B15R1.888 CC(=O)CCCOc1ccc(c(c1)I)Cl 7a_100000049588_100011215641 [0,2,0,0,0,0|2,0,0]=4 13383 B15R1.888 CC(=O)CCCOc1ccc(c(c1)I)N 34a_100010084370_100000685027 [0,2,0,0,0,0|2,0,0]=4 13384 B15R1.888 CC(=O)CCCOc1ccc(c(c1)I)N 7a_100010084370_100011215641 [0,2,0,0,0,0|2,0,0]=4 13385 B15R1.888 CC(=O)CCCOc1ccc(c(c1)N)Br 34a_100011999798_100000685027 [0,2,0,0,0,0|2,0,0]=4 13386 B15R1.888 CC(=O)CCCOc1ccc(c(c1)N)Br 7a_100011999798_100011215641 [0,2,0,0,0,0|2,0,0]=4 13387 B15R1.888 CC(=O)CCCOc1ccc(c(c1)N)C 34a_100011216113_100000685027 [0,2,0,0,0,0|2,0,0]=4 13388 B15R1.888 CC(=O)CCCOc1ccc(c(c1)N)C 7a_100011216113_100011215641 [0,2,0,0,0,0|2,0,0]=4 13389 B15R1.888 CC(=O)CCCOc1ccc(c(c1)N)Cl 34a_100011934297_100000685027 [0,2,0,0,0,0|2,0,0]=4 13390 B15R1.888 CC(=O)CCCOc1ccc(c(c1)N)F 34a_100012017239_100000685027 [0,2,0,0,0,0|2,0,0]=4 13391 B15R1.888 CC(=O)CCCOc1ccc(c(c1)N)F 7a_100012017239_100011215641 [0,2,0,0,0,0|2,0,0]=4 13392 B15R1.888 CC(=O)CCCOc1ccc(c(c1)N)N 34a_100025771000_100000685027 [0,2,0,0,0,0|2,0,0]=4 13393 B15R1.888 CC(=O)CCCSc1ccc(c(c1)Br)Br 62a_100011215641_100012356285 [0,2,0,0,0,0|2,0,0]=4 13394 B15R1.888 CC(=O)CCCSc1ccc(c(c1)Br)Br 62a_100012356285_100011215641 [0,2,0,0,0,0|2,0,0]=4 13395 B15R1.888 CC(=O)CCCSc1ccc(c(c1)Br)C 62a_100011215641_100011847877 [0,2,0,0,0,0|2,0,0]=4 13396 B15R1.888 CC(=O)CCCSc1ccc(c(c1)Br)C 62a_100011847877_100011215641 [0,2,0,0,0,0|2,0,0]=4 13397 B15R1.888 CC(=O)CCCSc1ccc(c(c1)Br)Cl 62a_100011215641_100012353702 [0,2,0,0,0,0|2,0,0]=4 13398 B15R1.888 CC(=O)CCCSc1ccc(c(c1)Br)Cl 62a_100012353702_100011215641 [0,2,0,0,0,0|2,0,0]=4 13399 B15R1.888 CC(=O)CCCSc1ccc(c(c1)Br)F 62a_100011215641_100012047266 [0,2,0,0,0,0|2,0,0]=4 13400 B15R1.888 CC(=O)CCCSc1ccc(c(c1)Br)F 62a_100012047266_100011215641 [0,2,0,0,0,0|2,0,0]=4 13401 B15R1.888 CC(=O)CCCSc1ccc(c(c1)Br)N 62a_100000750455_100011215641 [0,2,0,0,0,0|2,0,0]=4 13402 B15R1.888 CC(=O)CCCSc1ccc(c(c1)Br)N 62a_100011215641_100000750455 [0,2,0,0,0,0|2,0,0]=4 13403 B15R1.888 CC(=O)CCCSc1ccc(c(c1)Br)O 62a_100011215641_100012361655 [0,2,0,0,0,0|2,0,0]=4 13404 B15R1.888 CC(=O)CCCSc1ccc(c(c1)Br)O 62a_100012361655_100011215641 [0,2,0,0,0,0|2,0,0]=4 13405 B15R1.888 CC(=O)CCCSc1ccc(c(c1)C)Br 62a_100009813585_100011215641 [0,2,0,0,0,0|2,0,0]=4 13406 B15R1.888 CC(=O)CCCSc1ccc(c(c1)C)Br 62a_100011215641_100009813585 [0,2,0,0,0,0|2,0,0]=4 13407 B15R1.888 CC(=O)CCCSc1ccc(c(c1)C)C 62a_100011215607_100011215641 [0,2,0,0,0,0|2,0,0]=4 13408 B15R1.888 CC(=O)CCCSc1ccc(c(c1)C)C 62a_100011215641_100011215607 [0,2,0,0,0,0|2,0,0]=4 13409 B15R1.888 CC(=O)CCCSc1ccc(c(c1)C)Cl 62a_100000049509_100011215641 [0,2,0,0,0,0|2,0,0]=4 13410 B15R1.888 CC(=O)CCCSc1ccc(c(c1)C)Cl 62a_100011215641_100000049509 [0,2,0,0,0,0|2,0,0]=4 13411 B15R1.888 CC(=O)CCCSc1ccc(c(c1)C)F 62a_100011215641_100011218330 [0,2,0,0,0,0|2,0,0]=4 13412 B15R1.888 CC(=O)CCCSc1ccc(c(c1)C)F 62a_100011218330_100011215641 [0,2,0,0,0,0|2,0,0]=4 13413 B15R1.888 CC(=O)CCCSc1ccc(c(c1)C)N 62a_100000211769_100011215641 [0,2,0,0,0,0|2,0,0]=4 13414 B15R1.888 CC(=O)CCCSc1ccc(c(c1)C)N 62a_100011215641_100000211769 [0,2,0,0,0,0|2,0,0]=4 13415 B15R1.888 CC(=O)CCCSc1ccc(c(c1)C)O 62a_100011215641_100000186361 [0,2,0,0,0,0|2,0,0]=4 13416 B15R1.888 CC(=O)CCCSc1ccc(c(c1)Cl)Br 62a_100011215641_100012047281 [0,2,0,0,0,0|2,0,0]=4 13417 B15R1.888 CC(=O)CCCSc1ccc(c(c1)Cl)Br 62a_100012047281_100011215641 [0,2,0,0,0,0|2,0,0]=4 13418 B15R1.888 CC(=O)CCCSc1ccc(c(c1)Cl)C 62a_100011215641_100011216363 [0,2,0,0,0,0|2,0,0]=4 13419 B15R1.888 CC(=O)CCCSc1ccc(c(c1)Cl)C 62a_100011216363_100011215641 [0,2,0,0,0,0|2,0,0]=4 13420 B15R1.888 CC(=O)CCCSc1ccc(c(c1)Cl)Cl 62a_100011214914_100011215641 [0,2,0,0,0,0|2,0,0]=4 13421 B15R1.888 CC(=O)CCCSc1ccc(c(c1)Cl)Cl 62a_100011215641_100011214914 [0,2,0,0,0,0|2,0,0]=4 13422 B15R1.888 CC(=O)CCCSc1ccc(c(c1)Cl)F 62a_100011215641_100011215976 [0,2,0,0,0,0|2,0,0]=4 13423 B15R1.888 CC(=O)CCCSc1ccc(c(c1)Cl)F 62a_100011215976_100011215641 [0,2,0,0,0,0|2,0,0]=4 13424 B15R1.888 CC(=O)CCCSc1ccc(c(c1)Cl)N 62a_100011215641_100011218065 [0,2,0,0,0,0|2,0,0]=4 13425 B15R1.888 CC(=O)CCCSc1ccc(c(c1)Cl)N 62a_100011218065_100011215641 [0,2,0,0,0,0|2,0,0]=4 13426 B15R1.888 CC(=O)CCCSc1ccc(c(c1)Cl)O 62a_100011215641_100012360047 [0,2,0,0,0,0|2,0,0]=4 13427 B15R1.888 CC(=O)CCCSc1ccc(c(c1)Cl)O 62a_100012360047_100011215641 [0,2,0,0,0,0|2,0,0]=4 13428 B15R1.888 CC(=O)CCCSc1ccc(c(c1)F)Br 62a_100000685389_100011215641 [0,2,0,0,0,0|2,0,0]=4 13429 B15R1.888 CC(=O)CCCSc1ccc(c(c1)F)Br 62a_100011215641_100000685389 [0,2,0,0,0,0|2,0,0]=4 13430 B15R1.888 CC(=O)CCCSc1ccc(c(c1)F)C 62a_100000720648_100011215641 [0,2,0,0,0,0|2,0,0]=4 13431 B15R1.888 CC(=O)CCCSc1ccc(c(c1)F)C 62a_100011215641_100000720648 [0,2,0,0,0,0|2,0,0]=4 13432 B15R1.888 CC(=O)CCCSc1ccc(c(c1)F)Cl 62a_100011215641_100011216805 [0,2,0,0,0,0|2,0,0]=4 13433 B15R1.888 CC(=O)CCCSc1ccc(c(c1)F)Cl 62a_100011216805_100011215641 [0,2,0,0,0,0|2,0,0]=4 13434 B15R1.888 CC(=O)CCCSc1ccc(c(c1)F)F 62a_100000703953_100011215641 [0,2,0,0,0,0|2,0,0]=4 13435 B15R1.888 CC(=O)CCCSc1ccc(c(c1)F)F 62a_100011215641_100000703953 [0,2,0,0,0,0|2,0,0]=4 13436 B15R1.888 CC(=O)CCCSc1ccc(c(c1)F)N 62a_100011215594_100011215641 [0,2,0,0,0,0|2,0,0]=4 13437 B15R1.888 CC(=O)CCCSc1ccc(c(c1)F)N 62a_100011215641_100011215594 [0,2,0,0,0,0|2,0,0]=4 13438 B15R1.888 CC(=O)CCCSc1ccc(c(c1)F)O 62a_100000185481_100011215641 [0,2,0,0,0,0|2,0,0]=4 13439 B15R1.888 CC(=O)CCCSc1ccc(c(c1)F)O 62a_100011215641_100000185481 [0,2,0,0,0,0|2,0,0]=4 13440 B15R1.888 CC(=O)CCCSc1ccc(c(c1)N)Br 62a_100000750456_100011215641 [0,2,0,0,0,0|2,0,0]=4 13441 B15R1.888 CC(=O)CCCSc1ccc(c(c1)N)Br 62a_100011215641_100000750456 [0,2,0,0,0,0|2,0,0]=4 13442 B15R1.888 CC(=O)CCCSc1ccc(c(c1)N)C 62a_100000761890_100011215641 [0,2,0,0,0,0|2,0,0]=4 13443 B15R1.888 CC(=O)CCCSc1ccc(c(c1)N)C 62a_100011215641_100000761890 [0,2,0,0,0,0|2,0,0]=4 13444 B15R1.888 CC(=O)CCCSc1ccc(c(c1)N)Cl 62a_100011215641_200000761891 [0,2,0,0,0,0|2,0,0]=4 13445 B15R1.888 CC(=O)CCCSc1ccc(c(c1)N)Cl 62a_200000761891_100011215641 [0,2,0,0,0,0|2,0,0]=4 13446 B15R1.888 CC(=O)CCCSc1ccc(c(c1)N)F 62a_100000740924_100011215641 [0,2,0,0,0,0|2,0,0]=4 13447 B15R1.888 CC(=O)CCCSc1ccc(c(c1)N)F 62a_100011215641_100000740924 [0,2,0,0,0,0|2,0,0]=4 13448 B15R1.888 CC(=O)CCCSc1ccc(c(c1)N)N 62a_100000741789_100011215641 [0,2,0,0,0,0|2,0,0]=4 13449 B15R1.888 CC(=O)CCCSc1ccc(c(c1)N)N 62a_100011215641_100011534411 [0,2,0,0,0,0|2,0,0]=4 13450 B15R1.888 CC(=O)CCCSc1ccc(c(c1)N)O 62a_100000752626_100011215641 [0,2,0,0,0,0|2,0,0]=4 13451 B15R1.888 CC(=O)CCCSc1ccc(c(c1)N)O 62a_100011215641_100000752626 [0,2,0,0,0,0|2,0,0]=4 13452 B15R1.888 CC(=O)CCCSc1ccc(c(c1)O)Br 62a_100011215641_100012356990 [0,2,0,0,0,0|2,0,0]=4 13453 B15R1.888 CC(=O)CCCSc1ccc(c(c1)O)Br 62a_100012356990_100011215641 [0,2,0,0,0,0|2,0,0]=4 13454 B15R1.888 CC(=O)CCCSc1ccc(c(c1)O)C 62a_100000685420_100011215641 [0,2,0,0,0,0|2,0,0]=4 13455 B15R1.888 CC(=O)CCCSc1ccc(c(c1)O)C 62a_100011215641_100000685420 [0,2,0,0,0,0|2,0,0]=4 13456 B15R1.888 CC(=O)CCCSc1ccc(c(c1)O)Cl 62a_100011215641_100011356854 [0,2,0,0,0,0|2,0,0]=4 13457 B15R1.888 CC(=O)CCCSc1ccc(c(c1)O)Cl 62a_100011356854_100011215641 [0,2,0,0,0,0|2,0,0]=4 13458 B15R1.888 CC(=O)CCCSc1ccc(c(c1)O)F 62a_100000686035_100011215641 [0,2,0,0,0,0|2,0,0]=4 13459 B15R1.888 CC(=O)CCCSc1ccc(c(c1)O)F 62a_100011215641_100000686035 [0,2,0,0,0,0|2,0,0]=4 13460 B15R1.888 CC(=O)CCCSc1ccc(c(c1)O)N 62a_100000739049_100011215641 [0,2,0,0,0,0|2,0,0]=4 13461 B15R1.888 CC(=O)CCCSc1ccc(c(c1)O)N 62a_100011215641_100000739049 [0,2,0,0,0,0|2,0,0]=4 13462 B15R1.888 CC(=O)CCCSc1ccc(c(c1)O)O 62a_100011215641_100009813601 [0,2,0,0,0,0|2,0,0]=4 13463 B15R1.888 CC(=O)CCOCc1ccc(c(c1)Br)Br 34a_100000759926_100012353900 [0,2,0,0,0,0|2,0,0]=4 13464 B15R1.888 CC(=O)CCOCc1ccc(c(c1)Br)Br 7a_100000759926_100012353900 [0,2,0,0,0,0|2,0,0]=4 13465 B15R1.888 CC(=O)CCOCc1ccc(c(c1)Br)C 34a_100000759926_100012232412 [0,2,0,0,0,0|2,0,0]=4 13466 B15R1.888 CC(=O)CCOCc1ccc(c(c1)Br)C 7a_100000708995_100000053229 [0,2,0,0,0,0|2,0,0]=4 13467 B15R1.888 CC(=O)CCOCc1ccc(c(c1)Br)C 7a_100000759926_100012232412 [0,2,0,0,0,0|2,0,0]=4 13468 B15R1.888 CC(=O)CCOCc1ccc(c(c1)Br)Cl 34a_100000759926_100012353894 [0,2,0,0,0,0|2,0,0]=4 13469 B15R1.888 CC(=O)CCOCc1ccc(c(c1)Br)Cl 7a_100000759926_100012353894 [0,2,0,0,0,0|2,0,0]=4 13470 B15R1.888 CC(=O)CCOCc1ccc(c(c1)Br)Cl 7a_100012353893_100000053229 [0,2,0,0,0,0|2,0,0]=4 13471 B15R1.888 CC(=O)CCOCc1ccc(c(c1)Br)F 34a_100000759926_100011206884 [0,2,0,0,0,0|2,0,0]=4 13472 B15R1.888 CC(=O)CCOCc1ccc(c(c1)Br)F 7a_100000246287_100000053229 [0,2,0,0,0,0|2,0,0]=4 13473 B15R1.888 CC(=O)CCOCc1ccc(c(c1)Br)F 7a_100000759926_100011206884 [0,2,0,0,0,0|2,0,0]=4 13474 B15R1.888 CC(=O)CCOCc1ccc(c(c1)C)Br 34a_100000759926_100000727479 [0,2,0,0,0,0|2,0,0]=4 13475 B15R1.888 CC(=O)CCOCc1ccc(c(c1)C)Br 7a_100000718852_100000053229 [0,2,0,0,0,0|2,0,0]=4 13476 B15R1.888 CC(=O)CCOCc1ccc(c(c1)C)Br 7a_100000759926_100000727479 [0,2,0,0,0,0|2,0,0]=4 13477 B15R1.888 CC(=O)CCOCc1ccc(c(c1)C)C 34a_100000759926_100000742320 [0,2,0,0,0,0|2,0,0]=4 13478 B15R1.888 CC(=O)CCOCc1ccc(c(c1)C)C 7a_100000759926_100000742320 [0,2,0,0,0,0|2,0,0]=4 13479 B15R1.888 CC(=O)CCOCc1ccc(c(c1)C)C 7a_100011215342_100000053229 [0,2,0,0,0,0|2,0,0]=4 13480 B15R1.888 CC(=O)CCOCc1ccc(c(c1)C)Cl 34a_100000759926_100012184735 [0,2,0,0,0,0|2,0,0]=4 13481 B15R1.888 CC(=O)CCOCc1ccc(c(c1)C)Cl 7a_100000759926_100012184735 [0,2,0,0,0,0|2,0,0]=4 13482 B15R1.888 CC(=O)CCOCc1ccc(c(c1)C)F 34a_100000759926_100011216667 [0,2,0,0,0,0|2,0,0]=4 13483 B15R1.888 CC(=O)CCOCc1ccc(c(c1)C)F 7a_100000759926_100011216667 [0,2,0,0,0,0|2,0,0]=4 13484 B15R1.888 CC(=O)CCOCc1ccc(c(c1)C)F 7a_100011219793_100000053229 [0,2,0,0,0,0|2,0,0]=4 13485 B15R1.888 CC(=O)CCOCc1ccc(c(c1)Cl)Br 34a_100000759926_100012353895 [0,2,0,0,0,0|2,0,0]=4 13486 B15R1.888 CC(=O)CCOCc1ccc(c(c1)Cl)Br 7a_100000709168_100000053229 [0,2,0,0,0,0|2,0,0]=4 13487 B15R1.888 CC(=O)CCOCc1ccc(c(c1)Cl)Br 7a_100000759926_100012353895 [0,2,0,0,0,0|2,0,0]=4 13488 B15R1.888 CC(=O)CCOCc1ccc(c(c1)Cl)C 34a_100000759926_100011823929 [0,2,0,0,0,0|2,0,0]=4 13489 B15R1.888 CC(=O)CCOCc1ccc(c(c1)Cl)C 7a_100000759926_100011823929 [0,2,0,0,0,0|2,0,0]=4 13490 B15R1.888 CC(=O)CCOCc1ccc(c(c1)Cl)C 7a_100011290783_100000053229 [0,2,0,0,0,0|2,0,0]=4 13491 B15R1.888 CC(=O)CCOCc1ccc(c(c1)Cl)Cl 34a_100000759926_100000184707 [0,2,0,0,0,0|2,0,0]=4 13492 B15R1.888 CC(=O)CCOCc1ccc(c(c1)Cl)Cl 7a_100000211588_100000053229 [0,2,0,0,0,0|2,0,0]=4 13493 B15R1.888 CC(=O)CCOCc1ccc(c(c1)Cl)Cl 7a_100000759926_100000184707 [0,2,0,0,0,0|2,0,0]=4 13494 B15R1.888 CC(=O)CCOCc1ccc(c(c1)Cl)F 34a_100000759926_100011934319 [0,2,0,0,0,0|2,0,0]=4 13495 B15R1.888 CC(=O)CCOCc1ccc(c(c1)Cl)F 7a_100000759926_100000717365 [0,2,0,0,0,0|2,0,0]=4 13496 B15R1.888 CC(=O)CCOCc1ccc(c(c1)Cl)F 7a_100011217911_100000053229 [0,2,0,0,0,0|2,0,0]=4 13497 B15R1.888 CC(=O)CCOCc1ccc(c(c1)Cl)I 34a_100000759926_100012349665 [0,2,0,0,0,0|2,0,0]=4 13498 B15R1.888 CC(=O)CCOCc1ccc(c(c1)Cl)I 7a_100000718186_100000053229 [0,2,0,0,0,0|2,0,0]=4 13499 B15R1.888 CC(=O)CCOCc1ccc(c(c1)Cl)I 7a_100000759926_100012349665 [0,2,0,0,0,0|2,0,0]=4 13500 B15R1.888 CC(=O)CCOCc1ccc(c(c1)F)Br 34a_100000759926_100000767054 [0,2,0,0,0,0|2,0,0]=4 13501 B15R1.888 CC(=O)CCOCc1ccc(c(c1)F)Br 7a_100000759926_100000767054 [0,2,0,0,0,0|2,0,0]=4 13502 B15R1.888 CC(=O)CCOCc1ccc(c(c1)F)Br 7a_100011533735_100000053229 [0,2,0,0,0,0|2,0,0]=4 13503 B15R1.888 CC(=O)CCOCc1ccc(c(c1)F)C 34a_100000759926_100011217369 [0,2,0,0,0,0|2,0,0]=4 13504 B15R1.888 CC(=O)CCOCc1ccc(c(c1)F)C 7a_100000702247_100000053229 [0,2,0,0,0,0|2,0,0]=4 13505 B15R1.888 CC(=O)CCOCc1ccc(c(c1)F)C 7a_100000759926_100011217369 [0,2,0,0,0,0|2,0,0]=4 13506 B15R1.888 CC(=O)CCOCc1ccc(c(c1)F)Cl 34a_100000759926_100011519011 [0,2,0,0,0,0|2,0,0]=4 13507 B15R1.888 CC(=O)CCOCc1ccc(c(c1)F)Cl 7a_100000759926_100000716492 [0,2,0,0,0,0|2,0,0]=4 13508 B15R1.888 CC(=O)CCOCc1ccc(c(c1)F)Cl 7a_100011218299_100000053229 [0,2,0,0,0,0|2,0,0]=4 13509 B15R1.888 CC(=O)CCOCc1ccc(c(c1)F)F 34a_100000759926_100000757363 [0,2,0,0,0,0|2,0,0]=4 13510 B15R1.888 CC(=O)CCOCc1ccc(c(c1)F)F 7a_100000759926_100000757363 [0,2,0,0,0,0|2,0,0]=4 13511 B15R1.888 CC(=O)CCOCc1ccc(c(c1)F)F 7a_100011215442_100000053229 [0,2,0,0,0,0|2,0,0]=4 13512 B15R1.888 CC(=O)CCOCc1ccc(c(c1)F)I 34a_100000759926_100010149604 [0,2,0,0,0,0|2,0,0]=4 13513 B15R1.888 CC(=O)CCOCc1ccc(c(c1)F)I 7a_100000759926_100010149604 [0,2,0,0,0,0|2,0,0]=4 13514 B15R1.888 CC(=O)CCOCc1ccc(c(c1)F)I 7a_100010149597_100000053229 [0,2,0,0,0,0|2,0,0]=4 13515 B15R1.888 CC(=O)CCOCc1ccc(c(c1)I)Br 34a_100000759926_100010146616 [0,2,0,0,0,0|2,0,0]=4 13516 B15R1.888 CC(=O)CCOCc1ccc(c(c1)I)Br 7a_100000759926_100010146616 [0,2,0,0,0,0|2,0,0]=4 13517 B15R1.888 CC(=O)CCOCc1ccc(c(c1)I)C 34a_100000759926_100010206137 [0,2,0,0,0,0|2,0,0]=4 13518 B15R1.888 CC(=O)CCOCc1ccc(c(c1)I)C 7a_100000050133_100000053229 [0,2,0,0,0,0|2,0,0]=4 13519 B15R1.888 CC(=O)CCOCc1ccc(c(c1)I)C 7a_100000759926_100010206137 [0,2,0,0,0,0|2,0,0]=4 13520 B15R1.888 CC(=O)CCOCc1ccc(c(c1)I)F 34a_100000759926_100010188208 [0,2,0,0,0,0|2,0,0]=4 13521 B15R1.888 CC(=O)CCOCc1ccc(c(c1)I)F 7a_100000049585_100000053229 [0,2,0,0,0,0|2,0,0]=4 13522 B15R1.888 CC(=O)CCOCc1ccc(c(c1)I)F 7a_100000759926_100010188208 [0,2,0,0,0,0|2,0,0]=4 13523 B15R1.888 CC(=O)CCSCc1ccc(c(c1)Br)Br 62a_100000053229_100012353900 [0,2,0,0,0,0|2,0,0]=4 13524 B15R1.888 CC(=O)CCSCc1ccc(c(c1)Br)Br 62a_100012353900_100000053229 [0,2,0,0,0,0|2,0,0]=4 13525 B15R1.888 CC(=O)CCSCc1ccc(c(c1)Br)C 62a_100000053229_100012232412 [0,2,0,0,0,0|2,0,0]=4 13526 B15R1.888 CC(=O)CCSCc1ccc(c(c1)Br)C 62a_100012232412_100000053229 [0,2,0,0,0,0|2,0,0]=4 13527 B15R1.888 CC(=O)CCSCc1ccc(c(c1)Br)Cl 62a_100000053229_100012353894 [0,2,0,0,0,0|2,0,0]=4 13528 B15R1.888 CC(=O)CCSCc1ccc(c(c1)Br)Cl 62a_100012353894_100000053229 [0,2,0,0,0,0|2,0,0]=4 13529 B15R1.888 CC(=O)CCSCc1ccc(c(c1)Br)F 62a_100000053229_100011206884 [0,2,0,0,0,0|2,0,0]=4 13530 B15R1.888 CC(=O)CCSCc1ccc(c(c1)Br)F 62a_100011206884_100000053229 [0,2,0,0,0,0|2,0,0]=4 13531 B15R1.888 CC(=O)CCSCc1ccc(c(c1)C)Br 62a_100000053229_100000727479 [0,2,0,0,0,0|2,0,0]=4 13532 B15R1.888 CC(=O)CCSCc1ccc(c(c1)C)Br 62a_100000727479_100000053229 [0,2,0,0,0,0|2,0,0]=4 13533 B15R1.888 CC(=O)CCSCc1ccc(c(c1)C)C 62a_100000053229_100000742320 [0,2,0,0,0,0|2,0,0]=4 13534 B15R1.888 CC(=O)CCSCc1ccc(c(c1)C)C 62a_100000742320_100000053229 [0,2,0,0,0,0|2,0,0]=4 13535 B15R1.888 CC(=O)CCSCc1ccc(c(c1)C)Cl 62a_100000053229_100012184735 [0,2,0,0,0,0|2,0,0]=4 13536 B15R1.888 CC(=O)CCSCc1ccc(c(c1)C)Cl 62a_100012184735_100000053229 [0,2,0,0,0,0|2,0,0]=4 13537 B15R1.888 CC(=O)CCSCc1ccc(c(c1)C)F 62a_100000053229_100011216667 [0,2,0,0,0,0|2,0,0]=4 13538 B15R1.888 CC(=O)CCSCc1ccc(c(c1)C)F 62a_100011216667_100000053229 [0,2,0,0,0,0|2,0,0]=4 13539 B15R1.888 CC(=O)CCSCc1ccc(c(c1)Cl)Br 62a_100000053229_100012353895 [0,2,0,0,0,0|2,0,0]=4 13540 B15R1.888 CC(=O)CCSCc1ccc(c(c1)Cl)Br 62a_100012353895_100000053229 [0,2,0,0,0,0|2,0,0]=4 13541 B15R1.888 CC(=O)CCSCc1ccc(c(c1)Cl)C 62a_100000053229_100011823929 [0,2,0,0,0,0|2,0,0]=4 13542 B15R1.888 CC(=O)CCSCc1ccc(c(c1)Cl)C 62a_100011823929_100000053229 [0,2,0,0,0,0|2,0,0]=4 13543 B15R1.888 CC(=O)CCSCc1ccc(c(c1)Cl)Cl 62a_100000053229_100000184707 [0,2,0,0,0,0|2,0,0]=4 13544 B15R1.888 CC(=O)CCSCc1ccc(c(c1)Cl)Cl 62a_100000184707_100000053229 [0,2,0,0,0,0|2,0,0]=4 13545 B15R1.888 CC(=O)CCSCc1ccc(c(c1)Cl)F 62a_100000053229_100011934319 [0,2,0,0,0,0|2,0,0]=4 13546 B15R1.888 CC(=O)CCSCc1ccc(c(c1)Cl)F 62a_100000717365_100000053229 [0,2,0,0,0,0|2,0,0]=4 13547 B15R1.888 CC(=O)CCSCc1ccc(c(c1)Cl)I 62a_100000053229_100012349665 [0,2,0,0,0,0|2,0,0]=4 13548 B15R1.888 CC(=O)CCSCc1ccc(c(c1)Cl)I 62a_100012349665_100000053229 [0,2,0,0,0,0|2,0,0]=4 13549 B15R1.888 CC(=O)CCSCc1ccc(c(c1)F)Br 62a_100000053229_100000767054 [0,2,0,0,0,0|2,0,0]=4 13550 B15R1.888 CC(=O)CCSCc1ccc(c(c1)F)Br 62a_100000767054_100000053229 [0,2,0,0,0,0|2,0,0]=4 13551 B15R1.888 CC(=O)CCSCc1ccc(c(c1)F)C 62a_100000053229_100011217369 [0,2,0,0,0,0|2,0,0]=4 13552 B15R1.888 CC(=O)CCSCc1ccc(c(c1)F)C 62a_100011217369_100000053229 [0,2,0,0,0,0|2,0,0]=4 13553 B15R1.888 CC(=O)CCSCc1ccc(c(c1)F)Cl 62a_100000053229_100000716492 [0,2,0,0,0,0|2,0,0]=4 13554 B15R1.888 CC(=O)CCSCc1ccc(c(c1)F)Cl 62a_100000716492_100000053229 [0,2,0,0,0,0|2,0,0]=4 13555 B15R1.888 CC(=O)CCSCc1ccc(c(c1)F)F 62a_100000053229_100000757363 [0,2,0,0,0,0|2,0,0]=4 13556 B15R1.888 CC(=O)CCSCc1ccc(c(c1)F)F 62a_100000757363_100000053229 [0,2,0,0,0,0|2,0,0]=4 13557 B15R1.888 CC(=O)CCSCc1ccc(c(c1)F)I 62a_100000053229_100010149604 [0,2,0,0,0,0|2,0,0]=4 13558 B15R1.888 CC(=O)CCSCc1ccc(c(c1)F)I 62a_100010149604_100000053229 [0,2,0,0,0,0|2,0,0]=4 13559 B15R1.888 CC(=O)CCSCc1ccc(c(c1)I)Br 62a_100000053229_100010146616 [0,2,0,0,0,0|2,0,0]=4 13560 B15R1.888 CC(=O)CCSCc1ccc(c(c1)I)Br 62a_100010146616_100000053229 [0,2,0,0,0,0|2,0,0]=4 13561 B15R1.888 CC(=O)CCSCc1ccc(c(c1)I)C 62a_100000053229_100010206137 [0,2,0,0,0,0|2,0,0]=4 13562 B15R1.888 CC(=O)CCSCc1ccc(c(c1)I)C 62a_100010206137_100000053229 [0,2,0,0,0,0|2,0,0]=4 13563 B15R1.888 CC(=O)CCSCc1ccc(c(c1)I)F 62a_100000053229_100010188208 [0,2,0,0,0,0|2,0,0]=4 13564 B15R1.888 CC(=O)CCSCc1ccc(c(c1)I)F 62a_100010188208_100000053229 [0,2,0,0,0,0|2,0,0]=4 13565 B15R1.888 CC(=O)COCCc1ccc(c(c1)Cl)Cl 34a_100000211253_100011713676 [0,2,0,0,0,0|2,0,0]=4 13566 B15R1.888 CC(=O)COCCc1ccc(c(c1)Cl)F 34a_100000211253_100012361305 [0,2,0,0,0,0|2,0,0]=4 13567 B15R1.888 CC(=O)COCCc1ccc(c(c1)F)F 34a_100000211253_100000690553 [0,2,0,0,0,0|2,0,0]=4 13568 B15R1.888 Cc1cc(ccc1Br)CNCCC(=O)N 207a_100000740010_100000765772 [0,2,0,0,0,0|2,0,0]=4 13569 B15R1.888 Cc1cc(ccc1Br)CNCCC(=O)N 2230a_100015205234_100000744528 [0,2,0,0,0,0|2,0,0]=4 13570 B15R1.888 Cc1cc(ccc1Br)CNCCC(=O)N 34a_100015205234_100000731001 [0,2,0,0,0,0|2,0,0]=4 13571 B15R1.888 Cc1cc(ccc1Br)CNOCC(=O)O 269956a_100000106656_100000727479 [0,2,0,0,0,0|2,0,0]=4 13572 B15R1.888 Cc1cc(ccc1Br)COCCC(=O)N 34a_100000718852_100000731001 [0,2,0,0,0,0|2,0,0]=4 13573 B15R1.888 Cc1cc(ccc1Br)COCCC(=O)N 34a_100000757172_100000727479 [0,2,0,0,0,0|2,0,0]=4 13574 B15R1.888 Cc1cc(ccc1Br)COCCC(=O)N 7a_100000718852_100000744528 [0,2,0,0,0,0|2,0,0]=4 13575 B15R1.888 Cc1cc(ccc1Br)COCCC(=O)N 7a_100000757172_100000727479 [0,2,0,0,0,0|2,0,0]=4 13576 B15R1.888 Cc1cc(ccc1Br)CSCCC(=O)N 62a_100000727479_100000744528 [0,2,0,0,0,0|2,0,0]=4 13577 B15R1.888 Cc1cc(ccc1Br)CSCCC(=O)N 62a_100000744528_100000727479 [0,2,0,0,0,0|2,0,0]=4 13578 B15R1.888 Cc1cc(ccc1Br)NCCCC(=O)N 34a_100000210723_100102525003 [0,2,0,0,0,0|2,0,0]=4 13579 B15R1.888 Cc1cc(ccc1Br)NCCCC(=O)N 7a_100000210723_100102525003 [0,2,0,0,0,0|2,0,0]=4 13580 B15R1.888 Cc1cc(ccc1Br)OCCCC(=O)N 34a_100000690111_100102525003 [0,2,0,0,0,0|2,0,0]=4 13581 B15R1.888 Cc1cc(ccc1Br)OCCCC(=O)N 7a_100000690111_100102525003 [0,2,0,0,0,0|2,0,0]=4 13582 B15R1.888 Cc1cc(ccc1Br)SCCCC(=O)N 62a_100009813585_100102525003 [0,2,0,0,0,0|2,0,0]=4 13583 B15R1.888 Cc1cc(ccc1Br)SCCCC(=O)N 62a_100102525003_100009813585 [0,2,0,0,0,0|2,0,0]=4 13584 B15R1.888 Cc1cc(ccc1Cl)CNCCC(=O)N 207a_100000740010_100000698814 [0,2,0,0,0,0|2,0,0]=4 13585 B15R1.888 Cc1cc(ccc1Cl)CNOCC(=O)O 269956a_100000106656_100012184735 [0,2,0,0,0,0|2,0,0]=4 13586 B15R1.888 Cc1cc(ccc1Cl)COCCC(=O)N 34a_100000757172_100012184735 [0,2,0,0,0,0|2,0,0]=4 13587 B15R1.888 Cc1cc(ccc1Cl)COCCC(=O)N 7a_100000757172_100012184735 [0,2,0,0,0,0|2,0,0]=4 13588 B15R1.888 Cc1cc(ccc1Cl)CSCCC(=O)N 62a_100000744528_100012184735 [0,2,0,0,0,0|2,0,0]=4 13589 B15R1.888 Cc1cc(ccc1Cl)CSCCC(=O)N 62a_100012184735_100000744528 [0,2,0,0,0,0|2,0,0]=4 13590 B15R1.888 Cc1cc(ccc1Cl)NCCCC(=O)N 34a_100000187808_100102525003 [0,2,0,0,0,0|2,0,0]=4 13591 B15R1.888 Cc1cc(ccc1Cl)NCCCC(=O)N 7a_100000187808_100102525003 [0,2,0,0,0,0|2,0,0]=4 13592 B15R1.888 Cc1cc(ccc1Cl)OCCCC(=O)N 34a_100000211092_100102525003 [0,2,0,0,0,0|2,0,0]=4 13593 B15R1.888 Cc1cc(ccc1Cl)OCCCC(=O)N 7a_100000211092_100102525003 [0,2,0,0,0,0|2,0,0]=4 13594 B15R1.888 Cc1cc(ccc1Cl)OCCCC(=O)[13CH3] 1458a_100000182829_200025704644 [0,2,0,0,0,0|2,0,0]=4 13595 B15R1.888 Cc1cc(ccc1Cl)SCCCC(=O)N 62a_100000049509_100102525003 [0,2,0,0,0,0|2,0,0]=4 13596 B15R1.888 Cc1cc(ccc1Cl)SCCCC(=O)N 62a_100102525003_100000049509 [0,2,0,0,0,0|2,0,0]=4 13597 B15R1.888 Cc1cc(ccc1F)CNCCC(=O)N 207a_100000740010_100000748208 [0,2,0,0,0,0|2,0,0]=4 13598 B15R1.888 Cc1cc(ccc1F)CNCCC(=O)N 2230a_100000239911_100000744528 [0,2,0,0,0,0|2,0,0]=4 13599 B15R1.888 Cc1cc(ccc1F)CNCCC(=O)N 34a_100000239911_100000731001 [0,2,0,0,0,0|2,0,0]=4 13600 B15R1.888 Cc1cc(ccc1F)CNOCC(=O)O 269956a_100000106656_100011216667 [0,2,0,0,0,0|2,0,0]=4 13601 B15R1.888 Cc1cc(ccc1F)COCCC(=O)N 34a_100000757172_100011216667 [0,2,0,0,0,0|2,0,0]=4 13602 B15R1.888 Cc1cc(ccc1F)COCCC(=O)N 34a_100011219793_100000731001 [0,2,0,0,0,0|2,0,0]=4 13603 B15R1.888 Cc1cc(ccc1F)COCCC(=O)N 7a_100000757172_100011216667 [0,2,0,0,0,0|2,0,0]=4 13604 B15R1.888 Cc1cc(ccc1F)COCCC(=O)N 7a_100011219793_100000744528 [0,2,0,0,0,0|2,0,0]=4 13605 B15R1.888 Cc1cc(ccc1F)CSCCC(=O)N 62a_100000744528_100011216667 [0,2,0,0,0,0|2,0,0]=4 13606 B15R1.888 Cc1cc(ccc1F)CSCCC(=O)N 62a_100011216667_100000744528 [0,2,0,0,0,0|2,0,0]=4 13607 B15R1.888 Cc1cc(ccc1F)NCCCC(=O)N 34a_100000750164_100102525003 [0,2,0,0,0,0|2,0,0]=4 13608 B15R1.888 Cc1cc(ccc1F)NCCCC(=O)N 7a_100000750164_100102525003 [0,2,0,0,0,0|2,0,0]=4 13609 B15R1.888 Cc1cc(ccc1F)OCCCC(=O)N 34a_100000751312_100102525003 [0,2,0,0,0,0|2,0,0]=4 13610 B15R1.888 Cc1cc(ccc1F)OCCCC(=O)N 7a_100000751312_100102525003 [0,2,0,0,0,0|2,0,0]=4 13611 B15R1.888 Cc1cc(ccc1F)SCCCC(=O)N 62a_100011218330_100102525003 [0,2,0,0,0,0|2,0,0]=4 13612 B15R1.888 Cc1cc(ccc1F)SCCCC(=O)N 62a_100102525003_100011218330 [0,2,0,0,0,0|2,0,0]=4 13613 B15R1.888 Cc1cc(ccc1I)NCCCC(=O)N 34a_100000198070_100102525003 [0,2,0,0,0,0|2,0,0]=4 13614 B15R1.888 Cc1cc(ccc1I)NCCCC(=O)N 7a_100000198070_100102525003 [0,2,0,0,0,0|2,0,0]=4 13615 B15R1.888 Cc1cc(ccc1I)OCCCC(=O)N 34a_100000729255_100102525003 [0,2,0,0,0,0|2,0,0]=4 13616 B15R1.888 Cc1cc(ccc1I)OCCCC(=O)N 7a_100000729255_100102525003 [0,2,0,0,0,0|2,0,0]=4 13617 B15R1.888 Cc1cc(ccc1N)COCCC(=O)N 34a_200011997030_100000731001 [0,2,0,0,0,0|2,0,0]=4 13618 B15R1.888 Cc1cc(ccc1N)OCCCC(=O)N 34a_100000756630_100102525003 [0,2,0,0,0,0|2,0,0]=4 13619 B15R1.888 Cc1cc(ccc1N)OCCCC(=O)N 7a_100000756630_100102525003 [0,2,0,0,0,0|2,0,0]=4 13620 B15R1.888 Cc1cc(ccc1N)SCCCC(=O)N 62a_100000211769_100102525003 [0,2,0,0,0,0|2,0,0]=4 13621 B15R1.888 Cc1cc(ccc1N)SCCCC(=O)N 62a_100102525003_100000211769 [0,2,0,0,0,0|2,0,0]=4 13622 B15R1.888 Cc1cc(ccc1O)NCCCC(=O)N 34a_100011218179_100102525003 [0,2,0,0,0,0|2,0,0]=4 13623 B15R1.888 Cc1cc(ccc1O)NCCCC(=O)N 7a_100011218179_100102525003 [0,2,0,0,0,0|2,0,0]=4 13624 B15R1.888 Cc1cc(ccc1O)SCCCC(=O)N 62a_100102525003_100000186361 [0,2,0,0,0,0|2,0,0]=4 13625 B15R1.888 Cc1ccc(cc1Br)CNCCC(=O)N 207a_100000740010_100000695567 [0,2,0,0,0,0|2,0,0]=4 13626 B15R1.888 Cc1ccc(cc1Br)CNOCC(=O)O 269956a_100000106656_100012232412 [0,2,0,0,0,0|2,0,0]=4 13627 B15R1.888 Cc1ccc(cc1Br)COCCC(=O)N 34a_100000708995_100000731001 [0,2,0,0,0,0|2,0,0]=4 13628 B15R1.888 Cc1ccc(cc1Br)COCCC(=O)N 34a_100000757172_100012232412 [0,2,0,0,0,0|2,0,0]=4 13629 B15R1.888 Cc1ccc(cc1Br)COCCC(=O)N 7a_100000708995_100000744528 [0,2,0,0,0,0|2,0,0]=4 13630 B15R1.888 Cc1ccc(cc1Br)COCCC(=O)N 7a_100000757172_100012232412 [0,2,0,0,0,0|2,0,0]=4 13631 B15R1.888 Cc1ccc(cc1Br)CSCCC(=O)N 62a_100000744528_100012232412 [0,2,0,0,0,0|2,0,0]=4 13632 B15R1.888 Cc1ccc(cc1Br)CSCCC(=O)N 62a_100012232412_100000744528 [0,2,0,0,0,0|2,0,0]=4 13633 B15R1.888 Cc1ccc(cc1Br)NCCCC(=O)N 34a_100000736455_100102525003 [0,2,0,0,0,0|2,0,0]=4 13634 B15R1.888 Cc1ccc(cc1Br)NCCCC(=O)N 7a_100000736455_100102525003 [0,2,0,0,0,0|2,0,0]=4 13635 B15R1.888 Cc1ccc(cc1Br)OCCCC(=O)N 34a_100011380479_100102525003 [0,2,0,0,0,0|2,0,0]=4 13636 B15R1.888 Cc1ccc(cc1Br)OCCCC(=O)N 7a_100011380479_100102525003 [0,2,0,0,0,0|2,0,0]=4 13637 B15R1.888 Cc1ccc(cc1Br)SCCCC(=O)N 62a_100011847877_100102525003 [0,2,0,0,0,0|2,0,0]=4 13638 B15R1.888 Cc1ccc(cc1Br)SCCCC(=O)N 62a_100102525003_100011847877 [0,2,0,0,0,0|2,0,0]=4 13639 B15R1.888 Cc1ccc(cc1C)CCNCC(=O)N 2230a_100020591374_100000747473 [0,2,0,0,0,0|2,0,0]=4 13640 B15R1.888 Cc1ccc(cc1C)CCNCC(=O)N 34a_100020591374_100000187820 [0,2,0,0,0,0|2,0,0]=4 13641 B15R1.888 Cc1ccc(cc1C)CCNCC(=O)[O-] 34a_100020591374_100020667443 [0,2,0,0,0,0|1,0,1]=4 13642 B15R1.888 Cc1ccc(cc1C)CNCCC(=O)N 207a_100000740010_100000229942 [0,2,0,0,0,0|2,0,0]=4 13643 B15R1.888 Cc1ccc(cc1C)CNCCC(=O)N 2230a_100025706692_100000744528 [0,2,0,0,0,0|2,0,0]=4 13644 B15R1.888 Cc1ccc(cc1C)CNCCC(=O)N 34a_100025706692_100000731001 [0,2,0,0,0,0|2,0,0]=4 13645 B15R1.888 Cc1ccc(cc1C)CNOCC(=O)O 269956a_100000106656_100000742320 [0,2,0,0,0,0|2,0,0]=4 13646 B15R1.888 Cc1ccc(cc1C)COCCC(=O)N 34a_100000757172_100000742320 [0,2,0,0,0,0|2,0,0]=4 13647 B15R1.888 Cc1ccc(cc1C)COCCC(=O)N 34a_100011215342_100000731001 [0,2,0,0,0,0|2,0,0]=4 13648 B15R1.888 Cc1ccc(cc1C)COCCC(=O)N 7a_100000757172_100000742320 [0,2,0,0,0,0|2,0,0]=4 13649 B15R1.888 Cc1ccc(cc1C)COCCC(=O)N 7a_100011215342_100000744528 [0,2,0,0,0,0|2,0,0]=4 13650 B15R1.888 Cc1ccc(cc1C)CSCCC(=O)N 62a_100000742320_100000744528 [0,2,0,0,0,0|2,0,0]=4 13651 B15R1.888 Cc1ccc(cc1C)CSCCC(=O)N 62a_100000744528_100000742320 [0,2,0,0,0,0|2,0,0]=4 13652 B15R1.888 Cc1ccc(cc1C)NCCCC(=O)N 34a_100000724040_100102525003 [0,2,0,0,0,0|2,0,0]=4 13653 B15R1.888 Cc1ccc(cc1C)NCCCC(=O)N 7a_100000724040_100102525003 [0,2,0,0,0,0|2,0,0]=4 13654 B15R1.888 Cc1ccc(cc1C)OCCCC(=O)N 34a_100000210932_100102525003 [0,2,0,0,0,0|2,0,0]=4 13655 B15R1.888 Cc1ccc(cc1C)OCCCC(=O)N 7a_100000210932_100102525003 [0,2,0,0,0,0|2,0,0]=4 13656 B15R1.888 Cc1ccc(cc1C)OCCCC(=O)[13CH3] 1458a_100000766245_200025704644 [0,2,0,0,0,0|2,0,0]=4 13657 B15R1.888 Cc1ccc(cc1C)SCCCC(=O)N 62a_100011215607_100102525003 [0,2,0,0,0,0|2,0,0]=4 13658 B15R1.888 Cc1ccc(cc1C)SCCCC(=O)N 62a_100102525003_100011215607 [0,2,0,0,0,0|2,0,0]=4 13659 B15R1.888 Cc1ccc(cc1Cl)CNCCC(=O)N 207a_100000740010_100000760539 [0,2,0,0,0,0|2,0,0]=4 13660 B15R1.888 Cc1ccc(cc1Cl)CNCCC(=O)N 2230a_102495364989_100000744528 [0,2,0,0,0,0|2,0,0]=4 13661 B15R1.888 Cc1ccc(cc1Cl)CNCCC(=O)N 34a_102495364989_100000731001 [0,2,0,0,0,0|2,0,0]=4 13662 B15R1.888 Cc1ccc(cc1Cl)CNOCC(=O)O 269956a_100000106656_100011823929 [0,2,0,0,0,0|2,0,0]=4 13663 B15R1.888 Cc1ccc(cc1Cl)COCCC(=O)N 34a_100000757172_100011823929 [0,2,0,0,0,0|2,0,0]=4 13664 B15R1.888 Cc1ccc(cc1Cl)COCCC(=O)N 34a_100011290783_100000731001 [0,2,0,0,0,0|2,0,0]=4 13665 B15R1.888 Cc1ccc(cc1Cl)COCCC(=O)N 7a_100000757172_100011823929 [0,2,0,0,0,0|2,0,0]=4 13666 B15R1.888 Cc1ccc(cc1Cl)COCCC(=O)N 7a_100011290783_100000744528 [0,2,0,0,0,0|2,0,0]=4 13667 B15R1.888 Cc1ccc(cc1Cl)CSCCC(=O)N 62a_100000744528_100011823929 [0,2,0,0,0,0|2,0,0]=4 13668 B15R1.888 Cc1ccc(cc1Cl)CSCCC(=O)N 62a_100011823929_100000744528 [0,2,0,0,0,0|2,0,0]=4 13669 B15R1.888 Cc1ccc(cc1Cl)NCCCC(=O)N 34a_100000188892_100102525003 [0,2,0,0,0,0|2,0,0]=4 13670 B15R1.888 Cc1ccc(cc1Cl)NCCCC(=O)N 7a_100000188892_100102525003 [0,2,0,0,0,0|2,0,0]=4 13671 B15R1.888 Cc1ccc(cc1Cl)OCCCC(=O)N 34a_100011265682_100102525003 [0,2,0,0,0,0|2,0,0]=4 13672 B15R1.888 Cc1ccc(cc1Cl)OCCCC(=O)N 7a_100011265682_100102525003 [0,2,0,0,0,0|2,0,0]=4 13673 B15R1.888 Cc1ccc(cc1Cl)SCCCC(=O)N 62a_100011216363_100102525003 [0,2,0,0,0,0|2,0,0]=4 13674 B15R1.888 Cc1ccc(cc1Cl)SCCCC(=O)N 62a_100102525003_100011216363 [0,2,0,0,0,0|2,0,0]=4 13675 B15R1.888 Cc1ccc(cc1F)CNCCC(=O)N 207a_100000740010_100000753222 [0,2,0,0,0,0|2,0,0]=4 13676 B15R1.888 Cc1ccc(cc1F)CNCCC(=O)N 2230a_100102708794_100000744528 [0,2,0,0,0,0|2,0,0]=4 13677 B15R1.888 Cc1ccc(cc1F)CNCCC(=O)N 34a_100102708794_100000731001 [0,2,0,0,0,0|2,0,0]=4 13678 B15R1.888 Cc1ccc(cc1F)CNOCC(=O)O 269956a_100000106656_100011217369 [0,2,0,0,0,0|2,0,0]=4 13679 B15R1.888 Cc1ccc(cc1F)COCCC(=O)N 34a_100000702247_100000731001 [0,2,0,0,0,0|2,0,0]=4 13680 B15R1.888 Cc1ccc(cc1F)COCCC(=O)N 34a_100000757172_100011217369 [0,2,0,0,0,0|2,0,0]=4 13681 B15R1.888 Cc1ccc(cc1F)COCCC(=O)N 7a_100000702247_100000744528 [0,2,0,0,0,0|2,0,0]=4 13682 B15R1.888 Cc1ccc(cc1F)COCCC(=O)N 7a_100000757172_100011217369 [0,2,0,0,0,0|2,0,0]=4 13683 B15R1.888 Cc1ccc(cc1F)CSCCC(=O)N 62a_100000744528_100011217369 [0,2,0,0,0,0|2,0,0]=4 13684 B15R1.888 Cc1ccc(cc1F)CSCCC(=O)N 62a_100011217369_100000744528 [0,2,0,0,0,0|2,0,0]=4 13685 B15R1.888 Cc1ccc(cc1F)NCCCC(=O)N 34a_100000210958_100102525003 [0,2,0,0,0,0|2,0,0]=4 13686 B15R1.888 Cc1ccc(cc1F)NCCCC(=O)N 7a_100000210958_100102525003 [0,2,0,0,0,0|2,0,0]=4 13687 B15R1.888 Cc1ccc(cc1F)OCCCC(=O)N 34a_100000722560_100102525003 [0,2,0,0,0,0|2,0,0]=4 13688 B15R1.888 Cc1ccc(cc1F)OCCCC(=O)N 7a_100000722560_100102525003 [0,2,0,0,0,0|2,0,0]=4 13689 B15R1.888 Cc1ccc(cc1F)SCCCC(=O)N 62a_100000720648_100102525003 [0,2,0,0,0,0|2,0,0]=4 13690 B15R1.888 Cc1ccc(cc1F)SCCCC(=O)N 62a_100102525003_100000720648 [0,2,0,0,0,0|2,0,0]=4 13691 B15R1.888 Cc1ccc(cc1I)CNCCC(=O)N 207a_100000740010_100010197721 [0,2,0,0,0,0|2,0,0]=4 13692 B15R1.888 Cc1ccc(cc1I)CNOCC(=O)O 269956a_100000106656_100010206137 [0,2,0,0,0,0|2,0,0]=4 13693 B15R1.888 Cc1ccc(cc1I)COCCC(=O)N 34a_100000050133_100000731001 [0,2,0,0,0,0|2,0,0]=4 13694 B15R1.888 Cc1ccc(cc1I)COCCC(=O)N 34a_100000757172_100010206137 [0,2,0,0,0,0|2,0,0]=4 13695 B15R1.888 Cc1ccc(cc1I)COCCC(=O)N 7a_100000050133_100000744528 [0,2,0,0,0,0|2,0,0]=4 13696 B15R1.888 Cc1ccc(cc1I)COCCC(=O)N 7a_100000757172_100010206137 [0,2,0,0,0,0|2,0,0]=4 13697 B15R1.888 Cc1ccc(cc1I)CSCCC(=O)N 62a_100000744528_100010206137 [0,2,0,0,0,0|2,0,0]=4 13698 B15R1.888 Cc1ccc(cc1I)CSCCC(=O)N 62a_100010206137_100000744528 [0,2,0,0,0,0|2,0,0]=4 13699 B15R1.888 Cc1ccc(cc1I)NCCCC(=O)N 34a_100000184131_100102525003 [0,2,0,0,0,0|2,0,0]=4 13700 B15R1.888 Cc1ccc(cc1I)NCCCC(=O)N 7a_100000184131_100102525003 [0,2,0,0,0,0|2,0,0]=4 13701 B15R1.888 Cc1ccc(cc1N)COCCC(=O)N 34a_100000758420_100000731001 [0,2,0,0,0,0|2,0,0]=4 13702 B15R1.888 Cc1ccc(cc1N)OCCCC(=O)N 34a_100011216113_100102525003 [0,2,0,0,0,0|2,0,0]=4 13703 B15R1.888 Cc1ccc(cc1N)OCCCC(=O)N 7a_100011216113_100102525003 [0,2,0,0,0,0|2,0,0]=4 13704 B15R1.888 Cc1ccc(cc1N)SCCCC(=O)N 62a_100000761890_100102525003 [0,2,0,0,0,0|2,0,0]=4 13705 B15R1.888 Cc1ccc(cc1N)SCCCC(=O)N 62a_100102525003_100000761890 [0,2,0,0,0,0|2,0,0]=4 13706 B15R1.888 Cc1ccc(cc1O)NCCCC(=O)N 34a_100000759471_100102525003 [0,2,0,0,0,0|2,0,0]=4 13707 B15R1.888 Cc1ccc(cc1O)NCCCC(=O)N 7a_100000759471_100102525003 [0,2,0,0,0,0|2,0,0]=4 13708 B15R1.888 Cc1ccc(cc1O)SCCCC(=O)N 62a_100000685420_100102525003 [0,2,0,0,0,0|2,0,0]=4 13709 B15R1.888 Cc1ccc(cc1O)SCCCC(=O)N 62a_100102525003_100000685420 [0,2,0,0,0,0|2,0,0]=4 13710 B15R1.888 NC(=O)CCCNc1ccc(c(c1)Br)Br 34a_100011306057_100102525003 [0,2,0,0,0,0|2,0,0]=4 13711 B15R1.888 NC(=O)CCCNc1ccc(c(c1)Br)Br 7a_100011306057_100102525003 [0,2,0,0,0,0|2,0,0]=4 13712 B15R1.888 NC(=O)CCCNc1ccc(c(c1)Br)Cl 34a_100000686031_100102525003 [0,2,0,0,0,0|2,0,0]=4 13713 B15R1.888 NC(=O)CCCNc1ccc(c(c1)Br)F 34a_100000760356_100102525003 [0,2,0,0,0,0|2,0,0]=4 13714 B15R1.888 NC(=O)CCCNc1ccc(c(c1)Br)F 7a_100000760356_100102525003 [0,2,0,0,0,0|2,0,0]=4 13715 B15R1.888 NC(=O)CCCNc1ccc(c(c1)Br)I 34a_100000750458_100102525003 [0,2,0,0,0,0|2,0,0]=4 13716 B15R1.888 NC(=O)CCCNc1ccc(c(c1)Br)O 34a_100011534360_100102525003 [0,2,0,0,0,0|2,0,0]=4 13717 B15R1.888 NC(=O)CCCNc1ccc(c(c1)Cl)Br 34a_100000687081_100102525003 [0,2,0,0,0,0|2,0,0]=4 13718 B15R1.888 NC(=O)CCCNc1ccc(c(c1)Cl)Br 7a_100000687081_100102525003 [0,2,0,0,0,0|2,0,0]=4 13719 B15R1.888 NC(=O)CCCNc1ccc(c(c1)Cl)Cl 34a_100000184108_100102525003 [0,2,0,0,0,0|2,0,0]=4 13720 B15R1.888 NC(=O)CCCNc1ccc(c(c1)Cl)F 34a_100000211060_100102525003 [0,2,0,0,0,0|2,0,0]=4 13721 B15R1.888 NC(=O)CCCNc1ccc(c(c1)Cl)F 7a_100000211060_100102525003 [0,2,0,0,0,0|2,0,0]=4 13722 B15R1.888 NC(=O)CCCNc1ccc(c(c1)Cl)I 34a_100000761885_100102525003 [0,2,0,0,0,0|2,0,0]=4 13723 B15R1.888 NC(=O)CCCNc1ccc(c(c1)Cl)O 34a_100000744943_100102525003 [0,2,0,0,0,0|2,0,0]=4 13724 B15R1.888 NC(=O)CCCNc1ccc(c(c1)F)Br 34a_100000759894_100102525003 [0,2,0,0,0,0|2,0,0]=4 13725 B15R1.888 NC(=O)CCCNc1ccc(c(c1)F)Br 7a_100000759894_100102525003 [0,2,0,0,0,0|2,0,0]=4 13726 B15R1.888 NC(=O)CCCNc1ccc(c(c1)F)Cl 34a_100000739366_100102525003 [0,2,0,0,0,0|2,0,0]=4 13727 B15R1.888 NC(=O)CCCNc1ccc(c(c1)F)Cl 7a_100000739366_100102525003 [0,2,0,0,0,0|2,0,0]=4 13728 B15R1.888 NC(=O)CCCNc1ccc(c(c1)F)F 34a_100000210724_100102525003 [0,2,0,0,0,0|2,0,0]=4 13729 B15R1.888 NC(=O)CCCNc1ccc(c(c1)F)F 7a_100000210724_100102525003 [0,2,0,0,0,0|2,0,0]=4 13730 B15R1.888 NC(=O)CCCNc1ccc(c(c1)F)I 34a_100011356925_100102525003 [0,2,0,0,0,0|2,0,0]=4 13731 B15R1.888 NC(=O)CCCNc1ccc(c(c1)F)I 7a_100011356925_100102525003 [0,2,0,0,0,0|2,0,0]=4 13732 B15R1.888 NC(=O)CCCNc1ccc(c(c1)F)O 34a_100011220035_100102525003 [0,2,0,0,0,0|2,0,0]=4 13733 B15R1.888 NC(=O)CCCNc1ccc(c(c1)F)O 7a_100011220035_100102525003 [0,2,0,0,0,0|2,0,0]=4 13734 B15R1.888 NC(=O)CCCNc1ccc(c(c1)I)Br 34a_100000750459_100102525003 [0,2,0,0,0,0|2,0,0]=4 13735 B15R1.888 NC(=O)CCCNc1ccc(c(c1)I)Cl 34a_100012360549_100102525003 [0,2,0,0,0,0|2,0,0]=4 13736 B15R1.888 NC(=O)CCCNc1ccc(c(c1)I)F 34a_114828291077_100102525003 [0,2,0,0,0,0|2,0,0]=4 13737 B15R1.888 NC(=O)CCCNc1ccc(c(c1)I)F 7a_114828291077_100102525003 [0,2,0,0,0,0|2,0,0]=4 13738 B15R1.888 NC(=O)CCCNc1ccc(c(c1)O)Cl 34a_100011934209_100102525003 [0,2,0,0,0,0|2,0,0]=4 13739 B15R1.888 NC(=O)CCCNc1ccc(c(c1)O)F 34a_100012017398_100102525003 [0,2,0,0,0,0|2,0,0]=4 13740 B15R1.888 NC(=O)CCCNc1ccc(c(c1)O)F 7a_100012017398_100102525003 [0,2,0,0,0,0|2,0,0]=4 13741 B15R1.888 NC(=O)CCCNc1ccc(c(c1)O)O 34a_100102946323_100102525003 [0,2,0,0,0,0|2,0,0]=4 13742 B15R1.888 NC(=O)CCCOc1ccc(c(c1)Br)Cl 34a_100011933957_100102525003 [0,2,0,0,0,0|2,0,0]=4 13743 B15R1.888 NC(=O)CCCOc1ccc(c(c1)Br)Cl 7a_100011933957_100102525003 [0,2,0,0,0,0|2,0,0]=4 13744 B15R1.888 NC(=O)CCCOc1ccc(c(c1)Br)F 34a_100000693481_100102525003 [0,2,0,0,0,0|2,0,0]=4 13745 B15R1.888 NC(=O)CCCOc1ccc(c(c1)Br)F 7a_100000693481_100102525003 [0,2,0,0,0,0|2,0,0]=4 13746 B15R1.888 NC(=O)CCCOc1ccc(c(c1)Br)I 34a_100000701344_100102525003 [0,2,0,0,0,0|2,0,0]=4 13747 B15R1.888 NC(=O)CCCOc1ccc(c(c1)Br)I 7a_100000701344_100102525003 [0,2,0,0,0,0|2,0,0]=4 13748 B15R1.888 NC(=O)CCCOc1ccc(c(c1)Br)N 34a_100012001276_100102525003 [0,2,0,0,0,0|2,0,0]=4 13749 B15R1.888 NC(=O)CCCOc1ccc(c(c1)Br)N 7a_100012001276_100102525003 [0,2,0,0,0,0|2,0,0]=4 13750 B15R1.888 NC(=O)CCCOc1ccc(c(c1)Cl)Br 34a_100011215161_100102525003 [0,2,0,0,0,0|2,0,0]=4 13751 B15R1.888 NC(=O)CCCOc1ccc(c(c1)Cl)Br 7a_100011215161_100102525003 [0,2,0,0,0,0|2,0,0]=4 13752 B15R1.888 NC(=O)CCCOc1ccc(c(c1)Cl)Cl 34a_100000211054_100102525003 [0,2,0,0,0,0|2,0,0]=4 13753 B15R1.888 NC(=O)CCCOc1ccc(c(c1)Cl)Cl 7a_100000211054_100102525003 [0,2,0,0,0,0|2,0,0]=4 13754 B15R1.888 NC(=O)CCCOc1ccc(c(c1)Cl)F 34a_100000211030_100102525003 [0,2,0,0,0,0|2,0,0]=4 13755 B15R1.888 NC(=O)CCCOc1ccc(c(c1)Cl)F 7a_100000211030_100102525003 [0,2,0,0,0,0|2,0,0]=4 13756 B15R1.888 NC(=O)CCCOc1ccc(c(c1)Cl)I 34a_100000047559_100102525003 [0,2,0,0,0,0|2,0,0]=4 13757 B15R1.888 NC(=O)CCCOc1ccc(c(c1)Cl)I 7a_100000047559_100102525003 [0,2,0,0,0,0|2,0,0]=4 13758 B15R1.888 NC(=O)CCCOc1ccc(c(c1)Cl)N 34a_100011215599_100102525003 [0,2,0,0,0,0|2,0,0]=4 13759 B15R1.888 NC(=O)CCCOc1ccc(c(c1)Cl)N 7a_100011215599_100102525003 [0,2,0,0,0,0|2,0,0]=4 13760 B15R1.888 NC(=O)CCCOc1ccc(c(c1)F)Br 34a_100000755031_100102525003 [0,2,0,0,0,0|2,0,0]=4 13761 B15R1.888 NC(=O)CCCOc1ccc(c(c1)F)Br 7a_100000755031_100102525003 [0,2,0,0,0,0|2,0,0]=4 13762 B15R1.888 NC(=O)CCCOc1ccc(c(c1)F)Cl 34a_100000691581_100102525003 [0,2,0,0,0,0|2,0,0]=4 13763 B15R1.888 NC(=O)CCCOc1ccc(c(c1)F)Cl 7a_100000691581_100102525003 [0,2,0,0,0,0|2,0,0]=4 13764 B15R1.888 NC(=O)CCCOc1ccc(c(c1)F)F 34a_100000181275_100102525003 [0,2,0,0,0,0|2,0,0]=4 13765 B15R1.888 NC(=O)CCCOc1ccc(c(c1)F)F 7a_100000181275_100102525003 [0,2,0,0,0,0|2,0,0]=4 13766 B15R1.888 NC(=O)CCCOc1ccc(c(c1)F)I 34a_100009990212_100102525003 [0,2,0,0,0,0|2,0,0]=4 13767 B15R1.888 NC(=O)CCCOc1ccc(c(c1)F)I 7a_100009990212_100102525003 [0,2,0,0,0,0|2,0,0]=4 13768 B15R1.888 NC(=O)CCCOc1ccc(c(c1)F)N 34a_100000759473_100102525003 [0,2,0,0,0,0|2,0,0]=4 13769 B15R1.888 NC(=O)CCCOc1ccc(c(c1)F)N 7a_100000759473_100102525003 [0,2,0,0,0,0|2,0,0]=4 13770 B15R1.888 NC(=O)CCCOc1ccc(c(c1)I)Br 34a_100012339312_100102525003 [0,2,0,0,0,0|2,0,0]=4 13771 B15R1.888 NC(=O)CCCOc1ccc(c(c1)I)Br 7a_100012339312_100102525003 [0,2,0,0,0,0|2,0,0]=4 13772 B15R1.888 NC(=O)CCCOc1ccc(c(c1)I)Cl 34a_100000049588_100102525003 [0,2,0,0,0,0|2,0,0]=4 13773 B15R1.888 NC(=O)CCCOc1ccc(c(c1)I)Cl 7a_100000049588_100102525003 [0,2,0,0,0,0|2,0,0]=4 13774 B15R1.888 NC(=O)CCCOc1ccc(c(c1)I)N 34a_100010084370_100102525003 [0,2,0,0,0,0|2,0,0]=4 13775 B15R1.888 NC(=O)CCCOc1ccc(c(c1)I)N 7a_100010084370_100102525003 [0,2,0,0,0,0|2,0,0]=4 13776 B15R1.888 NC(=O)CCCOc1ccc(c(c1)N)Br 34a_100011999798_100102525003 [0,2,0,0,0,0|2,0,0]=4 13777 B15R1.888 NC(=O)CCCOc1ccc(c(c1)N)Br 7a_100011999798_100102525003 [0,2,0,0,0,0|2,0,0]=4 13778 B15R1.888 NC(=O)CCCOc1ccc(c(c1)N)Cl 34a_100011934297_100102525003 [0,2,0,0,0,0|2,0,0]=4 13779 B15R1.888 NC(=O)CCCOc1ccc(c(c1)N)F 34a_100012017239_100102525003 [0,2,0,0,0,0|2,0,0]=4 13780 B15R1.888 NC(=O)CCCOc1ccc(c(c1)N)F 7a_100012017239_100102525003 [0,2,0,0,0,0|2,0,0]=4 13781 B15R1.888 NC(=O)CCCOc1ccc(c(c1)N)N 34a_100025771000_100102525003 [0,2,0,0,0,0|2,0,0]=4 13782 B15R1.888 NC(=O)CCCSc1ccc(c(c1)Br)Br 62a_100012356285_100102525003 [0,2,0,0,0,0|2,0,0]=4 13783 B15R1.888 NC(=O)CCCSc1ccc(c(c1)Br)Br 62a_100102525003_100012356285 [0,2,0,0,0,0|2,0,0]=4 13784 B15R1.888 NC(=O)CCCSc1ccc(c(c1)Br)Cl 62a_100012353702_100102525003 [0,2,0,0,0,0|2,0,0]=4 13785 B15R1.888 NC(=O)CCCSc1ccc(c(c1)Br)Cl 62a_100102525003_100012353702 [0,2,0,0,0,0|2,0,0]=4 13786 B15R1.888 NC(=O)CCCSc1ccc(c(c1)Br)F 62a_100012047266_100102525003 [0,2,0,0,0,0|2,0,0]=4 13787 B15R1.888 NC(=O)CCCSc1ccc(c(c1)Br)F 62a_100102525003_100012047266 [0,2,0,0,0,0|2,0,0]=4 13788 B15R1.888 NC(=O)CCCSc1ccc(c(c1)Br)N 62a_100000750455_100102525003 [0,2,0,0,0,0|2,0,0]=4 13789 B15R1.888 NC(=O)CCCSc1ccc(c(c1)Br)N 62a_100102525003_100000750455 [0,2,0,0,0,0|2,0,0]=4 13790 B15R1.888 NC(=O)CCCSc1ccc(c(c1)Br)O 62a_100012361655_100102525003 [0,2,0,0,0,0|2,0,0]=4 13791 B15R1.888 NC(=O)CCCSc1ccc(c(c1)Br)O 62a_100102525003_100012361655 [0,2,0,0,0,0|2,0,0]=4 13792 B15R1.888 NC(=O)CCCSc1ccc(c(c1)Cl)Br 62a_100012047281_100102525003 [0,2,0,0,0,0|2,0,0]=4 13793 B15R1.888 NC(=O)CCCSc1ccc(c(c1)Cl)Br 62a_100102525003_100012047281 [0,2,0,0,0,0|2,0,0]=4 13794 B15R1.888 NC(=O)CCCSc1ccc(c(c1)Cl)Cl 62a_100011214914_100102525003 [0,2,0,0,0,0|2,0,0]=4 13795 B15R1.888 NC(=O)CCCSc1ccc(c(c1)Cl)Cl 62a_100102525003_100011214914 [0,2,0,0,0,0|2,0,0]=4 13796 B15R1.888 NC(=O)CCCSc1ccc(c(c1)Cl)F 62a_100011215976_100102525003 [0,2,0,0,0,0|2,0,0]=4 13797 B15R1.888 NC(=O)CCCSc1ccc(c(c1)Cl)F 62a_100102525003_100011215976 [0,2,0,0,0,0|2,0,0]=4 13798 B15R1.888 NC(=O)CCCSc1ccc(c(c1)Cl)N 62a_100011218065_100102525003 [0,2,0,0,0,0|2,0,0]=4 13799 B15R1.888 NC(=O)CCCSc1ccc(c(c1)Cl)N 62a_100102525003_100011218065 [0,2,0,0,0,0|2,0,0]=4 13800 B15R1.888 NC(=O)CCCSc1ccc(c(c1)Cl)O 62a_100012360047_100102525003 [0,2,0,0,0,0|2,0,0]=4 13801 B15R1.888 NC(=O)CCCSc1ccc(c(c1)Cl)O 62a_100102525003_100012360047 [0,2,0,0,0,0|2,0,0]=4 13802 B15R1.888 NC(=O)CCCSc1ccc(c(c1)F)Br 62a_100000685389_100102525003 [0,2,0,0,0,0|2,0,0]=4 13803 B15R1.888 NC(=O)CCCSc1ccc(c(c1)F)Br 62a_100102525003_100000685389 [0,2,0,0,0,0|2,0,0]=4 13804 B15R1.888 NC(=O)CCCSc1ccc(c(c1)F)Cl 62a_100011216805_100102525003 [0,2,0,0,0,0|2,0,0]=4 13805 B15R1.888 NC(=O)CCCSc1ccc(c(c1)F)Cl 62a_100102525003_100011216805 [0,2,0,0,0,0|2,0,0]=4 13806 B15R1.888 NC(=O)CCCSc1ccc(c(c1)F)F 62a_100000703953_100102525003 [0,2,0,0,0,0|2,0,0]=4 13807 B15R1.888 NC(=O)CCCSc1ccc(c(c1)F)F 62a_100102525003_100000703953 [0,2,0,0,0,0|2,0,0]=4 13808 B15R1.888 NC(=O)CCCSc1ccc(c(c1)F)N 62a_100011215594_100102525003 [0,2,0,0,0,0|2,0,0]=4 13809 B15R1.888 NC(=O)CCCSc1ccc(c(c1)F)N 62a_100102525003_100011215594 [0,2,0,0,0,0|2,0,0]=4 13810 B15R1.888 NC(=O)CCCSc1ccc(c(c1)F)O 62a_100000185481_100102525003 [0,2,0,0,0,0|2,0,0]=4 13811 B15R1.888 NC(=O)CCCSc1ccc(c(c1)F)O 62a_100102525003_100000185481 [0,2,0,0,0,0|2,0,0]=4 13812 B15R1.888 NC(=O)CCCSc1ccc(c(c1)N)Br 62a_100000750456_100102525003 [0,2,0,0,0,0|2,0,0]=4 13813 B15R1.888 NC(=O)CCCSc1ccc(c(c1)N)Br 62a_100102525003_100000750456 [0,2,0,0,0,0|2,0,0]=4 13814 B15R1.888 NC(=O)CCCSc1ccc(c(c1)N)Cl 62a_100102525003_200000761891 [0,2,0,0,0,0|2,0,0]=4 13815 B15R1.888 NC(=O)CCCSc1ccc(c(c1)N)Cl 62a_200000761891_100102525003 [0,2,0,0,0,0|2,0,0]=4 13816 B15R1.888 NC(=O)CCCSc1ccc(c(c1)N)F 62a_100000740924_100102525003 [0,2,0,0,0,0|2,0,0]=4 13817 B15R1.888 NC(=O)CCCSc1ccc(c(c1)N)F 62a_100102525003_100000740924 [0,2,0,0,0,0|2,0,0]=4 13818 B15R1.888 NC(=O)CCCSc1ccc(c(c1)N)N 62a_100000741789_100102525003 [0,2,0,0,0,0|2,0,0]=4 13819 B15R1.888 NC(=O)CCCSc1ccc(c(c1)N)N 62a_100102525003_100011534411 [0,2,0,0,0,0|2,0,0]=4 13820 B15R1.888 NC(=O)CCCSc1ccc(c(c1)N)O 62a_100000752626_100102525003 [0,2,0,0,0,0|2,0,0]=4 13821 B15R1.888 NC(=O)CCCSc1ccc(c(c1)N)O 62a_100102525003_100000752626 [0,2,0,0,0,0|2,0,0]=4 13822 B15R1.888 NC(=O)CCCSc1ccc(c(c1)O)Br 62a_100012356990_100102525003 [0,2,0,0,0,0|2,0,0]=4 13823 B15R1.888 NC(=O)CCCSc1ccc(c(c1)O)Br 62a_100102525003_100012356990 [0,2,0,0,0,0|2,0,0]=4 13824 B15R1.888 NC(=O)CCCSc1ccc(c(c1)O)Cl 62a_100011356854_100102525003 [0,2,0,0,0,0|2,0,0]=4 13825 B15R1.888 NC(=O)CCCSc1ccc(c(c1)O)Cl 62a_100102525003_100011356854 [0,2,0,0,0,0|2,0,0]=4 13826 B15R1.888 NC(=O)CCCSc1ccc(c(c1)O)F 62a_100000686035_100102525003 [0,2,0,0,0,0|2,0,0]=4 13827 B15R1.888 NC(=O)CCCSc1ccc(c(c1)O)F 62a_100102525003_100000686035 [0,2,0,0,0,0|2,0,0]=4 13828 B15R1.888 NC(=O)CCCSc1ccc(c(c1)O)N 62a_100000739049_100102525003 [0,2,0,0,0,0|2,0,0]=4 13829 B15R1.888 NC(=O)CCCSc1ccc(c(c1)O)N 62a_100102525003_100000739049 [0,2,0,0,0,0|2,0,0]=4 13830 B15R1.888 NC(=O)CCCSc1ccc(c(c1)O)O 62a_100102525003_100009813601 [0,2,0,0,0,0|2,0,0]=4 13831 B15R1.888 NC(=O)CCNCc1ccc(c(c1)Br)Br 207a_100000740010_100011215943 [0,2,0,0,0,0|2,0,0]=4 13832 B15R1.888 NC(=O)CCNCc1ccc(c(c1)Br)Br 2230a_100012351559_100000744528 [0,2,0,0,0,0|2,0,0]=4 13833 B15R1.888 NC(=O)CCNCc1ccc(c(c1)Br)Br 34a_100012351559_100000731001 [0,2,0,0,0,0|2,0,0]=4 13834 B15R1.888 NC(=O)CCNCc1ccc(c(c1)Br)Cl 207a_100000740010_100000693810 [0,2,0,0,0,0|2,0,0]=4 13835 B15R1.888 NC(=O)CCNCc1ccc(c(c1)Br)Cl 2230a_100012349490_100000744528 [0,2,0,0,0,0|2,0,0]=4 13836 B15R1.888 NC(=O)CCNCc1ccc(c(c1)Br)Cl 34a_100012349490_100000731001 [0,2,0,0,0,0|2,0,0]=4 13837 B15R1.888 NC(=O)CCNCc1ccc(c(c1)Br)F 207a_100000740010_100000211747 [0,2,0,0,0,0|2,0,0]=4 13838 B15R1.888 NC(=O)CCNCc1ccc(c(c1)Br)F 2230a_100015193890_100000744528 [0,2,0,0,0,0|2,0,0]=4 13839 B15R1.888 NC(=O)CCNCc1ccc(c(c1)Br)F 34a_100015193890_100000731001 [0,2,0,0,0,0|2,0,0]=4 13840 B15R1.888 NC(=O)CCNCc1ccc(c(c1)Cl)Br 207a_100000740010_100000690054 [0,2,0,0,0,0|2,0,0]=4 13841 B15R1.888 NC(=O)CCNCc1ccc(c(c1)Cl)Br 2230a_100012362553_100000744528 [0,2,0,0,0,0|2,0,0]=4 13842 B15R1.888 NC(=O)CCNCc1ccc(c(c1)Cl)Br 34a_100012362553_100000731001 [0,2,0,0,0,0|2,0,0]=4 13843 B15R1.888 NC(=O)CCNCc1ccc(c(c1)Cl)Cl 207a_100000740010_100000188533 [0,2,0,0,0,0|2,0,0]=4 13844 B15R1.888 NC(=O)CCNCc1ccc(c(c1)Cl)Cl 2230a_100000174881_100000744528 [0,2,0,0,0,0|2,0,0]=4 13845 B15R1.888 NC(=O)CCNCc1ccc(c(c1)Cl)Cl 34a_100000174881_100000731001 [0,2,0,0,0,0|2,0,0]=4 13846 B15R1.888 NC(=O)CCNCc1ccc(c(c1)Cl)F 207a_100000740010_100000742290 [0,2,0,0,0,0|2,0,0]=4 13847 B15R1.888 NC(=O)CCNCc1ccc(c(c1)Cl)F 2230a_100000749334_100000744528 [0,2,0,0,0,0|2,0,0]=4 13848 B15R1.888 NC(=O)CCNCc1ccc(c(c1)Cl)F 34a_100000749334_100000731001 [0,2,0,0,0,0|2,0,0]=4 13849 B15R1.888 NC(=O)CCNCc1ccc(c(c1)F)Br 207a_100000740010_100000686674 [0,2,0,0,0,0|2,0,0]=4 13850 B15R1.888 NC(=O)CCNCc1ccc(c(c1)F)Br 2230a_100000755036_100000744528 [0,2,0,0,0,0|2,0,0]=4 13851 B15R1.888 NC(=O)CCNCc1ccc(c(c1)F)Br 34a_100000755036_100000731001 [0,2,0,0,0,0|2,0,0]=4 13852 B15R1.888 NC(=O)CCNCc1ccc(c(c1)F)Cl 207a_100000740010_100000745630 [0,2,0,0,0,0|2,0,0]=4 13853 B15R1.888 NC(=O)CCNCc1ccc(c(c1)F)Cl 2230a_100011219866_100000744528 [0,2,0,0,0,0|2,0,0]=4 13854 B15R1.888 NC(=O)CCNCc1ccc(c(c1)F)Cl 34a_100011219866_100000731001 [0,2,0,0,0,0|2,0,0]=4 13855 B15R1.888 NC(=O)CCNCc1ccc(c(c1)F)F 207a_100000740010_100000211062 [0,2,0,0,0,0|2,0,0]=4 13856 B15R1.888 NC(=O)CCNCc1ccc(c(c1)F)F 2230a_100000737897_100000744528 [0,2,0,0,0,0|2,0,0]=4 13857 B15R1.888 NC(=O)CCNCc1ccc(c(c1)F)F 34a_100000737897_100000731001 [0,2,0,0,0,0|2,0,0]=4 13858 B15R1.888 NC(=O)CCNCc1ccc(c(c1)F)I 207a_100000740010_100000050832 [0,2,0,0,0,0|2,0,0]=4 13859 B15R1.888 NC(=O)CCNCc1ccc(c(c1)F)O 34a_100000758358_100000731001 [0,2,0,0,0,0|2,0,0]=4 13860 B15R1.888 NC(=O)CCNCc1ccc(c(c1)I)Br 207a_100000740010_100010146563 [0,2,0,0,0,0|2,0,0]=4 13861 B15R1.888 NC(=O)CCNCc1ccc(c(c1)I)Cl 207a_100000740010_100010209939 [0,2,0,0,0,0|2,0,0]=4 13862 B15R1.888 NC(=O)CCNCc1ccc(c(c1)I)F 207a_100000740010_100010188209 [0,2,0,0,0,0|2,0,0]=4 13863 B15R1.888 NC(=O)CCNCc1ccc(c(c1)O)Cl 34a_100020636435_100000731001 [0,2,0,0,0,0|2,0,0]=4 13864 B15R1.888 NC(=O)CCNCc1ccc(c(c1)O)F 34a_100160469508_100000731001 [0,2,0,0,0,0|2,0,0]=4 13865 B15R1.888 NC(=O)CCNCc1ccc(c(c1)O)O 34a_100000010075_100000731001 [0,2,0,0,0,0|2,0,0]=4 13866 B15R1.888 NC(=O)CCOCc1ccc(c(c1)Br)Br 34a_100000757172_100012353900 [0,2,0,0,0,0|2,0,0]=4 13867 B15R1.888 NC(=O)CCOCc1ccc(c(c1)Br)Br 7a_100000757172_100012353900 [0,2,0,0,0,0|2,0,0]=4 13868 B15R1.888 NC(=O)CCOCc1ccc(c(c1)Br)Cl 34a_100000757172_100012353894 [0,2,0,0,0,0|2,0,0]=4 13869 B15R1.888 NC(=O)CCOCc1ccc(c(c1)Br)Cl 34a_100012353893_100000731001 [0,2,0,0,0,0|2,0,0]=4 13870 B15R1.888 NC(=O)CCOCc1ccc(c(c1)Br)Cl 7a_100000757172_100012353894 [0,2,0,0,0,0|2,0,0]=4 13871 B15R1.888 NC(=O)CCOCc1ccc(c(c1)Br)Cl 7a_100012353893_100000744528 [0,2,0,0,0,0|2,0,0]=4 13872 B15R1.888 NC(=O)CCOCc1ccc(c(c1)Br)F 34a_100000246287_100000731001 [0,2,0,0,0,0|2,0,0]=4 13873 B15R1.888 NC(=O)CCOCc1ccc(c(c1)Br)F 34a_100000757172_100011206884 [0,2,0,0,0,0|2,0,0]=4 13874 B15R1.888 NC(=O)CCOCc1ccc(c(c1)Br)F 7a_100000246287_100000744528 [0,2,0,0,0,0|2,0,0]=4 13875 B15R1.888 NC(=O)CCOCc1ccc(c(c1)Br)F 7a_100000757172_100011206884 [0,2,0,0,0,0|2,0,0]=4 13876 B15R1.888 NC(=O)CCOCc1ccc(c(c1)Cl)Br 34a_100000709168_100000731001 [0,2,0,0,0,0|2,0,0]=4 13877 B15R1.888 NC(=O)CCOCc1ccc(c(c1)Cl)Br 34a_100000757172_100012353895 [0,2,0,0,0,0|2,0,0]=4 13878 B15R1.888 NC(=O)CCOCc1ccc(c(c1)Cl)Br 7a_100000709168_100000744528 [0,2,0,0,0,0|2,0,0]=4 13879 B15R1.888 NC(=O)CCOCc1ccc(c(c1)Cl)Br 7a_100000757172_100012353895 [0,2,0,0,0,0|2,0,0]=4 13880 B15R1.888 NC(=O)CCOCc1ccc(c(c1)Cl)Cl 34a_100000211588_100000731001 [0,2,0,0,0,0|2,0,0]=4 13881 B15R1.888 NC(=O)CCOCc1ccc(c(c1)Cl)Cl 34a_100000757172_100000184707 [0,2,0,0,0,0|2,0,0]=4 13882 B15R1.888 NC(=O)CCOCc1ccc(c(c1)Cl)Cl 7a_100000211588_100000744528 [0,2,0,0,0,0|2,0,0]=4 13883 B15R1.888 NC(=O)CCOCc1ccc(c(c1)Cl)Cl 7a_100000757172_100000184707 [0,2,0,0,0,0|2,0,0]=4 13884 B15R1.888 NC(=O)CCOCc1ccc(c(c1)Cl)F 34a_100000757172_100011934319 [0,2,0,0,0,0|2,0,0]=4 13885 B15R1.888 NC(=O)CCOCc1ccc(c(c1)Cl)F 34a_100011217911_100000731001 [0,2,0,0,0,0|2,0,0]=4 13886 B15R1.888 NC(=O)CCOCc1ccc(c(c1)Cl)F 7a_100000757172_100000717365 [0,2,0,0,0,0|2,0,0]=4 13887 B15R1.888 NC(=O)CCOCc1ccc(c(c1)Cl)F 7a_100011217911_100000744528 [0,2,0,0,0,0|2,0,0]=4 13888 B15R1.888 NC(=O)CCOCc1ccc(c(c1)Cl)I 34a_100000718186_100000731001 [0,2,0,0,0,0|2,0,0]=4 13889 B15R1.888 NC(=O)CCOCc1ccc(c(c1)Cl)I 34a_100000757172_100012349665 [0,2,0,0,0,0|2,0,0]=4 13890 B15R1.888 NC(=O)CCOCc1ccc(c(c1)Cl)I 7a_100000718186_100000744528 [0,2,0,0,0,0|2,0,0]=4 13891 B15R1.888 NC(=O)CCOCc1ccc(c(c1)Cl)I 7a_100000757172_100012349665 [0,2,0,0,0,0|2,0,0]=4 13892 B15R1.888 NC(=O)CCOCc1ccc(c(c1)F)Br 34a_100000757172_100000767054 [0,2,0,0,0,0|2,0,0]=4 13893 B15R1.888 NC(=O)CCOCc1ccc(c(c1)F)Br 34a_100011533735_100000731001 [0,2,0,0,0,0|2,0,0]=4 13894 B15R1.888 NC(=O)CCOCc1ccc(c(c1)F)Br 7a_100000757172_100000767054 [0,2,0,0,0,0|2,0,0]=4 13895 B15R1.888 NC(=O)CCOCc1ccc(c(c1)F)Br 7a_100011533735_100000744528 [0,2,0,0,0,0|2,0,0]=4 13896 B15R1.888 NC(=O)CCOCc1ccc(c(c1)F)Cl 34a_100000757172_100011519011 [0,2,0,0,0,0|2,0,0]=4 13897 B15R1.888 NC(=O)CCOCc1ccc(c(c1)F)Cl 34a_100011218299_100000731001 [0,2,0,0,0,0|2,0,0]=4 13898 B15R1.888 NC(=O)CCOCc1ccc(c(c1)F)Cl 7a_100000757172_100000716492 [0,2,0,0,0,0|2,0,0]=4 13899 B15R1.888 NC(=O)CCOCc1ccc(c(c1)F)Cl 7a_100011218299_100000744528 [0,2,0,0,0,0|2,0,0]=4 13900 B15R1.888 NC(=O)CCOCc1ccc(c(c1)F)F 34a_100000757172_100000757363 [0,2,0,0,0,0|2,0,0]=4 13901 B15R1.888 NC(=O)CCOCc1ccc(c(c1)F)F 34a_100011215442_100000731001 [0,2,0,0,0,0|2,0,0]=4 13902 B15R1.888 NC(=O)CCOCc1ccc(c(c1)F)F 7a_100000757172_100000757363 [0,2,0,0,0,0|2,0,0]=4 13903 B15R1.888 NC(=O)CCOCc1ccc(c(c1)F)F 7a_100011215442_100000744528 [0,2,0,0,0,0|2,0,0]=4 13904 B15R1.888 NC(=O)CCOCc1ccc(c(c1)F)I 34a_100000757172_100010149604 [0,2,0,0,0,0|2,0,0]=4 13905 B15R1.888 NC(=O)CCOCc1ccc(c(c1)F)I 34a_100010149597_100000731001 [0,2,0,0,0,0|2,0,0]=4 13906 B15R1.888 NC(=O)CCOCc1ccc(c(c1)F)I 7a_100000757172_100010149604 [0,2,0,0,0,0|2,0,0]=4 13907 B15R1.888 NC(=O)CCOCc1ccc(c(c1)F)I 7a_100010149597_100000744528 [0,2,0,0,0,0|2,0,0]=4 13908 B15R1.888 NC(=O)CCOCc1ccc(c(c1)F)N 34a_100011217239_100000731001 [0,2,0,0,0,0|2,0,0]=4 13909 B15R1.888 NC(=O)CCOCc1ccc(c(c1)I)Br 34a_100000757172_100010146616 [0,2,0,0,0,0|2,0,0]=4 13910 B15R1.888 NC(=O)CCOCc1ccc(c(c1)I)Br 7a_100000757172_100010146616 [0,2,0,0,0,0|2,0,0]=4 13911 B15R1.888 NC(=O)CCOCc1ccc(c(c1)I)F 34a_100000049585_100000731001 [0,2,0,0,0,0|2,0,0]=4 13912 B15R1.888 NC(=O)CCOCc1ccc(c(c1)I)F 34a_100000757172_100010188208 [0,2,0,0,0,0|2,0,0]=4 13913 B15R1.888 NC(=O)CCOCc1ccc(c(c1)I)F 7a_100000049585_100000744528 [0,2,0,0,0,0|2,0,0]=4 13914 B15R1.888 NC(=O)CCOCc1ccc(c(c1)I)F 7a_100000757172_100010188208 [0,2,0,0,0,0|2,0,0]=4 13915 B15R1.888 NC(=O)CCOCc1ccc(c(c1)N)Br 34a_100012347568_100000731001 [0,2,0,0,0,0|2,0,0]=4 13916 B15R1.888 NC(=O)CCOCc1ccc(c(c1)N)Cl 34a_106256033963_100000731001 [0,2,0,0,0,0|2,0,0]=4 13917 B15R1.888 NC(=O)CCOCc1ccc(c(c1)N)F 34a_102125399562_100000731001 [0,2,0,0,0,0|2,0,0]=4 13918 B15R1.888 NC(=O)CCSCc1ccc(c(c1)Br)Br 62a_100000744528_100012353900 [0,2,0,0,0,0|2,0,0]=4 13919 B15R1.888 NC(=O)CCSCc1ccc(c(c1)Br)Br 62a_100012353900_100000744528 [0,2,0,0,0,0|2,0,0]=4 13920 B15R1.888 NC(=O)CCSCc1ccc(c(c1)Br)Cl 62a_100000744528_100012353894 [0,2,0,0,0,0|2,0,0]=4 13921 B15R1.888 NC(=O)CCSCc1ccc(c(c1)Br)Cl 62a_100012353894_100000744528 [0,2,0,0,0,0|2,0,0]=4 13922 B15R1.888 NC(=O)CCSCc1ccc(c(c1)Br)F 62a_100000744528_100011206884 [0,2,0,0,0,0|2,0,0]=4 13923 B15R1.888 NC(=O)CCSCc1ccc(c(c1)Br)F 62a_100011206884_100000744528 [0,2,0,0,0,0|2,0,0]=4 13924 B15R1.888 NC(=O)CCSCc1ccc(c(c1)Cl)Br 62a_100000744528_100012353895 [0,2,0,0,0,0|2,0,0]=4 13925 B15R1.888 NC(=O)CCSCc1ccc(c(c1)Cl)Br 62a_100012353895_100000744528 [0,2,0,0,0,0|2,0,0]=4 13926 B15R1.888 NC(=O)CCSCc1ccc(c(c1)Cl)Cl 62a_100000184707_100000744528 [0,2,0,0,0,0|2,0,0]=4 13927 B15R1.888 NC(=O)CCSCc1ccc(c(c1)Cl)Cl 62a_100000744528_100000184707 [0,2,0,0,0,0|2,0,0]=4 13928 B15R1.888 NC(=O)CCSCc1ccc(c(c1)Cl)F 62a_100000717365_100000744528 [0,2,0,0,0,0|2,0,0]=4 13929 B15R1.888 NC(=O)CCSCc1ccc(c(c1)Cl)F 62a_100000744528_100011934319 [0,2,0,0,0,0|2,0,0]=4 13930 B15R1.888 NC(=O)CCSCc1ccc(c(c1)Cl)I 62a_100000744528_100012349665 [0,2,0,0,0,0|2,0,0]=4 13931 B15R1.888 NC(=O)CCSCc1ccc(c(c1)Cl)I 62a_100012349665_100000744528 [0,2,0,0,0,0|2,0,0]=4 13932 B15R1.888 NC(=O)CCSCc1ccc(c(c1)F)Br 62a_100000744528_100000767054 [0,2,0,0,0,0|2,0,0]=4 13933 B15R1.888 NC(=O)CCSCc1ccc(c(c1)F)Br 62a_100000767054_100000744528 [0,2,0,0,0,0|2,0,0]=4 13934 B15R1.888 NC(=O)CCSCc1ccc(c(c1)F)Cl 62a_100000716492_100000744528 [0,2,0,0,0,0|2,0,0]=4 13935 B15R1.888 NC(=O)CCSCc1ccc(c(c1)F)Cl 62a_100000744528_100000716492 [0,2,0,0,0,0|2,0,0]=4 13936 B15R1.888 NC(=O)CCSCc1ccc(c(c1)F)F 62a_100000744528_100000757363 [0,2,0,0,0,0|2,0,0]=4 13937 B15R1.888 NC(=O)CCSCc1ccc(c(c1)F)F 62a_100000757363_100000744528 [0,2,0,0,0,0|2,0,0]=4 13938 B15R1.888 NC(=O)CCSCc1ccc(c(c1)F)I 62a_100000744528_100010149604 [0,2,0,0,0,0|2,0,0]=4 13939 B15R1.888 NC(=O)CCSCc1ccc(c(c1)F)I 62a_100010149604_100000744528 [0,2,0,0,0,0|2,0,0]=4 13940 B15R1.888 NC(=O)CCSCc1ccc(c(c1)I)Br 62a_100000744528_100010146616 [0,2,0,0,0,0|2,0,0]=4 13941 B15R1.888 NC(=O)CCSCc1ccc(c(c1)I)Br 62a_100010146616_100000744528 [0,2,0,0,0,0|2,0,0]=4 13942 B15R1.888 NC(=O)CCSCc1ccc(c(c1)I)F 62a_100000744528_100010188208 [0,2,0,0,0,0|2,0,0]=4 13943 B15R1.888 NC(=O)CCSCc1ccc(c(c1)I)F 62a_100010188208_100000744528 [0,2,0,0,0,0|2,0,0]=4 13944 B15R1.888 NC(=O)CNCCc1ccc(c(c1)Cl)Cl 2230a_100000711301_100011713676 [0,2,0,0,0,0|2,0,0]=4 13945 B15R1.888 NC(=O)CNCCc1ccc(c(c1)Cl)Cl 2230a_100011207230_100000747473 [0,2,0,0,0,0|2,0,0]=4 13946 B15R1.888 NC(=O)CNCCc1ccc(c(c1)Cl)Cl 34a_100011207230_100000187820 [0,2,0,0,0,0|2,0,0]=4 13947 B15R1.888 NC(=O)CNCCc1ccc(c(c1)Cl)F 2230a_100000711301_100012361305 [0,2,0,0,0,0|2,0,0]=4 13948 B15R1.888 NC(=O)CNCCc1ccc(c(c1)Cl)F 2230a_200011997520_100000747473 [0,2,0,0,0,0|2,0,0]=4 13949 B15R1.888 NC(=O)CNCCc1ccc(c(c1)Cl)F 34a_200011997520_100000187820 [0,2,0,0,0,0|2,0,0]=4 13950 B15R1.888 NC(=O)CNCCc1ccc(c(c1)F)F 2230a_100000711301_100000690553 [0,2,0,0,0,0|2,0,0]=4 13951 B15R1.888 NC(=O)CNCCc1ccc(c(c1)F)F 2230a_200000706328_100000747473 [0,2,0,0,0,0|2,0,0]=4 13952 B15R1.888 NC(=O)CNCCc1ccc(c(c1)F)F 34a_200000706328_100000187820 [0,2,0,0,0,0|2,0,0]=4 13953 B15R1.888 NC(=O)CNCCc1ccc(c(c1)O)O 34a_100000210387_100000187820 [0,2,0,0,0,0|2,0,0]=4 13954 B15R1.888 NC(=O)COCCc1ccc(c(c1)Cl)Cl 34a_100011709245_100000187820 [0,2,0,0,0,0|2,0,0]=4 13955 B15R1.888 NC(=O)COCCc1ccc(c(c1)Cl)Cl 7a_100011709245_100000187820 [0,2,0,0,0,0|2,0,0]=4 13956 B15R1.888 NC(=O)COCCc1ccc(c(c1)Cl)F 34a_100011830478_100000187820 [0,2,0,0,0,0|2,0,0]=4 13957 B15R1.888 NC(=O)COCCc1ccc(c(c1)Cl)F 7a_100011830478_100000187820 [0,2,0,0,0,0|2,0,0]=4 13958 B15R1.888 NC(=O)COCCc1ccc(c(c1)F)Br 34a_100012921202_100000187820 [0,2,0,0,0,0|2,0,0]=4 13959 B15R1.888 NC(=O)COCCc1ccc(c(c1)F)Br 7a_100012921202_100000187820 [0,2,0,0,0,0|2,0,0]=4 13960 B15R1.888 NC(=O)COCCc1ccc(c(c1)F)Cl 34a_100011934464_100000187820 [0,2,0,0,0,0|2,0,0]=4 13961 B15R1.888 NC(=O)COCCc1ccc(c(c1)F)Cl 7a_100011934464_100000187820 [0,2,0,0,0,0|2,0,0]=4 13962 B15R1.888 NC(=O)COCCc1ccc(c(c1)F)F 34a_100000690376_100000187820 [0,2,0,0,0,0|2,0,0]=4 13963 B15R1.888 NC(=O)COCCc1ccc(c(c1)F)F 7a_100000690376_100000187820 [0,2,0,0,0,0|2,0,0]=4 13964 B15R1.888 NC(=O)CSCCc1ccc(c(c1)Cl)Cl 62a_100000747473_100011713676 [0,2,0,0,0,0|2,0,0]=4 13965 B15R1.888 NC(=O)CSCCc1ccc(c(c1)Cl)Cl 62a_100011713676_100000747473 [0,2,0,0,0,0|2,0,0]=4 13966 B15R1.888 NC(=O)CSCCc1ccc(c(c1)Cl)F 62a_100000747473_100012361305 [0,2,0,0,0,0|2,0,0]=4 13967 B15R1.888 NC(=O)CSCCc1ccc(c(c1)Cl)F 62a_100012361305_100000747473 [0,2,0,0,0,0|2,0,0]=4 13968 B15R1.888 NC(=O)CSCCc1ccc(c(c1)F)F 62a_100000690553_100000747473 [0,2,0,0,0,0|2,0,0]=4 13969 B15R1.888 NC(=O)CSCCc1ccc(c(c1)F)F 62a_100000747473_100000690553 [0,2,0,0,0,0|2,0,0]=4 13970 B15R1.888 NC(=O)CSCCc1ccc(c(c1)O)O 62a_100000747473_200010393615 [0,2,0,0,0,0|2,0,0]=4 13971 B15R1.888 O=C(O)CNCCc1ccc(c(c1)Cl)Cl 269956a_100016091260_100011713676 [0,2,0,0,0,0|1,0,0]=3 13972 B15R1.888 O=C(O)CNCCc1ccc(c(c1)Cl)F 269956a_100016091260_100012361305 [0,2,0,0,0,0|1,0,0]=3 13973 B15R1.888 O=C(O)CNCCc1ccc(c(c1)F)F 269956a_100016091260_100000690553 [0,2,0,0,0,0|1,0,0]=3 13974 B15R1.888 O=C(O)CNCCc1ccc(c(c1)O)O 269956a_100016091260_200010393615 [0,2,0,0,0,0|1,0,0]=3 13975 B15R1.888 O=C(O)CONCc1ccc(c(c1)Br)Br 269956a_100000106656_100012353900 [0,2,0,0,0,0|2,0,0]=4 13976 B15R1.888 O=C(O)CONCc1ccc(c(c1)Br)Cl 269956a_100000106656_100012353894 [0,2,0,0,0,0|2,0,0]=4 13977 B15R1.888 O=C(O)CONCc1ccc(c(c1)Br)F 269956a_100000106656_100000743011 [0,2,0,0,0,0|2,0,0]=4 13978 B15R1.888 O=C(O)CONCc1ccc(c(c1)Cl)Br 269956a_100000106656_100012353895 [0,2,0,0,0,0|2,0,0]=4 13979 B15R1.888 O=C(O)CONCc1ccc(c(c1)Cl)Cl 269956a_100000106656_100000188800 [0,2,0,0,0,0|2,0,0]=4 13980 B15R1.888 O=C(O)CONCc1ccc(c(c1)Cl)F 269956a_100000106656_100000717365 [0,2,0,0,0,0|2,0,0]=4 13981 B15R1.888 O=C(O)CONCc1ccc(c(c1)Cl)I 269956a_100000106656_100012349665 [0,2,0,0,0,0|2,0,0]=4 13982 B15R1.888 O=C(O)CONCc1ccc(c(c1)F)Br 269956a_100000106656_100000767054 [0,2,0,0,0,0|2,0,0]=4 13983 B15R1.888 O=C(O)CONCc1ccc(c(c1)F)Cl 269956a_100000106656_100000716492 [0,2,0,0,0,0|2,0,0]=4 13984 B15R1.888 O=C(O)CONCc1ccc(c(c1)F)F 269956a_100000106656_100000757363 [0,2,0,0,0,0|2,0,0]=4 13985 B15R1.888 O=C(O)CONCc1ccc(c(c1)F)I 269956a_100000106656_100010149604 [0,2,0,0,0,0|2,0,0]=4 13986 B15R1.888 O=C(O)CONCc1ccc(c(c1)I)Br 269956a_100000106656_100010146616 [0,2,0,0,0,0|2,0,0]=4 13987 B15R1.888 O=C(O)CONCc1ccc(c(c1)I)F 269956a_100000106656_100010188208 [0,2,0,0,0,0|2,0,0]=4 13988 B15R1.888 O=C([O-])CNCCc1ccc(c(c1)Cl)Cl 34a_100011207230_100020667443 [0,2,0,0,0,0|1,0,1]=4 13989 B15R1.888 O=C([O-])CNCCc1ccc(c(c1)Cl)F 34a_200011997520_100020667443 [0,2,0,0,0,0|1,0,1]=4 13990 B15R1.888 O=C([O-])CNCCc1ccc(c(c1)F)F 34a_200000706328_100020667443 [0,2,0,0,0,0|1,0,1]=4 13991 B15R1.888 O=C([O-])CNCCc1ccc(c(c1)O)O 34a_100000210387_100020667443 [0,2,0,0,0,0|1,0,1]=4 13992 B15R1.888 O=C([O-])COCCc1ccc(c(c1)Cl)Cl 34a_100011709245_100020667443 [0,2,0,0,0,0|1,0,1]=4 13993 B15R1.888 O=C([O-])COCCc1ccc(c(c1)Cl)F 34a_100011830478_100020667443 [0,2,0,0,0,0|1,0,1]=4 13994 B15R1.888 O=C([O-])COCCc1ccc(c(c1)F)Br 34a_100012921202_100020667443 [0,2,0,0,0,0|1,0,1]=4 13995 B15R1.888 O=C([O-])COCCc1ccc(c(c1)F)Cl 34a_100011934464_100020667443 [0,2,0,0,0,0|1,0,1]=4 13996 B15R1.888 O=C([O-])COCCc1ccc(c(c1)F)F 34a_100000690376_100020667443 [0,2,0,0,0,0|1,0,1]=4 13997 B15R1.888 O=C([O-])CSCCc1ccc(c(c1)Cl)Cl 62a_100011713676_100020667443 [0,2,0,0,0,0|1,0,1]=4 13998 B15R1.888 O=C([O-])CSCCc1ccc(c(c1)Cl)Cl 62a_100020667443_100011713676 [0,2,0,0,0,0|1,0,1]=4 13999 B15R1.888 O=C([O-])CSCCc1ccc(c(c1)Cl)F 62a_100012361305_100020667443 [0,2,0,0,0,0|1,0,1]=4 14000 B15R1.888 O=C([O-])CSCCc1ccc(c(c1)Cl)F 62a_100020667443_100012361305 [0,2,0,0,0,0|1,0,1]=4 14001 B15R1.888 O=C([O-])CSCCc1ccc(c(c1)F)F 62a_100000690553_100020667443 [0,2,0,0,0,0|1,0,1]=4 14002 B15R1.888 O=C([O-])CSCCc1ccc(c(c1)F)F 62a_100020667443_100000690553 [0,2,0,0,0,0|1,0,1]=4 14003 B15R1.888 O=C([O-])CSCCc1ccc(c(c1)O)O 62a_100020667443_200010393615 [0,2,0,0,0,0|1,0,1]=4 14004 B15R1.942 C#CC(=O)CCCOc1cccc(c1)C 1458a_100000211873_100000212303 [0,2,0,0,0,0|2,0,0]=4 14005 B15R1.942 C#CC(=O)CCCOc1cccc(c1)Cl 1458a_100000211873_100000742658 [0,2,0,0,0,0|2,0,0]=4 14006 B15R1.942 C=CC(=O)CCCOc1cccc(c1)C 1458a_100000185746_100000212303 [0,2,0,0,0,0|2,0,0]=4 14007 B15R1.942 C=CC(=O)CCCOc1cccc(c1)Cl 1458a_100000185746_100000742658 [0,2,0,0,0,0|2,0,0]=4 14008 B15R1.942 C=CC(=O)NCCCc1cccc(c1)Br 1626a_100000753791_100000185746 [0,2,0,0,0,0|2,0,0]=4 14009 B15R1.942 C=CC(=O)NCCCc1cccc(c1)Br 240690a_100000753791_200121576911 [0,2,0,0,0,0|2,0,0]=4 14010 B15R1.942 C=CC(=O)NCCCc1cccc(c1)C 1626a_103496528808_100000185746 [0,2,0,0,0,0|2,0,0]=4 14011 B15R1.942 C=CC(=O)NCCCc1cccc(c1)C 240690a_103496528808_200121576911 [0,2,0,0,0,0|2,0,0]=4 14012 B15R1.942 C=CC(=O)NCCCc1cccc(c1)Cl 1626a_100000704586_100000185746 [0,2,0,0,0,0|2,0,0]=4 14013 B15R1.942 C=CC(=O)NCCCc1cccc(c1)Cl 240690a_100000704586_200121576911 [0,2,0,0,0,0|2,0,0]=4 14014 B15R1.942 C=CC(=O)NCCCc1cccc(c1)F 1626a_100000754185_100000185746 [0,2,0,0,0,0|2,0,0]=4 14015 B15R1.942 C=CC(=O)NCCCc1cccc(c1)F 240690a_100000754185_200121576911 [0,2,0,0,0,0|2,0,0]=4 14016 B15R1.942 CCC(=O)CCCCc1cccc(c1)Br 1458a_200010160685_100000210202 [0,2,0,0,0,0|1,0,0]=3 14017 B15R1.942 CCC(=O)CCCOc1cccc(c1)C 1458a_100000183260_100000210202 [0,2,0,0,0,0|2,0,0]=4 14018 B15R1.942 CCC(=O)CCCOc1cccc(c1)C 1458a_100000210414_100000212303 [0,2,0,0,0,0|2,0,0]=4 14019 B15R1.942 CCC(=O)CCCOc1cccc(c1)Cl 1458a_100000210414_100000742658 [0,2,0,0,0,0|2,0,0]=4 14020 B15R1.942 CCC(=O)CCCOc1cccc(c1)O 1458a_200009913207_100000210202 [0,2,0,0,0,0|2,0,0]=4 14021 B15R1.942 CCC(=O)COCCc1cccc(c1)Br 34a_100000725409_100011740638 [0,2,0,0,0,0|2,0,0]=4 14022 B15R1.942 CCC(=O)COCCc1cccc(c1)Br 7a_100011217444_100000747405 [0,2,0,0,0,0|2,0,0]=4 14023 B15R1.942 CCC(=O)COCCc1cccc(c1)C 34a_100000725409_100011713685 [0,2,0,0,0,0|2,0,0]=4 14024 B15R1.942 CCC(=O)COCCc1cccc(c1)C 7a_100011217157_100000747405 [0,2,0,0,0,0|2,0,0]=4 14025 B15R1.942 CCC(=O)COCCc1cccc(c1)Cl 34a_100000725409_100011713710 [0,2,0,0,0,0|2,0,0]=4 14026 B15R1.942 CCC(=O)COCCc1cccc(c1)Cl 7a_100000754733_100000747405 [0,2,0,0,0,0|2,0,0]=4 14027 B15R1.942 CCC(=O)COCCc1cccc(c1)F 34a_100000725409_100011217235 [0,2,0,0,0,0|2,0,0]=4 14028 B15R1.942 CCC(=O)COCCc1cccc(c1)F 7a_100000763591_100000747405 [0,2,0,0,0,0|2,0,0]=4 14029 B15R1.942 CCC(=O)CSCCc1cccc(c1)Br 62a_100000747405_100011740638 [0,2,0,0,0,0|2,0,0]=4 14030 B15R1.942 CCC(=O)CSCCc1cccc(c1)Br 62a_100011740638_100000747405 [0,2,0,0,0,0|2,0,0]=4 14031 B15R1.942 CCC(=O)CSCCc1cccc(c1)C 62a_100000747405_100011713685 [0,2,0,0,0,0|2,0,0]=4 14032 B15R1.942 CCC(=O)CSCCc1cccc(c1)C 62a_100011713685_100000747405 [0,2,0,0,0,0|2,0,0]=4 14033 B15R1.942 CCC(=O)CSCCc1cccc(c1)Cl 62a_100000747405_100011713710 [0,2,0,0,0,0|2,0,0]=4 14034 B15R1.942 CCC(=O)CSCCc1cccc(c1)Cl 62a_100011713710_100000747405 [0,2,0,0,0,0|2,0,0]=4 14035 B15R1.942 CCC(=O)CSCCc1cccc(c1)F 62a_100000747405_100011217235 [0,2,0,0,0,0|2,0,0]=4 14036 B15R1.942 CCC(=O)CSCCc1cccc(c1)F 62a_100011217235_100000747405 [0,2,0,0,0,0|2,0,0]=4 14037 B15R1.942 CCC(=O)NCCCc1cccc(c1)Br 11a_100000753791_100000210414 [0,2,0,0,0,0|2,0,0]=4 14038 B15R1.942 CCC(=O)NCCCc1cccc(c1)Br 1626a_100000753791_100000210414 [0,2,0,0,0,0|2,0,0]=4 14039 B15R1.942 CCC(=O)NCCCc1cccc(c1)Br 240690a_100000753791_100000210414 [0,2,0,0,0,0|2,0,0]=4 14040 B15R1.942 CCC(=O)NCCCc1cccc(c1)Br 527a_100000753791_100000210414 [0,2,0,0,0,0|2,0,0]=4 14041 B15R1.942 CCC(=O)NCCCc1cccc(c1)C 11a_103496528808_100000210414 [0,2,0,0,0,0|2,0,0]=4 14042 B15R1.942 CCC(=O)NCCCc1cccc(c1)C 1626a_103496528808_100000210414 [0,2,0,0,0,0|2,0,0]=4 14043 B15R1.942 CCC(=O)NCCCc1cccc(c1)C 240690a_103496528808_100000210414 [0,2,0,0,0,0|2,0,0]=4 14044 B15R1.942 CCC(=O)NCCCc1cccc(c1)C 527a_103496528808_100000210414 [0,2,0,0,0,0|2,0,0]=4 14045 B15R1.942 CCC(=O)NCCCc1cccc(c1)Cl 11a_100000704586_100000210414 [0,2,0,0,0,0|2,0,0]=4 14046 B15R1.942 CCC(=O)NCCCc1cccc(c1)Cl 1626a_100000704586_100000210414 [0,2,0,0,0,0|2,0,0]=4 14047 B15R1.942 CCC(=O)NCCCc1cccc(c1)Cl 240690a_100000704586_100000210414 [0,2,0,0,0,0|2,0,0]=4 14048 B15R1.942 CCC(=O)NCCCc1cccc(c1)Cl 527a_100000704586_100000210414 [0,2,0,0,0,0|2,0,0]=4 14049 B15R1.942 CCC(=O)NCCCc1cccc(c1)F 11a_100000754185_100000210414 [0,2,0,0,0,0|2,0,0]=4 14050 B15R1.942 CCC(=O)NCCCc1cccc(c1)F 1626a_100000754185_100000210414 [0,2,0,0,0,0|2,0,0]=4 14051 B15R1.942 CCC(=O)NCCCc1cccc(c1)F 240690a_100000754185_100000210414 [0,2,0,0,0,0|2,0,0]=4 14052 B15R1.942 CCC(=O)NCCCc1cccc(c1)F 527a_100000754185_100000210414 [0,2,0,0,0,0|2,0,0]=4 14053 B15R1.942 CNC(=O)CCCCc1cccc(c1)Br 11a_106832991635_200010160685 [0,2,0,0,0,0|1,0,0]=3 14054 B15R1.942 CNC(=O)CCCCc1cccc(c1)Br 1626a_100102657272_200010160685 [0,2,0,0,0,0|1,0,0]=3 14055 B15R1.942 CNC(=O)CCCCc1cccc(c1)Br 240690a_100102657272_200010160685 [0,2,0,0,0,0|1,0,0]=3 14056 B15R1.942 CNC(=O)CCCCc1cccc(c1)Br 527a_100102657272_200010160685 [0,2,0,0,0,0|1,0,0]=3 14057 B15R1.942 CNC(=O)CCCNc1cccc(c1)Br 34a_100000210019_100000741757 [0,2,0,0,0,0|2,0,0]=4 14058 B15R1.942 CNC(=O)CCCNc1cccc(c1)C 2230a_100000188690_100000741757 [0,2,0,0,0,0|2,0,0]=4 14059 B15R1.942 CNC(=O)CCCNc1cccc(c1)C 34a_100000188690_100000741757 [0,2,0,0,0,0|2,0,0]=4 14060 B15R1.942 CNC(=O)CCCNc1cccc(c1)Cl 34a_100000185859_100000741757 [0,2,0,0,0,0|2,0,0]=4 14061 B15R1.942 CNC(=O)CCCNc1cccc(c1)F 34a_100000210047_100000741757 [0,2,0,0,0,0|2,0,0]=4 14062 B15R1.942 CNC(=O)CCCNc1cccc(c1)I 34a_100000211102_100000741757 [0,2,0,0,0,0|2,0,0]=4 14063 B15R1.942 CNC(=O)CCCNc1cccc(c1)O 34a_100000210217_100000741757 [0,2,0,0,0,0|2,0,0]=4 14064 B15R1.942 CNC(=O)CCCOc1cccc(c1)Br 34a_100000210342_100000741757 [0,2,0,0,0,0|2,0,0]=4 14065 B15R1.942 CNC(=O)CCCOc1cccc(c1)Br 7a_100000210342_100000741757 [0,2,0,0,0,0|2,0,0]=4 14066 B15R1.942 CNC(=O)CCCOc1cccc(c1)C 11a_106832991635_100000183260 [0,2,0,0,0,0|2,0,0]=4 14067 B15R1.942 CNC(=O)CCCOc1cccc(c1)C 1626a_100102657272_100000183260 [0,2,0,0,0,0|2,0,0]=4 14068 B15R1.942 CNC(=O)CCCOc1cccc(c1)C 240690a_100102657272_100000183260 [0,2,0,0,0,0|2,0,0]=4 14069 B15R1.942 CNC(=O)CCCOc1cccc(c1)C 34a_100000210337_100000741757 [0,2,0,0,0,0|2,0,0]=4 14070 B15R1.942 CNC(=O)CCCOc1cccc(c1)C 527a_100102657272_100000183260 [0,2,0,0,0,0|2,0,0]=4 14071 B15R1.942 CNC(=O)CCCOc1cccc(c1)C 7a_100000210337_100000741757 [0,2,0,0,0,0|2,0,0]=4 14072 B15R1.942 CNC(=O)CCCOc1cccc(c1)Cl 34a_100000210295_100000741757 [0,2,0,0,0,0|2,0,0]=4 14073 B15R1.942 CNC(=O)CCCOc1cccc(c1)Cl 7a_100000210295_100000741757 [0,2,0,0,0,0|2,0,0]=4 14074 B15R1.942 CNC(=O)CCCOc1cccc(c1)F 34a_100000210426_100000741757 [0,2,0,0,0,0|2,0,0]=4 14075 B15R1.942 CNC(=O)CCCOc1cccc(c1)F 7a_100000210426_100000741757 [0,2,0,0,0,0|2,0,0]=4 14076 B15R1.942 CNC(=O)CCCOc1cccc(c1)I 34a_100000211634_100000741757 [0,2,0,0,0,0|2,0,0]=4 14077 B15R1.942 CNC(=O)CCCOc1cccc(c1)I 7a_100000211634_100000741757 [0,2,0,0,0,0|2,0,0]=4 14078 B15R1.942 CNC(=O)CCCOc1cccc(c1)N 34a_100000210217_100000741757 [0,2,0,0,0,0|2,0,0]=4 14079 B15R1.942 CNC(=O)CCCOc1cccc(c1)O 240690a_100102657272_200009913207 [0,2,0,0,0,0|2,0,0]=4 14080 B15R1.942 CNC(=O)CCCOc1cccc(c1)O 527a_100102657272_200009913207 [0,2,0,0,0,0|2,0,0]=4 14081 B15R1.942 CNC(=O)CCCSc1cccc(c1)Br 62a_100000691529_100000741757 [0,2,0,0,0,0|2,0,0]=4 14082 B15R1.942 CNC(=O)CCCSc1cccc(c1)Br 62a_100000741757_100000691529 [0,2,0,0,0,0|2,0,0]=4 14083 B15R1.942 CNC(=O)CCCSc1cccc(c1)C 62a_100000741757_100011215228 [0,2,0,0,0,0|2,0,0]=4 14084 B15R1.942 CNC(=O)CCCSc1cccc(c1)C 62a_100011215228_100000741757 [0,2,0,0,0,0|2,0,0]=4 14085 B15R1.942 CNC(=O)CCCSc1cccc(c1)Cl 62a_100000699651_100000741757 [0,2,0,0,0,0|2,0,0]=4 14086 B15R1.942 CNC(=O)CCCSc1cccc(c1)Cl 62a_100000741757_100000699651 [0,2,0,0,0,0|2,0,0]=4 14087 B15R1.942 CNC(=O)CCCSc1cccc(c1)F 62a_100000685547_100000741757 [0,2,0,0,0,0|2,0,0]=4 14088 B15R1.942 CNC(=O)CCCSc1cccc(c1)F 62a_100000741757_100000685547 [0,2,0,0,0,0|2,0,0]=4 14089 B15R1.942 CNC(=O)CCCSc1cccc(c1)N 62a_100000210019_100000741757 [0,2,0,0,0,0|2,0,0]=4 14090 B15R1.942 CNC(=O)CCCSc1cccc(c1)N 62a_100000741757_100000210019 [0,2,0,0,0,0|2,0,0]=4 14091 B15R1.942 CNC(=O)CCCSc1cccc(c1)O 62a_100000741757_100000211634 [0,2,0,0,0,0|2,0,0]=4 14092 B15R1.942 CNC(=O)CCCSc1cccc(c1)[S] 62a_100000741757_114929384022 [0,2,0,0,0,0|2,0,0]=4 14093 B15R1.942 CNC(=O)CCCSc1cccc(c1)[S] 62a_114929384022_100000741757 [0,2,0,0,0,0|2,0,0]=4 14094 B15R1.942 CNC(=O)CCNCc1cccc(c1)Br 207a_100000738227_100000210085 [0,2,0,0,0,0|2,0,0]=4 14095 B15R1.942 CNC(=O)CCNCc1cccc(c1)Br 2230a_100000174977_100000737683 [0,2,0,0,0,0|2,0,0]=4 14096 B15R1.942 CNC(=O)CCNCc1cccc(c1)Br 2230a_100000738227_100000698116 [0,2,0,0,0,0|2,0,0]=4 14097 B15R1.942 CNC(=O)CCNCc1cccc(c1)Br 270004a_100000738227_100000210085 [0,2,0,0,0,0|2,0,0]=4 14098 B15R1.942 CNC(=O)CCNCc1cccc(c1)Br 34a_100000174977_100012179268 [0,2,0,0,0,0|2,0,0]=4 14099 B15R1.942 CNC(=O)CCNCc1cccc(c1)Br 34a_100000738227_100000698116 [0,2,0,0,0,0|2,0,0]=4 14100 B15R1.942 CNC(=O)CCNCc1cccc(c1)C 207a_100000738227_100000211157 [0,2,0,0,0,0|2,0,0]=4 14101 B15R1.942 CNC(=O)CCNCc1cccc(c1)C 2230a_100000185548_100000737683 [0,2,0,0,0,0|2,0,0]=4 14102 B15R1.942 CNC(=O)CCNCc1cccc(c1)C 2230a_100000738227_100000211840 [0,2,0,0,0,0|2,0,0]=4 14103 B15R1.942 CNC(=O)CCNCc1cccc(c1)C 270004a_100000738227_100000211157 [0,2,0,0,0,0|2,0,0]=4 14104 B15R1.942 CNC(=O)CCNCc1cccc(c1)C 34a_100000185548_100012179268 [0,2,0,0,0,0|2,0,0]=4 14105 B15R1.942 CNC(=O)CCNCc1cccc(c1)C 34a_100000738227_100000211840 [0,2,0,0,0,0|2,0,0]=4 14106 B15R1.942 CNC(=O)CCNCc1cccc(c1)Cl 207a_100000738227_100000210801 [0,2,0,0,0,0|2,0,0]=4 14107 B15R1.942 CNC(=O)CCNCc1cccc(c1)Cl 2230a_100000174878_100000737683 [0,2,0,0,0,0|2,0,0]=4 14108 B15R1.942 CNC(=O)CCNCc1cccc(c1)Cl 2230a_100000738227_100000181238 [0,2,0,0,0,0|2,0,0]=4 14109 B15R1.942 CNC(=O)CCNCc1cccc(c1)Cl 270004a_100000738227_100000210801 [0,2,0,0,0,0|2,0,0]=4 14110 B15R1.942 CNC(=O)CCNCc1cccc(c1)Cl 34a_100000174878_100012179268 [0,2,0,0,0,0|2,0,0]=4 14111 B15R1.942 CNC(=O)CCNCc1cccc(c1)Cl 34a_100000738227_100000187163 [0,2,0,0,0,0|2,0,0]=4 14112 B15R1.942 CNC(=O)CCNCc1cccc(c1)F 207a_100000738227_100000210812 [0,2,0,0,0,0|2,0,0]=4 14113 B15R1.942 CNC(=O)CCNCc1cccc(c1)F 2230a_100000174948_100000737683 [0,2,0,0,0,0|2,0,0]=4 14114 B15R1.942 CNC(=O)CCNCc1cccc(c1)F 2230a_100000738227_100000230114 [0,2,0,0,0,0|2,0,0]=4 14115 B15R1.942 CNC(=O)CCNCc1cccc(c1)F 270004a_100000738227_100000210812 [0,2,0,0,0,0|2,0,0]=4 14116 B15R1.942 CNC(=O)CCNCc1cccc(c1)F 34a_100000174948_100012179268 [0,2,0,0,0,0|2,0,0]=4 14117 B15R1.942 CNC(=O)CCNCc1cccc(c1)F 34a_100000738227_100000187166 [0,2,0,0,0,0|2,0,0]=4 14118 B15R1.942 CNC(=O)CCNCc1cccc(c1)I 207a_100000738227_100000014684 [0,2,0,0,0,0|2,0,0]=4 14119 B15R1.942 CNC(=O)CCNCc1cccc(c1)I 2230a_100000106179_100000737683 [0,2,0,0,0,0|2,0,0]=4 14120 B15R1.942 CNC(=O)CCNCc1cccc(c1)I 2230a_100000738227_100011218688 [0,2,0,0,0,0|2,0,0]=4 14121 B15R1.942 CNC(=O)CCNCc1cccc(c1)I 270004a_100000738227_100000014684 [0,2,0,0,0,0|2,0,0]=4 14122 B15R1.942 CNC(=O)CCNCc1cccc(c1)I 34a_100000106179_100012179268 [0,2,0,0,0,0|2,0,0]=4 14123 B15R1.942 CNC(=O)CCNCc1cccc(c1)I 34a_100000738227_100011218688 [0,2,0,0,0,0|2,0,0]=4 14124 B15R1.942 CNC(=O)CCNCc1cccc(c1)O 207a_100000738227_100000188321 [0,2,0,0,0,0|2,0,0]=4 14125 B15R1.942 CNC(=O)CCNCc1cccc(c1)O 2230a_100000738227_100011660834 [0,2,0,0,0,0|2,0,0]=4 14126 B15R1.942 CNC(=O)CCNCc1cccc(c1)O 2230a_100000743036_100000737683 [0,2,0,0,0,0|2,0,0]=4 14127 B15R1.942 CNC(=O)CCNCc1cccc(c1)O 270004a_100000738227_100000188321 [0,2,0,0,0,0|2,0,0]=4 14128 B15R1.942 CNC(=O)CCNCc1cccc(c1)O 34a_100000738227_100011660834 [0,2,0,0,0,0|2,0,0]=4 14129 B15R1.942 CNC(=O)CCNCc1cccc(c1)O 34a_100000743036_100012179268 [0,2,0,0,0,0|2,0,0]=4 14130 B15R1.942 CNC(=O)CCOCc1cccc(c1)Br 34a_100000687537_100012179268 [0,2,0,0,0,0|2,0,0]=4 14131 B15R1.942 CNC(=O)CCOCc1cccc(c1)Br 34a_100000754576_100000698116 [0,2,0,0,0,0|2,0,0]=4 14132 B15R1.942 CNC(=O)CCOCc1cccc(c1)Br 7a_100000687537_100000737683 [0,2,0,0,0,0|2,0,0]=4 14133 B15R1.942 CNC(=O)CCOCc1cccc(c1)C 34a_100000754576_100000211840 [0,2,0,0,0,0|2,0,0]=4 14134 B15R1.942 CNC(=O)CCOCc1cccc(c1)C 34a_100011217746_100012179268 [0,2,0,0,0,0|2,0,0]=4 14135 B15R1.942 CNC(=O)CCOCc1cccc(c1)C 7a_100011217746_100000737683 [0,2,0,0,0,0|2,0,0]=4 14136 B15R1.942 CNC(=O)CCOCc1cccc(c1)Cl 34a_100000241301_100012179268 [0,2,0,0,0,0|2,0,0]=4 14137 B15R1.942 CNC(=O)CCOCc1cccc(c1)Cl 34a_100000754576_100000187163 [0,2,0,0,0,0|2,0,0]=4 14138 B15R1.942 CNC(=O)CCOCc1cccc(c1)Cl 7a_100000241301_100000737683 [0,2,0,0,0,0|2,0,0]=4 14139 B15R1.942 CNC(=O)CCOCc1cccc(c1)F 34a_100000210976_100012179268 [0,2,0,0,0,0|2,0,0]=4 14140 B15R1.942 CNC(=O)CCOCc1cccc(c1)F 34a_100000754576_100000187166 [0,2,0,0,0,0|2,0,0]=4 14141 B15R1.942 CNC(=O)CCOCc1cccc(c1)F 7a_100000210976_100000737683 [0,2,0,0,0,0|2,0,0]=4 14142 B15R1.942 CNC(=O)CCOCc1cccc(c1)I 34a_100000754576_100011218688 [0,2,0,0,0,0|2,0,0]=4 14143 B15R1.942 CNC(=O)CCOCc1cccc(c1)I 34a_100011215336_100012179268 [0,2,0,0,0,0|2,0,0]=4 14144 B15R1.942 CNC(=O)CCOCc1cccc(c1)I 7a_100011215336_100000737683 [0,2,0,0,0,0|2,0,0]=4 14145 B15R1.942 CNC(=O)CCOCc1cccc(c1)N 34a_100000211919_100012179268 [0,2,0,0,0,0|2,0,0]=4 14146 B15R1.942 CNC(=O)CCOCc1cccc(c1)O 34a_100000754576_100011660834 [0,2,0,0,0,0|2,0,0]=4 14147 B15R1.942 CNC(=O)CCSCc1cccc(c1)Br 62a_100000211773_100000737683 [0,2,0,0,0,0|2,0,0]=4 14148 B15R1.942 CNC(=O)CCSCc1cccc(c1)Br 62a_100000737683_100000211773 [0,2,0,0,0,0|2,0,0]=4 14149 B15R1.942 CNC(=O)CCSCc1cccc(c1)C 62a_100000211840_100000737683 [0,2,0,0,0,0|2,0,0]=4 14150 B15R1.942 CNC(=O)CCSCc1cccc(c1)C 62a_100000737683_100000211840 [0,2,0,0,0,0|2,0,0]=4 14151 B15R1.942 CNC(=O)CCSCc1cccc(c1)Cl 62a_100000187163_100000737683 [0,2,0,0,0,0|2,0,0]=4 14152 B15R1.942 CNC(=O)CCSCc1cccc(c1)Cl 62a_100000737683_100000187163 [0,2,0,0,0,0|2,0,0]=4 14153 B15R1.942 CNC(=O)CCSCc1cccc(c1)F 62a_100000230114_100000737683 [0,2,0,0,0,0|2,0,0]=4 14154 B15R1.942 CNC(=O)CCSCc1cccc(c1)F 62a_100000737683_100000230114 [0,2,0,0,0,0|2,0,0]=4 14155 B15R1.942 CNC(=O)CCSCc1cccc(c1)I 62a_100000737683_100011218688 [0,2,0,0,0,0|2,0,0]=4 14156 B15R1.942 CNC(=O)CCSCc1cccc(c1)I 62a_100011218688_100000737683 [0,2,0,0,0,0|2,0,0]=4 14157 B15R1.942 CNC(=O)CCSCc1cccc(c1)O 62a_100000737683_100011660834 [0,2,0,0,0,0|2,0,0]=4 14158 B15R1.942 CNC(=O)CCSCc1cccc(c1)O 62a_100011660834_100000737683 [0,2,0,0,0,0|2,0,0]=4 14159 B15R1.942 CNC(=O)CNCCc1cccc(c1)Br 2230a_100000693194_100011740638 [0,2,0,0,0,0|2,0,0]=4 14160 B15R1.942 CNC(=O)CNCCc1cccc(c1)Br 2230a_100011207229_100000183359 [0,2,0,0,0,0|2,0,0]=4 14161 B15R1.942 CNC(=O)CNCCc1cccc(c1)Br 34a_100011207229_100000183359 [0,2,0,0,0,0|2,0,0]=4 14162 B15R1.942 CNC(=O)CNCCc1cccc(c1)C 2230a_100000693194_100011713685 [0,2,0,0,0,0|2,0,0]=4 14163 B15R1.942 CNC(=O)CNCCc1cccc(c1)C 2230a_100000749837_100000183359 [0,2,0,0,0,0|2,0,0]=4 14164 B15R1.942 CNC(=O)CNCCc1cccc(c1)C 34a_100000749837_100000183359 [0,2,0,0,0,0|2,0,0]=4 14165 B15R1.942 CNC(=O)CNCCc1cccc(c1)Cl 2230a_100000185263_100000183359 [0,2,0,0,0,0|2,0,0]=4 14166 B15R1.942 CNC(=O)CNCCc1cccc(c1)Cl 2230a_100000693194_100011713710 [0,2,0,0,0,0|2,0,0]=4 14167 B15R1.942 CNC(=O)CNCCc1cccc(c1)Cl 34a_100000185263_100000183359 [0,2,0,0,0,0|2,0,0]=4 14168 B15R1.942 CNC(=O)CNCCc1cccc(c1)F 2230a_100000205154_100000183359 [0,2,0,0,0,0|2,0,0]=4 14169 B15R1.942 CNC(=O)CNCCc1cccc(c1)F 2230a_100000693194_100011217235 [0,2,0,0,0,0|2,0,0]=4 14170 B15R1.942 CNC(=O)CNCCc1cccc(c1)F 34a_100000205154_100000183359 [0,2,0,0,0,0|2,0,0]=4 14171 B15R1.942 CNC(=O)CNCCc1cccc(c1)O 2230a_100000747277_100000183359 [0,2,0,0,0,0|2,0,0]=4 14172 B15R1.942 CNC(=O)CNCCc1cccc(c1)O 34a_100000747277_100000183359 [0,2,0,0,0,0|2,0,0]=4 14173 B15R1.942 CNC(=O)COCCc1cccc(c1)Br 34a_100000750040_100011740638 [0,2,0,0,0,0|2,0,0]=4 14174 B15R1.942 CNC(=O)COCCc1cccc(c1)Br 34a_100011217444_100000183359 [0,2,0,0,0,0|2,0,0]=4 14175 B15R1.942 CNC(=O)COCCc1cccc(c1)Br 7a_100011217444_100000183359 [0,2,0,0,0,0|2,0,0]=4 14176 B15R1.942 CNC(=O)COCCc1cccc(c1)C 34a_100000750040_100011713685 [0,2,0,0,0,0|2,0,0]=4 14177 B15R1.942 CNC(=O)COCCc1cccc(c1)C 34a_100011217157_100000183359 [0,2,0,0,0,0|2,0,0]=4 14178 B15R1.942 CNC(=O)COCCc1cccc(c1)C 7a_100011217157_100000183359 [0,2,0,0,0,0|2,0,0]=4 14179 B15R1.942 CNC(=O)COCCc1cccc(c1)Cl 34a_100000750040_100011713710 [0,2,0,0,0,0|2,0,0]=4 14180 B15R1.942 CNC(=O)COCCc1cccc(c1)Cl 34a_100000754733_100000183359 [0,2,0,0,0,0|2,0,0]=4 14181 B15R1.942 CNC(=O)COCCc1cccc(c1)Cl 7a_100000754733_100000183359 [0,2,0,0,0,0|2,0,0]=4 14182 B15R1.942 CNC(=O)COCCc1cccc(c1)F 34a_100000750040_100011217235 [0,2,0,0,0,0|2,0,0]=4 14183 B15R1.942 CNC(=O)COCCc1cccc(c1)F 34a_100000763591_100000183359 [0,2,0,0,0,0|2,0,0]=4 14184 B15R1.942 CNC(=O)COCCc1cccc(c1)F 7a_100000763591_100000183359 [0,2,0,0,0,0|2,0,0]=4 14185 B15R1.942 CNC(=O)COCCc1cccc(c1)N 34a_100011996697_100000183359 [0,2,0,0,0,0|2,0,0]=4 14186 B15R1.942 CNC(=O)CSCCc1cccc(c1)Br 62a_100000183359_100011740638 [0,2,0,0,0,0|2,0,0]=4 14187 B15R1.942 CNC(=O)CSCCc1cccc(c1)Br 62a_100011740638_100000183359 [0,2,0,0,0,0|2,0,0]=4 14188 B15R1.942 CNC(=O)CSCCc1cccc(c1)C 62a_100000183359_100011713685 [0,2,0,0,0,0|2,0,0]=4 14189 B15R1.942 CNC(=O)CSCCc1cccc(c1)C 62a_100011713685_100000183359 [0,2,0,0,0,0|2,0,0]=4 14190 B15R1.942 CNC(=O)CSCCc1cccc(c1)Cl 62a_100000183359_100011713710 [0,2,0,0,0,0|2,0,0]=4 14191 B15R1.942 CNC(=O)CSCCc1cccc(c1)Cl 62a_100011713710_100000183359 [0,2,0,0,0,0|2,0,0]=4 14192 B15R1.942 CNC(=O)CSCCc1cccc(c1)F 62a_100000183359_100011217235 [0,2,0,0,0,0|2,0,0]=4 14193 B15R1.942 CNC(=O)CSCCc1cccc(c1)F 62a_100011217235_100000183359 [0,2,0,0,0,0|2,0,0]=4 14194 B15R1.942 CNC(=O)NCCCc1cccc(c1)Br 2708a_100000753791_106832991635 [0,2,0,0,0,0|2,0,0]=4 14195 B15R1.942 CNC(=O)NCCCc1cccc(c1)Br 2708a_100102657272_100000753791 [0,2,0,0,0,0|2,0,0]=4 14196 B15R1.942 CNC(=O)NCCCc1cccc(c1)Br 273464a_100000753791_100102657272 [0,2,0,0,0,0|2,0,0]=4 14197 B15R1.942 CNC(=O)NCCCc1cccc(c1)Br 273464a_100102657272_100000753791 [0,2,0,0,0,0|2,0,0]=4 14198 B15R1.942 CNC(=O)NCCCc1cccc(c1)Br 512a_100000753791_100102657272 [0,2,0,0,0,0|2,0,0]=4 14199 B15R1.942 CNC(=O)NCCCc1cccc(c1)Br 512a_106832991638_100000753791 [0,2,0,0,0,0|2,0,0]=4 14200 B15R1.942 CNC(=O)NCCCc1cccc(c1)C 2708a_100102657272_103496528808 [0,2,0,0,0,0|2,0,0]=4 14201 B15R1.942 CNC(=O)NCCCc1cccc(c1)C 2708a_103496528808_106832991635 [0,2,0,0,0,0|2,0,0]=4 14202 B15R1.942 CNC(=O)NCCCc1cccc(c1)C 273464a_100102657272_103496528808 [0,2,0,0,0,0|2,0,0]=4 14203 B15R1.942 CNC(=O)NCCCc1cccc(c1)C 273464a_103496528808_100102657272 [0,2,0,0,0,0|2,0,0]=4 14204 B15R1.942 CNC(=O)NCCCc1cccc(c1)C 512a_103496528808_100102657272 [0,2,0,0,0,0|2,0,0]=4 14205 B15R1.942 CNC(=O)NCCCc1cccc(c1)C 512a_106832991638_103496528808 [0,2,0,0,0,0|2,0,0]=4 14206 B15R1.942 CNC(=O)NCCCc1cccc(c1)Cl 2708a_100000704586_106832991635 [0,2,0,0,0,0|2,0,0]=4 14207 B15R1.942 CNC(=O)NCCCc1cccc(c1)Cl 2708a_100102657272_100000704586 [0,2,0,0,0,0|2,0,0]=4 14208 B15R1.942 CNC(=O)NCCCc1cccc(c1)Cl 273464a_100000704586_100102657272 [0,2,0,0,0,0|2,0,0]=4 14209 B15R1.942 CNC(=O)NCCCc1cccc(c1)Cl 273464a_100102657272_100000704586 [0,2,0,0,0,0|2,0,0]=4 14210 B15R1.942 CNC(=O)NCCCc1cccc(c1)Cl 512a_100000704586_100102657272 [0,2,0,0,0,0|2,0,0]=4 14211 B15R1.942 CNC(=O)NCCCc1cccc(c1)Cl 512a_106832991638_100000704586 [0,2,0,0,0,0|2,0,0]=4 14212 B15R1.942 CNC(=O)NCCCc1cccc(c1)F 2708a_100000754185_106832991635 [0,2,0,0,0,0|2,0,0]=4 14213 B15R1.942 CNC(=O)NCCCc1cccc(c1)F 2708a_100102657272_100000754185 [0,2,0,0,0,0|2,0,0]=4 14214 B15R1.942 CNC(=O)NCCCc1cccc(c1)F 273464a_100000754185_100102657272 [0,2,0,0,0,0|2,0,0]=4 14215 B15R1.942 CNC(=O)NCCCc1cccc(c1)F 273464a_100102657272_100000754185 [0,2,0,0,0,0|2,0,0]=4 14216 B15R1.942 CNC(=O)NCCCc1cccc(c1)F 512a_100000754185_100102657272 [0,2,0,0,0,0|2,0,0]=4 14217 B15R1.942 CNC(=O)NCCCc1cccc(c1)F 512a_106832991638_100000754185 [0,2,0,0,0,0|2,0,0]=4 14218 B15R1.942 COC(=O)CCCNc1cccc(c1)Br 34a_100000210019_100000742333 [0,2,0,0,0,0|1,0,0]=3 14219 B15R1.942 COC(=O)CCCNc1cccc(c1)C 2230a_100000188690_100011218270 [0,2,0,0,0,0|1,0,0]=3 14220 B15R1.942 COC(=O)CCCNc1cccc(c1)C 34a_100000188690_100000742333 [0,2,0,0,0,0|1,0,0]=3 14221 B15R1.942 COC(=O)CCCNc1cccc(c1)Cl 34a_100000185859_100000742333 [0,2,0,0,0,0|1,0,0]=3 14222 B15R1.942 COC(=O)CCCNc1cccc(c1)F 34a_100000210047_100000742333 [0,2,0,0,0,0|1,0,0]=3 14223 B15R1.942 COC(=O)CCCNc1cccc(c1)I 34a_100000211102_100000742333 [0,2,0,0,0,0|1,0,0]=3 14224 B15R1.942 COC(=O)CCCNc1cccc(c1)O 34a_100000210217_100000742333 [0,2,0,0,0,0|1,0,0]=3 14225 B15R1.942 COC(=O)CCCOc1cc[nH]c(=O)c1 34a_100000032262_100000742333 [0,2,0,0,0,0|2,0,0]=4 14226 B15R1.942 COC(=O)CCCOc1ccc[n+](c1)[O-] 34a_100000039713_100000742333 [0,2,0,0,0,0|2,0,0]=4 14227 B15R1.942 COC(=O)CCCOc1ccc[n+](c1)[O-] 7a_100000039713_100011218270 [0,2,0,0,0,0|2,0,0]=4 14228 B15R1.942 COC(=O)CCCOc1cccc(=O)[nH]1 34a_100000033347_100000742333 [0,2,0,0,0,0|2,0,0]=4 14229 B15R1.942 COC(=O)CCCOc1cccc(c1)Br 34a_100000210342_100000742333 [0,2,0,0,0,0|1,0,0]=3 14230 B15R1.942 COC(=O)CCCOc1cccc(c1)Br 7a_100000210342_100011218270 [0,2,0,0,0,0|1,0,0]=3 14231 B15R1.942 COC(=O)CCCOc1cccc(c1)C 34a_100000210337_100000742333 [0,2,0,0,0,0|1,0,0]=3 14232 B15R1.942 COC(=O)CCCOc1cccc(c1)C 7a_100000210337_100011218270 [0,2,0,0,0,0|1,0,0]=3 14233 B15R1.942 COC(=O)CCCOc1cccc(c1)Cl 34a_100000210295_100000742333 [0,2,0,0,0,0|1,0,0]=3 14234 B15R1.942 COC(=O)CCCOc1cccc(c1)Cl 7a_100000210295_100011218270 [0,2,0,0,0,0|1,0,0]=3 14235 B15R1.942 COC(=O)CCCOc1cccc(c1)F 34a_100000210426_100000742333 [0,2,0,0,0,0|1,0,0]=3 14236 B15R1.942 COC(=O)CCCOc1cccc(c1)F 7a_100000210426_100011218270 [0,2,0,0,0,0|1,0,0]=3 14237 B15R1.942 COC(=O)CCCOc1cccc(c1)I 34a_100000211634_100000742333 [0,2,0,0,0,0|1,0,0]=3 14238 B15R1.942 COC(=O)CCCOc1cccc(c1)I 7a_100000211634_100011218270 [0,2,0,0,0,0|1,0,0]=3 14239 B15R1.942 COC(=O)CCCOc1cccc(c1)N 34a_100000210217_100000742333 [0,2,0,0,0,0|1,0,0]=3 14240 B15R1.942 COC(=O)CCCOc1cccc(n1)F 34a_100011432558_100000742333 [0,2,0,0,0,0|2,0,0]=4 14241 B15R1.942 COC(=O)CCCOc1ccnc(c1)C 34a_100000688365_100000742333 [0,2,0,0,0,0|2,0,0]=4 14242 B15R1.942 COC(=O)CCCOc1ccnc(c1)Cl 34a_100000762945_100000742333 [0,2,0,0,0,0|2,0,0]=4 14243 B15R1.942 COC(=O)CCCOc1ccnc(c1)F 34a_100000732698_100000742333 [0,2,0,0,0,0|2,0,0]=4 14244 B15R1.942 COC(=O)CCCOc1ccnc(c1)N 34a_100011834064_100000742333 [0,2,0,0,0,0|2,0,0]=4 14245 B15R1.942 COC(=O)CCCOc1cncc(c1)Br 34a_100000754920_100000742333 [0,2,0,0,0,0|2,0,0]=4 14246 B15R1.942 COC(=O)CCCOc1cncc(c1)Br 7a_100000754920_100011218270 [0,2,0,0,0,0|2,0,0]=4 14247 B15R1.942 COC(=O)CCCOc1cncc(c1)C 34a_100011830280_100000742333 [0,2,0,0,0,0|2,0,0]=4 14248 B15R1.942 COC(=O)CCCOc1cncc(c1)C 7a_100011830280_100011218270 [0,2,0,0,0,0|2,0,0]=4 14249 B15R1.942 COC(=O)CCCOc1cncc(c1)Cl 7a_100000032511_100011218270 [0,2,0,0,0,0|2,0,0]=4 14250 B15R1.942 COC(=O)CCCOc1cncc(c1)F 34a_100011830296_100000742333 [0,2,0,0,0,0|2,0,0]=4 14251 B15R1.942 COC(=O)CCCOc1cncc(c1)F 7a_100011830296_100011218270 [0,2,0,0,0,0|2,0,0]=4 14252 B15R1.942 COC(=O)CCCOc1cncc(c1)N 34a_100011997051_100000742333 [0,2,0,0,0,0|2,0,0]=4 14253 B15R1.942 COC(=O)CCCSc1cc(=O)cc[nH]1 62a_100009817434_100011218270 [0,2,0,0,0,0|2,0,0]=4 14254 B15R1.942 COC(=O)CCCSc1cc(ccn1)C 62a_100000750283_100011218270 [0,2,0,0,0,0|2,0,0]=4 14255 B15R1.942 COC(=O)CCCSc1cc(ccn1)C 62a_100011218270_100000750283 [0,2,0,0,0,0|2,0,0]=4 14256 B15R1.942 COC(=O)CCCSc1cc(ccn1)Cl 62a_100010167805_100011218270 [0,2,0,0,0,0|2,0,0]=4 14257 B15R1.942 COC(=O)CCCSc1cc(ccn1)Cl 62a_100011218270_100010167805 [0,2,0,0,0,0|2,0,0]=4 14258 B15R1.942 COC(=O)CCCSc1cc(ccn1)F 62a_100000764206_100011218270 [0,2,0,0,0,0|2,0,0]=4 14259 B15R1.942 COC(=O)CCCSc1cc(ccn1)F 62a_100011218270_100000764206 [0,2,0,0,0,0|2,0,0]=4 14260 B15R1.942 COC(=O)CCCSc1cc(ccn1)N 62a_100009814236_100011218270 [0,2,0,0,0,0|2,0,0]=4 14261 B15R1.942 COC(=O)CCCSc1cc(ccn1)N 62a_100011218270_100009814236 [0,2,0,0,0,0|2,0,0]=4 14262 B15R1.942 COC(=O)CCCSc1cc(ccn1)O 62a_100011218270_100000762945 [0,2,0,0,0,0|2,0,0]=4 14263 B15R1.942 COC(=O)CCCSc1cc[nH]c(=O)c1 62a_100009816521_100011218270 [0,2,0,0,0,0|2,0,0]=4 14264 B15R1.942 COC(=O)CCCSc1cc[nH]c(=O)c1 62a_100011218270_100009816521 [0,2,0,0,0,0|2,0,0]=4 14265 B15R1.942 COC(=O)CCCSc1ccc[n+](c1)C 62a_100009996589_100011218270 [0,2,0,0,0,0|2,0,0]=4 14266 B15R1.942 COC(=O)CCCSc1ccc[n+](c1)C 62a_100011218270_100009996589 [0,2,0,0,0,0|2,0,0]=4 14267 B15R1.942 COC(=O)CCCSc1ccc[n+](c1)[O-] 62a_100011218270_100009815978 [0,2,0,0,0,0|2,0,0]=4 14268 B15R1.942 COC(=O)CCCSc1cccc(=O)[nH]1 62a_100011218270_100000752884 [0,2,0,0,0,0|2,0,0]=4 14269 B15R1.942 COC(=O)CCCSc1cccc(c1)Br 62a_100000691529_100011218270 [0,2,0,0,0,0|1,0,0]=3 14270 B15R1.942 COC(=O)CCCSc1cccc(c1)Br 62a_100011218270_100000691529 [0,2,0,0,0,0|1,0,0]=3 14271 B15R1.942 COC(=O)CCCSc1cccc(c1)C 62a_100011215228_100011218270 [0,2,0,0,0,0|1,0,0]=3 14272 B15R1.942 COC(=O)CCCSc1cccc(c1)C 62a_100011218270_100011215228 [0,2,0,0,0,0|1,0,0]=3 14273 B15R1.942 COC(=O)CCCSc1cccc(c1)Cl 62a_100000699651_100011218270 [0,2,0,0,0,0|1,0,0]=3 14274 B15R1.942 COC(=O)CCCSc1cccc(c1)Cl 62a_100011218270_100000699651 [0,2,0,0,0,0|1,0,0]=3 14275 B15R1.942 COC(=O)CCCSc1cccc(c1)F 62a_100000685547_100011218270 [0,2,0,0,0,0|1,0,0]=3 14276 B15R1.942 COC(=O)CCCSc1cccc(c1)F 62a_100011218270_100000685547 [0,2,0,0,0,0|1,0,0]=3 14277 B15R1.942 COC(=O)CCCSc1cccc(c1)N 62a_100000210019_100011218270 [0,2,0,0,0,0|1,0,0]=3 14278 B15R1.942 COC(=O)CCCSc1cccc(c1)N 62a_100011218270_100000210019 [0,2,0,0,0,0|1,0,0]=3 14279 B15R1.942 COC(=O)CCCSc1cccc(c1)O 62a_100011218270_100000211634 [0,2,0,0,0,0|1,0,0]=3 14280 B15R1.942 COC(=O)CCCSc1cccc(c1)[S] 62a_100011218270_114929384022 [0,2,0,0,0,0|1,0,0]=3 14281 B15R1.942 COC(=O)CCCSc1cccc(c1)[S] 62a_114929384022_100011218270 [0,2,0,0,0,0|1,0,0]=3 14282 B15R1.942 COC(=O)CCCSc1cccc(n1)Br 62a_100000684672_100011218270 [0,2,0,0,0,0|2,0,0]=4 14283 B15R1.942 COC(=O)CCCSc1cccc(n1)Br 62a_100011218270_100000684672 [0,2,0,0,0,0|2,0,0]=4 14284 B15R1.942 COC(=O)CCCSc1cccc(n1)C 62a_100000742759_100011218270 [0,2,0,0,0,0|2,0,0]=4 14285 B15R1.942 COC(=O)CCCSc1cccc(n1)C 62a_100011218270_100000742759 [0,2,0,0,0,0|2,0,0]=4 14286 B15R1.942 COC(=O)CCCSc1cccc(n1)Cl 62a_100000051397_100011218270 [0,2,0,0,0,0|2,0,0]=4 14287 B15R1.942 COC(=O)CCCSc1cccc(n1)Cl 62a_100011218270_100000051397 [0,2,0,0,0,0|2,0,0]=4 14288 B15R1.942 COC(=O)CCCSc1cccc(n1)F 62a_100009815982_100011218270 [0,2,0,0,0,0|2,0,0]=4 14289 B15R1.942 COC(=O)CCCSc1cccc(n1)F 62a_100011218270_100009815982 [0,2,0,0,0,0|2,0,0]=4 14290 B15R1.942 COC(=O)CCCSc1cccc(n1)N 62a_100000740741_100011218270 [0,2,0,0,0,0|2,0,0]=4 14291 B15R1.942 COC(=O)CCCSc1cccc(n1)N 62a_100011218270_100000740741 [0,2,0,0,0,0|2,0,0]=4 14292 B15R1.942 COC(=O)CCCSc1ccnc(c1)Br 62a_100009814637_100011218270 [0,2,0,0,0,0|2,0,0]=4 14293 B15R1.942 COC(=O)CCCSc1ccnc(c1)Br 62a_100011218270_100009814637 [0,2,0,0,0,0|2,0,0]=4 14294 B15R1.942 COC(=O)CCCSc1ccnc(c1)C 62a_100000758586_100011218270 [0,2,0,0,0,0|2,0,0]=4 14295 B15R1.942 COC(=O)CCCSc1ccnc(c1)C 62a_100011218270_100000758586 [0,2,0,0,0,0|2,0,0]=4 14296 B15R1.942 COC(=O)CCCSc1ccnc(c1)Cl 62a_100000035001_100011218270 [0,2,0,0,0,0|2,0,0]=4 14297 B15R1.942 COC(=O)CCCSc1ccnc(c1)Cl 62a_100011218270_100000035001 [0,2,0,0,0,0|2,0,0]=4 14298 B15R1.942 COC(=O)CCCSc1ccnc(c1)F 62a_100009816116_100011218270 [0,2,0,0,0,0|2,0,0]=4 14299 B15R1.942 COC(=O)CCCSc1ccnc(c1)F 62a_100011218270_100009816116 [0,2,0,0,0,0|2,0,0]=4 14300 B15R1.942 COC(=O)CCCSc1ccnc(c1)N 62a_100000049665_100011218270 [0,2,0,0,0,0|2,0,0]=4 14301 B15R1.942 COC(=O)CCCSc1ccnc(c1)N 62a_100011218270_100000049665 [0,2,0,0,0,0|2,0,0]=4 14302 B15R1.942 COC(=O)CCCSc1cncc(c1)Br 62a_100000728054_100011218270 [0,2,0,0,0,0|2,0,0]=4 14303 B15R1.942 COC(=O)CCCSc1cncc(c1)Br 62a_100011218270_100000728054 [0,2,0,0,0,0|2,0,0]=4 14304 B15R1.942 COC(=O)CCCSc1cncc(c1)C 62a_100000760492_100011218270 [0,2,0,0,0,0|2,0,0]=4 14305 B15R1.942 COC(=O)CCCSc1cncc(c1)C 62a_100011218270_100000760492 [0,2,0,0,0,0|2,0,0]=4 14306 B15R1.942 COC(=O)CCCSc1cncc(c1)Cl 62a_100000049639_100011218270 [0,2,0,0,0,0|2,0,0]=4 14307 B15R1.942 COC(=O)CCCSc1cncc(c1)Cl 62a_100011218270_100000049639 [0,2,0,0,0,0|2,0,0]=4 14308 B15R1.942 COC(=O)CCCSc1cncc(c1)F 62a_100000744099_100011218270 [0,2,0,0,0,0|2,0,0]=4 14309 B15R1.942 COC(=O)CCCSc1cncc(c1)F 62a_100011218270_100000744099 [0,2,0,0,0,0|2,0,0]=4 14310 B15R1.942 COC(=O)CCCSc1cncc(c1)N 62a_100000687067_100011218270 [0,2,0,0,0,0|2,0,0]=4 14311 B15R1.942 COC(=O)CCCSc1cncc(c1)N 62a_100011218270_100000687067 [0,2,0,0,0,0|2,0,0]=4 14312 B15R1.942 COC(=O)CCCSc1cncc(c1)O 62a_100000754920_100011218270 [0,2,0,0,0,0|2,0,0]=4 14313 B15R1.942 COC(=O)CCCSc1cncc(c1)O 62a_100011218270_100000754920 [0,2,0,0,0,0|2,0,0]=4 14314 B15R1.942 COC(=O)CCNCc1cccc(=O)[nH]1 2230a_100000696482_100000204255 [0,2,0,0,0,0|2,0,0]=4 14315 B15R1.942 COC(=O)CCNCc1cccc(c1)Br 2230a_100000174977_100000204255 [0,2,0,0,0,0|1,0,0]=3 14316 B15R1.942 COC(=O)CCNCc1cccc(c1)Br 34a_100000174977_100000742370 [0,2,0,0,0,0|1,0,0]=3 14317 B15R1.942 COC(=O)CCNCc1cccc(c1)C 2230a_100000185548_100000204255 [0,2,0,0,0,0|1,0,0]=3 14318 B15R1.942 COC(=O)CCNCc1cccc(c1)C 34a_100000185548_100000742370 [0,2,0,0,0,0|1,0,0]=3 14319 B15R1.942 COC(=O)CCNCc1cccc(c1)Cl 2230a_100000174878_100000204255 [0,2,0,0,0,0|1,0,0]=3 14320 B15R1.942 COC(=O)CCNCc1cccc(c1)Cl 34a_100000174878_100000742370 [0,2,0,0,0,0|1,0,0]=3 14321 B15R1.942 COC(=O)CCNCc1cccc(c1)F 2230a_100000174948_100000204255 [0,2,0,0,0,0|1,0,0]=3 14322 B15R1.942 COC(=O)CCNCc1cccc(c1)F 34a_100000174948_100000742370 [0,2,0,0,0,0|1,0,0]=3 14323 B15R1.942 COC(=O)CCNCc1cccc(c1)I 2230a_100000106179_100000204255 [0,2,0,0,0,0|1,0,0]=3 14324 B15R1.942 COC(=O)CCNCc1cccc(c1)I 34a_100000106179_100000742370 [0,2,0,0,0,0|1,0,0]=3 14325 B15R1.942 COC(=O)CCNCc1cccc(c1)O 2230a_100000743036_100000204255 [0,2,0,0,0,0|1,0,0]=3 14326 B15R1.942 COC(=O)CCNCc1cccc(c1)O 34a_100000743036_100000742370 [0,2,0,0,0,0|1,0,0]=3 14327 B15R1.942 COC(=O)CCNCc1cccc(n1)Br 2230a_100016987751_100000204255 [0,2,0,0,0,0|2,0,0]=4 14328 B15R1.942 COC(=O)CCNCc1cccc(n1)C 34a_100000701342_100000742370 [0,2,0,0,0,0|2,0,0]=4 14329 B15R1.942 COC(=O)CCNCc1cccc(n1)Cl 2230a_100016990191_100000204255 [0,2,0,0,0,0|2,0,0]=4 14330 B15R1.942 COC(=O)CCNCc1cccc(n1)F 2230a_100015188798_100000204255 [0,2,0,0,0,0|2,0,0]=4 14331 B15R1.942 COC(=O)CCNCc1cccc(n1)F 34a_100015188798_100000742370 [0,2,0,0,0,0|2,0,0]=4 14332 B15R1.942 COC(=O)CCNCc1ccnc(c1)Br 2230a_100025757509_100000204255 [0,2,0,0,0,0|2,0,0]=4 14333 B15R1.942 COC(=O)CCNCc1ccnc(c1)Br 34a_100025757509_100000742370 [0,2,0,0,0,0|2,0,0]=4 14334 B15R1.942 COC(=O)CCNCc1ccnc(c1)C 34a_100011934566_100000742370 [0,2,0,0,0,0|2,0,0]=4 14335 B15R1.942 COC(=O)CCNCc1ccnc(c1)Cl 2230a_100015205668_100000204255 [0,2,0,0,0,0|2,0,0]=4 14336 B15R1.942 COC(=O)CCNCc1ccnc(c1)Cl 34a_100015205668_100000742370 [0,2,0,0,0,0|2,0,0]=4 14337 B15R1.942 COC(=O)CCNCc1ccnc(c1)F 2230a_100015188774_100000204255 [0,2,0,0,0,0|2,0,0]=4 14338 B15R1.942 COC(=O)CCNCc1ccnc(c1)F 34a_100015188774_100000742370 [0,2,0,0,0,0|2,0,0]=4 14339 B15R1.942 COC(=O)CCNCc1cncc(c1)C 2230a_100000692839_100000204255 [0,2,0,0,0,0|2,0,0]=4 14340 B15R1.942 COC(=O)CCNCc1cncc(c1)C 34a_100000692839_100000742370 [0,2,0,0,0,0|2,0,0]=4 14341 B15R1.942 COC(=O)CCNCc1cncc(c1)Cl 2230a_200020614424_100000204255 [0,2,0,0,0,0|2,0,0]=4 14342 B15R1.942 COC(=O)CCNCc1cncc(c1)F 2230a_100011962886_100000204255 [0,2,0,0,0,0|2,0,0]=4 14343 B15R1.942 COC(=O)CCNCc1cncc(c1)F 34a_100011962886_100000742370 [0,2,0,0,0,0|2,0,0]=4 14344 B15R1.942 COC(=O)CCOCc1cc(ccn1)C 34a_100011998357_100000742370 [0,2,0,0,0,0|2,0,0]=4 14345 B15R1.942 COC(=O)CCOCc1cc(ccn1)Cl 34a_100000748867_100000742370 [0,2,0,0,0,0|2,0,0]=4 14346 B15R1.942 COC(=O)CCOCc1cc(ccn1)N 34a_100000692640_100000742370 [0,2,0,0,0,0|2,0,0]=4 14347 B15R1.942 COC(=O)CCOCc1ccc[n+](c1)[O-] 34a_100000037817_100000742370 [0,2,0,0,0,0|2,0,0]=4 14348 B15R1.942 COC(=O)CCOCc1ccc[n+](c1)[O-] 7a_100000037817_100000204255 [0,2,0,0,0,0|2,0,0]=4 14349 B15R1.942 COC(=O)CCOCc1cccc(c1)Br 34a_100000687537_100000742370 [0,2,0,0,0,0|1,0,0]=3 14350 B15R1.942 COC(=O)CCOCc1cccc(c1)Br 7a_100000687537_100000204255 [0,2,0,0,0,0|1,0,0]=3 14351 B15R1.942 COC(=O)CCOCc1cccc(c1)C 34a_100011217746_100000742370 [0,2,0,0,0,0|1,0,0]=3 14352 B15R1.942 COC(=O)CCOCc1cccc(c1)C 7a_100011217746_100000204255 [0,2,0,0,0,0|1,0,0]=3 14353 B15R1.942 COC(=O)CCOCc1cccc(c1)Cl 34a_100000241301_100000742370 [0,2,0,0,0,0|1,0,0]=3 14354 B15R1.942 COC(=O)CCOCc1cccc(c1)Cl 7a_100000241301_100000204255 [0,2,0,0,0,0|1,0,0]=3 14355 B15R1.942 COC(=O)CCOCc1cccc(c1)F 34a_100000210976_100000742370 [0,2,0,0,0,0|1,0,0]=3 14356 B15R1.942 COC(=O)CCOCc1cccc(c1)F 7a_100000210976_100000204255 [0,2,0,0,0,0|1,0,0]=3 14357 B15R1.942 COC(=O)CCOCc1cccc(c1)I 34a_100011215336_100000742370 [0,2,0,0,0,0|1,0,0]=3 14358 B15R1.942 COC(=O)CCOCc1cccc(c1)I 7a_100011215336_100000204255 [0,2,0,0,0,0|1,0,0]=3 14359 B15R1.942 COC(=O)CCOCc1cccc(c1)N 34a_100000211919_100000742370 [0,2,0,0,0,0|1,0,0]=3 14360 B15R1.942 COC(=O)CCOCc1cccc(n1)Br 34a_100000694195_100000742370 [0,2,0,0,0,0|2,0,0]=4 14361 B15R1.942 COC(=O)CCOCc1cccc(n1)C 34a_100000690600_100000742370 [0,2,0,0,0,0|2,0,0]=4 14362 B15R1.942 COC(=O)CCOCc1cccc(n1)Cl 34a_100011998359_100000742370 [0,2,0,0,0,0|2,0,0]=4 14363 B15R1.942 COC(=O)CCOCc1cccc(n1)F 34a_100000086748_100000742370 [0,2,0,0,0,0|2,0,0]=4 14364 B15R1.942 COC(=O)CCOCc1ccnc(c1)Br 34a_100009814636_100000742370 [0,2,0,0,0,0|2,0,0]=4 14365 B15R1.942 COC(=O)CCOCc1ccnc(c1)Br 7a_100009814636_100000204255 [0,2,0,0,0,0|2,0,0]=4 14366 B15R1.942 COC(=O)CCOCc1ccnc(c1)C 34a_100011998630_100000742370 [0,2,0,0,0,0|2,0,0]=4 14367 B15R1.942 COC(=O)CCOCc1ccnc(c1)Cl 34a_100000748751_100000742370 [0,2,0,0,0,0|2,0,0]=4 14368 B15R1.942 COC(=O)CCOCc1ccnc(c1)F 34a_100000082451_100000742370 [0,2,0,0,0,0|2,0,0]=4 14369 B15R1.942 COC(=O)CCOCc1cncc(c1)Br 34a_100011259137_100000742370 [0,2,0,0,0,0|2,0,0]=4 14370 B15R1.942 COC(=O)CCOCc1cncc(c1)Br 7a_100011259137_100000204255 [0,2,0,0,0,0|2,0,0]=4 14371 B15R1.942 COC(=O)CCOCc1cncc(c1)C 34a_100011998709_100000742370 [0,2,0,0,0,0|2,0,0]=4 14372 B15R1.942 COC(=O)CCOCc1cncc(c1)C 7a_100011998709_100000204255 [0,2,0,0,0,0|2,0,0]=4 14373 B15R1.942 COC(=O)CCOCc1cncc(c1)Cl 34a_100000092867_100000742370 [0,2,0,0,0,0|2,0,0]=4 14374 B15R1.942 COC(=O)CCOCc1cncc(c1)Cl 7a_100000092867_100000204255 [0,2,0,0,0,0|2,0,0]=4 14375 B15R1.942 COC(=O)CCOCc1cncc(c1)F 34a_100011962875_100000742370 [0,2,0,0,0,0|2,0,0]=4 14376 B15R1.942 COC(=O)CCOCc1cncc(c1)F 7a_100011962875_100000204255 [0,2,0,0,0,0|2,0,0]=4 14377 B15R1.942 COC(=O)CCOCc1cncc(c1)N 34a_100000085308_100000742370 [0,2,0,0,0,0|2,0,0]=4 14378 B15R1.942 COC(=O)CCSCc1cc(ccn1)Br 62a_100000204255_100010173614 [0,2,0,0,0,0|2,0,0]=4 14379 B15R1.942 COC(=O)CCSCc1cc(ccn1)Br 62a_100010173614_100000204255 [0,2,0,0,0,0|2,0,0]=4 14380 B15R1.942 COC(=O)CCSCc1cc(ccn1)C 62a_100000204255_100000718516 [0,2,0,0,0,0|2,0,0]=4 14381 B15R1.942 COC(=O)CCSCc1cc(ccn1)C 62a_100000718516_100000204255 [0,2,0,0,0,0|2,0,0]=4 14382 B15R1.942 COC(=O)CCSCc1cc(ccn1)Cl 62a_100000204255_100016988179 [0,2,0,0,0,0|2,0,0]=4 14383 B15R1.942 COC(=O)CCSCc1cc(ccn1)Cl 62a_100016988179_100000204255 [0,2,0,0,0,0|2,0,0]=4 14384 B15R1.942 COC(=O)CCSCc1cccc(c1)Br 62a_100000204255_100000211773 [0,2,0,0,0,0|1,0,0]=3 14385 B15R1.942 COC(=O)CCSCc1cccc(c1)Br 62a_100000211773_100000204255 [0,2,0,0,0,0|1,0,0]=3 14386 B15R1.942 COC(=O)CCSCc1cccc(c1)C 62a_100000204255_100000211840 [0,2,0,0,0,0|1,0,0]=3 14387 B15R1.942 COC(=O)CCSCc1cccc(c1)C 62a_100000211840_100000204255 [0,2,0,0,0,0|1,0,0]=3 14388 B15R1.942 COC(=O)CCSCc1cccc(c1)Cl 62a_100000187163_100000204255 [0,2,0,0,0,0|1,0,0]=3 14389 B15R1.942 COC(=O)CCSCc1cccc(c1)Cl 62a_100000204255_100000187163 [0,2,0,0,0,0|1,0,0]=3 14390 B15R1.942 COC(=O)CCSCc1cccc(c1)F 62a_100000204255_100000230114 [0,2,0,0,0,0|1,0,0]=3 14391 B15R1.942 COC(=O)CCSCc1cccc(c1)F 62a_100000230114_100000204255 [0,2,0,0,0,0|1,0,0]=3 14392 B15R1.942 COC(=O)CCSCc1cccc(c1)I 62a_100000204255_100011218688 [0,2,0,0,0,0|1,0,0]=3 14393 B15R1.942 COC(=O)CCSCc1cccc(c1)I 62a_100011218688_100000204255 [0,2,0,0,0,0|1,0,0]=3 14394 B15R1.942 COC(=O)CCSCc1cccc(c1)O 62a_100000204255_100011660834 [0,2,0,0,0,0|1,0,0]=3 14395 B15R1.942 COC(=O)CCSCc1cccc(c1)O 62a_100011660834_100000204255 [0,2,0,0,0,0|1,0,0]=3 14396 B15R1.942 COC(=O)CCSCc1cccc(n1)Br 62a_100000204255_100009889011 [0,2,0,0,0,0|2,0,0]=4 14397 B15R1.942 COC(=O)CCSCc1cccc(n1)Br 62a_100009889011_100000204255 [0,2,0,0,0,0|2,0,0]=4 14398 B15R1.942 COC(=O)CCSCc1cccc(n1)C 62a_100000204255_100000757606 [0,2,0,0,0,0|2,0,0]=4 14399 B15R1.942 COC(=O)CCSCc1cccc(n1)C 62a_100000757606_100000204255 [0,2,0,0,0,0|2,0,0]=4 14400 B15R1.942 COC(=O)CCSCc1cccc(n1)Cl 62a_100000086093_100000204255 [0,2,0,0,0,0|2,0,0]=4 14401 B15R1.942 COC(=O)CCSCc1cccc(n1)Cl 62a_100000204255_100000086093 [0,2,0,0,0,0|2,0,0]=4 14402 B15R1.942 COC(=O)CCSCc1cccc(n1)F 62a_100000204255_100009819644 [0,2,0,0,0,0|2,0,0]=4 14403 B15R1.942 COC(=O)CCSCc1cccc(n1)F 62a_100009819644_100000204255 [0,2,0,0,0,0|2,0,0]=4 14404 B15R1.942 COC(=O)CCSCc1ccnc(c1)Br 62a_100000204255_100010243470 [0,2,0,0,0,0|2,0,0]=4 14405 B15R1.942 COC(=O)CCSCc1ccnc(c1)Br 62a_100010254460_100000204255 [0,2,0,0,0,0|2,0,0]=4 14406 B15R1.942 COC(=O)CCSCc1ccnc(c1)C 62a_100000204255_200020672517 [0,2,0,0,0,0|2,0,0]=4 14407 B15R1.942 COC(=O)CCSCc1ccnc(c1)C 62a_200020672517_100000204255 [0,2,0,0,0,0|2,0,0]=4 14408 B15R1.942 COC(=O)CCSCc1ccnc(c1)Cl 62a_100000204255_100000764220 [0,2,0,0,0,0|2,0,0]=4 14409 B15R1.942 COC(=O)CCSCc1ccnc(c1)Cl 62a_100000764220_100000204255 [0,2,0,0,0,0|2,0,0]=4 14410 B15R1.942 COC(=O)CCSCc1cncc(c1)Br 62a_100000204255_100000738771 [0,2,0,0,0,0|2,0,0]=4 14411 B15R1.942 COC(=O)CCSCc1cncc(c1)Br 62a_100000738771_100000204255 [0,2,0,0,0,0|2,0,0]=4 14412 B15R1.942 COC(=O)CCSCc1cncc(c1)C 62a_100000204255_100000716715 [0,2,0,0,0,0|2,0,0]=4 14413 B15R1.942 COC(=O)CCSCc1cncc(c1)C 62a_100000716715_100000204255 [0,2,0,0,0,0|2,0,0]=4 14414 B15R1.942 COC(=O)CCSCc1cncc(c1)Cl 62a_100000204255_100016992070 [0,2,0,0,0,0|2,0,0]=4 14415 B15R1.942 COC(=O)CCSCc1cncc(c1)Cl 62a_100016992070_100000204255 [0,2,0,0,0,0|2,0,0]=4 14416 B15R1.942 COC(=O)CCSCc1cncc(c1)F 62a_100000204255_100000725299 [0,2,0,0,0,0|2,0,0]=4 14417 B15R1.942 COC(=O)CCSCc1cncc(c1)F 62a_100000725299_100000204255 [0,2,0,0,0,0|2,0,0]=4 14418 B15R1.942 COC(=O)CNCCc1cccc(c1)Br 2230a_100011207229_100000747449 [0,2,0,0,0,0|1,0,0]=3 14419 B15R1.942 COC(=O)CNCCc1cccc(c1)Br 34a_100011207229_100000747449 [0,2,0,0,0,0|1,0,0]=3 14420 B15R1.942 COC(=O)CNCCc1cccc(c1)C 2230a_100000749837_100000747449 [0,2,0,0,0,0|1,0,0]=3 14421 B15R1.942 COC(=O)CNCCc1cccc(c1)C 34a_100000749837_100000747449 [0,2,0,0,0,0|1,0,0]=3 14422 B15R1.942 COC(=O)CNCCc1cccc(c1)Cl 2230a_100000185263_100000747449 [0,2,0,0,0,0|1,0,0]=3 14423 B15R1.942 COC(=O)CNCCc1cccc(c1)Cl 34a_100000185263_100000747449 [0,2,0,0,0,0|1,0,0]=3 14424 B15R1.942 COC(=O)CNCCc1cccc(c1)F 2230a_100000205154_100000747449 [0,2,0,0,0,0|1,0,0]=3 14425 B15R1.942 COC(=O)CNCCc1cccc(c1)F 34a_100000205154_100000747449 [0,2,0,0,0,0|1,0,0]=3 14426 B15R1.942 COC(=O)CNCCc1cccc(c1)O 2230a_100000747277_100000747449 [0,2,0,0,0,0|1,0,0]=3 14427 B15R1.942 COC(=O)CNCCc1cccc(c1)O 34a_100000747277_100000747449 [0,2,0,0,0,0|1,0,0]=3 14428 B15R1.942 COC(=O)CNCCc1cccc(n1)C 2230a_100011824523_100000747449 [0,2,0,0,0,0|2,0,0]=4 14429 B15R1.942 COC(=O)CNCCc1cccc(n1)C 34a_100011824523_100000747449 [0,2,0,0,0,0|2,0,0]=4 14430 B15R1.942 COC(=O)COCCc1cccc(c1)Br 34a_100011217444_100000747449 [0,2,0,0,0,0|1,0,0]=3 14431 B15R1.942 COC(=O)COCCc1cccc(c1)Br 7a_100011217444_100000747449 [0,2,0,0,0,0|1,0,0]=3 14432 B15R1.942 COC(=O)COCCc1cccc(c1)C 34a_100011217157_100000747449 [0,2,0,0,0,0|1,0,0]=3 14433 B15R1.942 COC(=O)COCCc1cccc(c1)C 7a_100011217157_100000747449 [0,2,0,0,0,0|1,0,0]=3 14434 B15R1.942 COC(=O)COCCc1cccc(c1)Cl 34a_100000754733_100000747449 [0,2,0,0,0,0|1,0,0]=3 14435 B15R1.942 COC(=O)COCCc1cccc(c1)Cl 7a_100000754733_100000747449 [0,2,0,0,0,0|1,0,0]=3 14436 B15R1.942 COC(=O)COCCc1cccc(c1)F 34a_100000763591_100000747449 [0,2,0,0,0,0|1,0,0]=3 14437 B15R1.942 COC(=O)COCCc1cccc(c1)F 7a_100000763591_100000747449 [0,2,0,0,0,0|1,0,0]=3 14438 B15R1.942 COC(=O)COCCc1cccc(c1)N 34a_100011996697_100000747449 [0,2,0,0,0,0|1,0,0]=3 14439 B15R1.942 COC(=O)COCCc1cccc(n1)Br 34a_100010221043_100000747449 [0,2,0,0,0,0|2,0,0]=4 14440 B15R1.942 COC(=O)COCCc1cccc(n1)Br 7a_100010221043_100000747449 [0,2,0,0,0,0|2,0,0]=4 14441 B15R1.942 COC(=O)CSCCc1cccc(c1)Br 62a_100000747449_100011740638 [0,2,0,0,0,0|1,0,0]=3 14442 B15R1.942 COC(=O)CSCCc1cccc(c1)Br 62a_100011740638_100000747449 [0,2,0,0,0,0|1,0,0]=3 14443 B15R1.942 COC(=O)CSCCc1cccc(c1)C 62a_100000747449_100011713685 [0,2,0,0,0,0|1,0,0]=3 14444 B15R1.942 COC(=O)CSCCc1cccc(c1)C 62a_100011713685_100000747449 [0,2,0,0,0,0|1,0,0]=3 14445 B15R1.942 COC(=O)CSCCc1cccc(c1)Cl 62a_100000747449_100011713710 [0,2,0,0,0,0|1,0,0]=3 14446 B15R1.942 COC(=O)CSCCc1cccc(c1)Cl 62a_100011713710_100000747449 [0,2,0,0,0,0|1,0,0]=3 14447 B15R1.942 COC(=O)CSCCc1cccc(c1)F 62a_100000747449_100011217235 [0,2,0,0,0,0|1,0,0]=3 14448 B15R1.942 COC(=O)CSCCc1cccc(c1)F 62a_100011217235_100000747449 [0,2,0,0,0,0|1,0,0]=3 14449 B15R1.942 COC(=O)OCSCc1cccc(c1)Br 62a_100000211773_100000139417 [0,2,0,0,0,0|2,0,0]=4 14450 B15R1.942 COC(=O)OCSCc1cccc(c1)C 62a_100000211840_100000139417 [0,2,0,0,0,0|2,0,0]=4 14451 B15R1.942 COC(=O)OCSCc1cccc(c1)Cl 62a_100000187163_100000139417 [0,2,0,0,0,0|2,0,0]=4 14452 B15R1.942 COC(=O)OCSCc1cccc(c1)F 62a_100000230114_100000139417 [0,2,0,0,0,0|2,0,0]=4 14453 B15R1.942 COC(=O)OCSCc1cccc(c1)I 62a_100011218688_100000139417 [0,2,0,0,0,0|2,0,0]=4 14454 B15R1.942 COC(=O)OCSCc1cccc(c1)O 62a_100011660834_100000139417 [0,2,0,0,0,0|2,0,0]=4 14455 B15R1.942 Cc1cccc(c1)CCCNC(=O)CO 240690a_103496528808_100000210174 [0,2,0,0,0,0|1,0,0]=3 14456 B15R1.942 Cc1cccc(c1)CCCNC(=O)CO 527a_103496528808_100000210174 [0,2,0,0,0,0|1,0,0]=3 14457 B15R1.942 Cc1cccc(c1)COCCC(=NO)N 34a_100000749954_100000211840 [0,2,0,0,0,0|2,0,0]=4 14458 B15R1.942 Cc1cccc(c1)OCCCC(=O)CF 1458a_100000183260_100015361967 [0,2,0,0,0,0|2,0,0]=4 14459 B15R1.942 Cc1cccc(c1)OCCCC(=O)CO 1458a_100000210174_100000212303 [0,2,0,0,0,0|1,0,0]=3 14460 B15R1.942 Cc1cccc(c1)OCCNC(=O)CO 240690a_100015185188_100000210174 [0,2,0,0,0,0|2,0,0]=4 14461 B15R1.942 Cc1cccc(c1)OCCNC(=O)CO 527a_100015185188_100000210174 [0,2,0,0,0,0|2,0,0]=4 14462 B15R1.942 NC(=NO)CCOCc1cccc(c1)Br 34a_100000749954_100000698116 [0,2,0,0,0,0|2,0,0]=4 14463 B15R1.942 NC(=NO)CCOCc1cccc(c1)Cl 34a_100000749954_100000187163 [0,2,0,0,0,0|2,0,0]=4 14464 B15R1.942 NC(=NO)CCOCc1cccc(c1)F 34a_100000749954_100000187166 [0,2,0,0,0,0|2,0,0]=4 14465 B15R1.942 NC(=NO)CCOCc1cccc(c1)I 34a_100000749954_100011218688 [0,2,0,0,0,0|2,0,0]=4 14466 B15R1.942 NC(=NO)CCOCc1cccc(c1)O 34a_100000749954_100011660834 [0,2,0,0,0,0|2,0,0]=4 14467 B15R1.942 O=C(CF)CCCCc1cccc(c1)Br 1458a_200010160685_100015361967 [0,2,0,0,0,0|1,0,0]=3 14468 B15R1.942 O=C(CF)CCCOc1cccc(c1)O 1458a_200009913207_100015361967 [0,2,0,0,0,0|2,0,0]=4 14469 B15R1.942 O=C(CO)CCCOc1cccc(c1)Cl 1458a_100000210174_100000742658 [0,2,0,0,0,0|1,0,0]=3 14470 B15R1.942 O=C(CO)NCCCc1cccc(c1)Br 240690a_100000753791_100000210174 [0,2,0,0,0,0|1,0,0]=3 14471 B15R1.942 O=C(CO)NCCCc1cccc(c1)Br 527a_100000753791_100000210174 [0,2,0,0,0,0|1,0,0]=3 14472 B15R1.942 O=C(CO)NCCCc1cccc(c1)Cl 240690a_100000704586_100000210174 [0,2,0,0,0,0|1,0,0]=3 14473 B15R1.942 O=C(CO)NCCCc1cccc(c1)Cl 527a_100000704586_100000210174 [0,2,0,0,0,0|1,0,0]=3 14474 B15R1.942 O=C(CO)NCCCc1cccc(c1)F 240690a_100000754185_100000210174 [0,2,0,0,0,0|1,0,0]=3 14475 B15R1.942 O=C(CO)NCCCc1cccc(c1)F 527a_100000754185_100000210174 [0,2,0,0,0,0|1,0,0]=3 14476 B15R1.942 O=C(CO)NCCOc1cccc(c1)Br 240690a_100000743521_100000210174 [0,2,0,0,0,0|2,0,0]=4 14477 B15R1.942 O=C(CO)NCCOc1cccc(c1)Br 527a_100000743521_100000210174 [0,2,0,0,0,0|2,0,0]=4 14478 B15R1.942 O=C(CO)NCCOc1cccc(c1)Cl 240690a_100000740232_100000210174 [0,2,0,0,0,0|2,0,0]=4 14479 B15R1.942 O=C(CO)NCCOc1cccc(c1)Cl 527a_100000740232_100000210174 [0,2,0,0,0,0|2,0,0]=4 14480 B15R1.942 O=C(CO)NCCOc1cccc(c1)F 240690a_100000738948_100000210174 [0,2,0,0,0,0|2,0,0]=4 14481 B15R1.942 O=C(CO)NCCOc1cccc(c1)F 527a_100000738948_100000210174 [0,2,0,0,0,0|2,0,0]=4 14482 B15R1.5448 CC(=O)CCCNc1cc(cc(c1)Br)Br 34a_100012047176_100000685027 [0,2,0,0,0,0|2,0,0]=4 14483 B15R1.5448 CC(=O)CCCNc1cc(cc(c1)Br)Br 7a_100012047176_100011215641 [0,2,0,0,0,0|2,0,0]=4 14484 B15R1.5448 CC(=O)CCCNc1cc(cc(c1)Br)C 34a_100000695972_100000685027 [0,2,0,0,0,0|2,0,0]=4 14485 B15R1.5448 CC(=O)CCCNc1cc(cc(c1)Br)C 7a_100000695972_100011215641 [0,2,0,0,0,0|2,0,0]=4 14486 B15R1.5448 CC(=O)CCCNc1cc(cc(c1)Br)Cl 34a_100011934539_100000685027 [0,2,0,0,0,0|2,0,0]=4 14487 B15R1.5448 CC(=O)CCCNc1cc(cc(c1)Br)Cl 7a_100011934539_100011215641 [0,2,0,0,0,0|2,0,0]=4 14488 B15R1.5448 CC(=O)CCCNc1cc(cc(c1)Br)F 34a_100000705686_100000685027 [0,2,0,0,0,0|2,0,0]=4 14489 B15R1.5448 CC(=O)CCCNc1cc(cc(c1)Br)F 7a_100000705686_100011215641 [0,2,0,0,0,0|2,0,0]=4 14490 B15R1.5448 CC(=O)CCCNc1cc(cc(c1)C)C 34a_100000210930_100000685027 [0,2,0,0,0,0|2,0,0]=4 14491 B15R1.5448 CC(=O)CCCNc1cc(cc(c1)C)C 7a_100000210930_100011215641 [0,2,0,0,0,0|2,0,0]=4 14492 B15R1.5448 CC(=O)CCCNc1cc(cc(c1)Cl)C 34a_100012022512_100000685027 [0,2,0,0,0,0|2,0,0]=4 14493 B15R1.5448 CC(=O)CCCNc1cc(cc(c1)Cl)C 7a_100012022512_100011215641 [0,2,0,0,0,0|2,0,0]=4 14494 B15R1.5448 CC(=O)CCCNc1cc(cc(c1)Cl)Cl 34a_100000210456_100000685027 [0,2,0,0,0,0|2,0,0]=4 14495 B15R1.5448 CC(=O)CCCNc1cc(cc(c1)Cl)Cl 7a_100000210456_100011215641 [0,2,0,0,0,0|2,0,0]=4 14496 B15R1.5448 CC(=O)CCCNc1cc(cc(c1)Cl)F 34a_100000686136_100000685027 [0,2,0,0,0,0|2,0,0]=4 14497 B15R1.5448 CC(=O)CCCNc1cc(cc(c1)Cl)F 7a_100000686136_100011215641 [0,2,0,0,0,0|2,0,0]=4 14498 B15R1.5448 CC(=O)CCCNc1cc(cc(c1)Cl)O 34a_100000123917_100000685027 [0,2,0,0,0,0|2,0,0]=4 14499 B15R1.5448 CC(=O)CCCNc1cc(cc(c1)Cl)O 7a_100000123917_100011215641 [0,2,0,0,0,0|2,0,0]=4 14500 B15R1.5448 CC(=O)CCCNc1cc(cc(c1)F)C 34a_100000742734_100000685027 [0,2,0,0,0,0|2,0,0]=4 14501 B15R1.5448 CC(=O)CCCNc1cc(cc(c1)F)C 7a_100000742734_100011215641 [0,2,0,0,0,0|2,0,0]=4 14502 B15R1.5448 CC(=O)CCCNc1cc(cc(c1)F)F 34a_100000233717_100000685027 [0,2,0,0,0,0|2,0,0]=4 14503 B15R1.5448 CC(=O)CCCNc1cc(cc(c1)F)F 7a_100000233717_100011215641 [0,2,0,0,0,0|2,0,0]=4 14504 B15R1.5448 CC(=O)CCCNc1cc(cc(c1)I)Br 7a_100009814763_100011215641 [0,2,0,0,0,0|2,0,0]=4 14505 B15R1.5448 CC(=O)CCCNc1cc(cc(c1)I)Cl 7a_100010147676_100011215641 [0,2,0,0,0,0|2,0,0]=4 14506 B15R1.5448 CC(=O)CCCNc1cc(cc(c1)I)F 34a_100011356972_100000685027 [0,2,0,0,0,0|2,0,0]=4 14507 B15R1.5448 CC(=O)CCCNc1cc(cc(c1)I)F 7a_100011356972_100011215641 [0,2,0,0,0,0|2,0,0]=4 14508 B15R1.5448 CC(=O)CCCNc1cc(cc(c1)I)I 7a_200000696836_100011215641 [0,2,0,0,0,0|2,0,0]=4 14509 B15R1.5448 CC(=O)CCCNc1cc(cc(c1)O)C 34a_100011995906_100000685027 [0,2,0,0,0,0|2,0,0]=4 14510 B15R1.5448 CC(=O)CCCNc1cc(cc(c1)O)C 7a_100011995906_100011215641 [0,2,0,0,0,0|2,0,0]=4 14511 B15R1.5448 CC(=O)CCCNc1cc(cc(c1)O)O 34a_100000043371_100000685027 [0,2,0,0,0,0|2,0,0]=4 14512 B15R1.5448 CC(=O)CCCOc1cc(cc(c1)Br)Br 34a_100010167048_100000685027 [0,2,0,0,0,0|2,0,0]=4 14513 B15R1.5448 CC(=O)CCCOc1cc(cc(c1)Br)Br 7a_100010167048_100011215641 [0,2,0,0,0,0|2,0,0]=4 14514 B15R1.5448 CC(=O)CCCOc1cc(cc(c1)Br)C 34a_100011999630_100000685027 [0,2,0,0,0,0|2,0,0]=4 14515 B15R1.5448 CC(=O)CCCOc1cc(cc(c1)Br)C 7a_100011999630_100011215641 [0,2,0,0,0,0|2,0,0]=4 14516 B15R1.5448 CC(=O)CCCOc1cc(cc(c1)Br)Cl 34a_100010185897_100000685027 [0,2,0,0,0,0|2,0,0]=4 14517 B15R1.5448 CC(=O)CCCOc1cc(cc(c1)Br)Cl 7a_100010185897_100011215641 [0,2,0,0,0,0|2,0,0]=4 14518 B15R1.5448 CC(=O)CCCOc1cc(cc(c1)Br)F 34a_100000688818_100000685027 [0,2,0,0,0,0|2,0,0]=4 14519 B15R1.5448 CC(=O)CCCOc1cc(cc(c1)Br)F 7a_100000688818_100011215641 [0,2,0,0,0,0|2,0,0]=4 14520 B15R1.5448 CC(=O)CCCOc1cc(cc(c1)C)C 1458a_100000070787_100000204577 [0,2,0,0,0,0|2,0,0]=4 14521 B15R1.5448 CC(=O)CCCOc1cc(cc(c1)C)C 34a_100000210933_100000685027 [0,2,0,0,0,0|2,0,0]=4 14522 B15R1.5448 CC(=O)CCCOc1cc(cc(c1)C)C 7a_100000210933_100011215641 [0,2,0,0,0,0|2,0,0]=4 14523 B15R1.5448 CC(=O)CCCOc1cc(cc(c1)Cl)C 34a_100000087485_100000685027 [0,2,0,0,0,0|2,0,0]=4 14524 B15R1.5448 CC(=O)CCCOc1cc(cc(c1)Cl)C 7a_100000087485_100011215641 [0,2,0,0,0,0|2,0,0]=4 14525 B15R1.5448 CC(=O)CCCOc1cc(cc(c1)Cl)Cl 34a_100000181315_100000685027 [0,2,0,0,0,0|2,0,0]=4 14526 B15R1.5448 CC(=O)CCCOc1cc(cc(c1)Cl)Cl 7a_100000181315_100011215641 [0,2,0,0,0,0|2,0,0]=4 14527 B15R1.5448 CC(=O)CCCOc1cc(cc(c1)Cl)F 34a_100011219751_100000685027 [0,2,0,0,0,0|2,0,0]=4 14528 B15R1.5448 CC(=O)CCCOc1cc(cc(c1)Cl)F 7a_100011219751_100011215641 [0,2,0,0,0,0|2,0,0]=4 14529 B15R1.5448 CC(=O)CCCOc1cc(cc(c1)Cl)N 34a_100000123917_100000685027 [0,2,0,0,0,0|2,0,0]=4 14530 B15R1.5448 CC(=O)CCCOc1cc(cc(c1)Cl)N 7a_100000123917_100011215641 [0,2,0,0,0,0|2,0,0]=4 14531 B15R1.5448 CC(=O)CCCOc1cc(cc(c1)F)C 34a_100011830401_100000685027 [0,2,0,0,0,0|2,0,0]=4 14532 B15R1.5448 CC(=O)CCCOc1cc(cc(c1)F)C 7a_100011830401_100011215641 [0,2,0,0,0,0|2,0,0]=4 14533 B15R1.5448 CC(=O)CCCOc1cc(cc(c1)F)F 34a_100000747503_100000685027 [0,2,0,0,0,0|2,0,0]=4 14534 B15R1.5448 CC(=O)CCCOc1cc(cc(c1)F)F 7a_100000747503_100011215641 [0,2,0,0,0,0|2,0,0]=4 14535 B15R1.5448 CC(=O)CCCOc1cc(cc(c1)I)Br 34a_100010068917_100000685027 [0,2,0,0,0,0|2,0,0]=4 14536 B15R1.5448 CC(=O)CCCOc1cc(cc(c1)I)Br 7a_100010068917_100011215641 [0,2,0,0,0,0|2,0,0]=4 14537 B15R1.5448 CC(=O)CCCOc1cc(cc(c1)I)Cl 34a_100010068924_100000685027 [0,2,0,0,0,0|2,0,0]=4 14538 B15R1.5448 CC(=O)CCCOc1cc(cc(c1)I)Cl 7a_100010068924_100011215641 [0,2,0,0,0,0|2,0,0]=4 14539 B15R1.5448 CC(=O)CCCOc1cc(cc(c1)I)F 34a_100000717995_100000685027 [0,2,0,0,0,0|2,0,0]=4 14540 B15R1.5448 CC(=O)CCCOc1cc(cc(c1)I)F 7a_100000717995_100011215641 [0,2,0,0,0,0|2,0,0]=4 14541 B15R1.5448 CC(=O)CCCOc1cc(cc(c1)N)C 34a_100011995906_100000685027 [0,2,0,0,0,0|2,0,0]=4 14542 B15R1.5448 CC(=O)CCCOc1cc(cc(c1)N)C 7a_100011995906_100011215641 [0,2,0,0,0,0|2,0,0]=4 14543 B15R1.5448 CC(=O)CCCSc1cc(cc(c1)Br)Br 62a_100009814770_100011215641 [0,2,0,0,0,0|2,0,0]=4 14544 B15R1.5448 CC(=O)CCCSc1cc(cc(c1)Br)Br 62a_100011215641_100009814770 [0,2,0,0,0,0|2,0,0]=4 14545 B15R1.5448 CC(=O)CCCSc1cc(cc(c1)Br)Cl 62a_100009814755_100011215641 [0,2,0,0,0,0|2,0,0]=4 14546 B15R1.5448 CC(=O)CCCSc1cc(cc(c1)Br)Cl 62a_100011215641_100009814755 [0,2,0,0,0,0|2,0,0]=4 14547 B15R1.5448 CC(=O)CCCSc1cc(cc(c1)Br)F 62a_100009814764_100011215641 [0,2,0,0,0,0|2,0,0]=4 14548 B15R1.5448 CC(=O)CCCSc1cc(cc(c1)Br)F 62a_100011215641_100009814764 [0,2,0,0,0,0|2,0,0]=4 14549 B15R1.5448 CC(=O)CCCSc1cc(cc(c1)Br)N 62a_100009814763_100011215641 [0,2,0,0,0,0|2,0,0]=4 14550 B15R1.5448 CC(=O)CCCSc1cc(cc(c1)Br)N 62a_100011215641_100009814763 [0,2,0,0,0,0|2,0,0]=4 14551 B15R1.5448 CC(=O)CCCSc1cc(cc(c1)Br)O 62a_100010068917_100011215641 [0,2,0,0,0,0|2,0,0]=4 14552 B15R1.5448 CC(=O)CCCSc1cc(cc(c1)Br)O 62a_100011215641_100010068917 [0,2,0,0,0,0|2,0,0]=4 14553 B15R1.5448 CC(=O)CCCSc1cc(cc(c1)C)C 62a_100011215608_100011215641 [0,2,0,0,0,0|2,0,0]=4 14554 B15R1.5448 CC(=O)CCCSc1cc(cc(c1)C)C 62a_100011215641_100011215608 [0,2,0,0,0,0|2,0,0]=4 14555 B15R1.5448 CC(=O)CCCSc1cc(cc(c1)Cl)C 62a_100010172791_100011215641 [0,2,0,0,0,0|2,0,0]=4 14556 B15R1.5448 CC(=O)CCCSc1cc(cc(c1)Cl)C 62a_100011215641_100010172791 [0,2,0,0,0,0|2,0,0]=4 14557 B15R1.5448 CC(=O)CCCSc1cc(cc(c1)Cl)Cl 62a_100000747138_100011215641 [0,2,0,0,0,0|2,0,0]=4 14558 B15R1.5448 CC(=O)CCCSc1cc(cc(c1)Cl)Cl 62a_100011215641_100000747138 [0,2,0,0,0,0|2,0,0]=4 14559 B15R1.5448 CC(=O)CCCSc1cc(cc(c1)Cl)F 62a_100011215641_100013859453 [0,2,0,0,0,0|2,0,0]=4 14560 B15R1.5448 CC(=O)CCCSc1cc(cc(c1)Cl)F 62a_100013859453_100011215641 [0,2,0,0,0,0|2,0,0]=4 14561 B15R1.5448 CC(=O)CCCSc1cc(cc(c1)Cl)N 62a_100010147676_100011215641 [0,2,0,0,0,0|2,0,0]=4 14562 B15R1.5448 CC(=O)CCCSc1cc(cc(c1)Cl)N 62a_100011215641_100010147676 [0,2,0,0,0,0|2,0,0]=4 14563 B15R1.5448 CC(=O)CCCSc1cc(cc(c1)Cl)O 62a_100010068924_100011215641 [0,2,0,0,0,0|2,0,0]=4 14564 B15R1.5448 CC(=O)CCCSc1cc(cc(c1)Cl)O 62a_100011215641_100010068924 [0,2,0,0,0,0|2,0,0]=4 14565 B15R1.5448 CC(=O)CCCSc1cc(cc(c1)F)C 62a_100011215641_100011356977 [0,2,0,0,0,0|2,0,0]=4 14566 B15R1.5448 CC(=O)CCCSc1cc(cc(c1)F)C 62a_100011356977_100011215641 [0,2,0,0,0,0|2,0,0]=4 14567 B15R1.5448 CC(=O)CCCSc1cc(cc(c1)F)F 62a_100000233788_100011215641 [0,2,0,0,0,0|2,0,0]=4 14568 B15R1.5448 CC(=O)CCCSc1cc(cc(c1)F)F 62a_100011215641_100000233788 [0,2,0,0,0,0|2,0,0]=4 14569 B15R1.5448 CC(=O)CCCSc1cc(cc(c1)F)N 62a_100011215641_100011356972 [0,2,0,0,0,0|2,0,0]=4 14570 B15R1.5448 CC(=O)CCCSc1cc(cc(c1)F)N 62a_100011356972_100011215641 [0,2,0,0,0,0|2,0,0]=4 14571 B15R1.5448 CC(=O)CCCSc1cc(cc(c1)F)O 62a_100000688818_100011215641 [0,2,0,0,0,0|2,0,0]=4 14572 B15R1.5448 CC(=O)CCCSc1cc(cc(c1)F)O 62a_100011215641_100000688818 [0,2,0,0,0,0|2,0,0]=4 14573 B15R1.5448 CC(=O)CCCSc1cc(cc(c1)N)C 62a_100000695972_100011215641 [0,2,0,0,0,0|2,0,0]=4 14574 B15R1.5448 CC(=O)CCCSc1cc(cc(c1)N)C 62a_100011215641_100000695972 [0,2,0,0,0,0|2,0,0]=4 14575 B15R1.5448 CC(=O)CCCSc1cc(cc(c1)N)N 62a_100011215641_100011999608 [0,2,0,0,0,0|2,0,0]=4 14576 B15R1.5448 CC(=O)CCCSc1cc(cc(c1)N)N 62a_100011999608_100011215641 [0,2,0,0,0,0|2,0,0]=4 14577 B15R1.5448 CC(=O)CCCSc1cc(cc(c1)O)C 62a_100011215641_100011999630 [0,2,0,0,0,0|2,0,0]=4 14578 B15R1.5448 CC(=O)CCCSc1cc(cc(c1)O)O 62a_100011215641_100009868816 [0,2,0,0,0,0|2,0,0]=4 14579 B15R1.5448 CC(=O)CCOCc1cc(cc(c1)Br)Br 34a_100000759926_100011216082 [0,2,0,0,0,0|2,0,0]=4 14580 B15R1.5448 CC(=O)CCOCc1cc(cc(c1)Br)Br 7a_100000759926_100011216082 [0,2,0,0,0,0|2,0,0]=4 14581 B15R1.5448 CC(=O)CCOCc1cc(cc(c1)Br)Br 7a_100011218366_100000053229 [0,2,0,0,0,0|2,0,0]=4 14582 B15R1.5448 CC(=O)CCOCc1cc(cc(c1)Br)C 34a_100000759926_100012348363 [0,2,0,0,0,0|2,0,0]=4 14583 B15R1.5448 CC(=O)CCOCc1cc(cc(c1)Br)C 7a_100000720511_100000053229 [0,2,0,0,0,0|2,0,0]=4 14584 B15R1.5448 CC(=O)CCOCc1cc(cc(c1)Br)C 7a_100000759926_100012348363 [0,2,0,0,0,0|2,0,0]=4 14585 B15R1.5448 CC(=O)CCOCc1cc(cc(c1)Br)Cl 7a_100012353933_100000053229 [0,2,0,0,0,0|2,0,0]=4 14586 B15R1.5448 CC(=O)CCOCc1cc(cc(c1)Br)F 34a_100000759926_100000766940 [0,2,0,0,0,0|2,0,0]=4 14587 B15R1.5448 CC(=O)CCOCc1cc(cc(c1)Br)F 7a_100000759926_100000766940 [0,2,0,0,0,0|2,0,0]=4 14588 B15R1.5448 CC(=O)CCOCc1cc(cc(c1)Br)F 7a_100000766897_100000053229 [0,2,0,0,0,0|2,0,0]=4 14589 B15R1.5448 CC(=O)CCOCc1cc(cc(c1)C)C 34a_100000759926_100000181317 [0,2,0,0,0,0|2,0,0]=4 14590 B15R1.5448 CC(=O)CCOCc1cc(cc(c1)C)C 7a_100000759926_100000181317 [0,2,0,0,0,0|2,0,0]=4 14591 B15R1.5448 CC(=O)CCOCc1cc(cc(c1)C)C 7a_100011216556_100000053229 [0,2,0,0,0,0|2,0,0]=4 14592 B15R1.5448 CC(=O)CCOCc1cc(cc(c1)Cl)Cl 7a_100000759926_100011219208 [0,2,0,0,0,0|2,0,0]=4 14593 B15R1.5448 CC(=O)CCOCc1cc(cc(c1)Cl)Cl 7a_100011218629_100000053229 [0,2,0,0,0,0|2,0,0]=4 14594 B15R1.5448 CC(=O)CCOCc1cc(cc(c1)Cl)F 34a_100000759926_100011219885 [0,2,0,0,0,0|2,0,0]=4 14595 B15R1.5448 CC(=O)CCOCc1cc(cc(c1)Cl)F 7a_100000759926_100011219885 [0,2,0,0,0,0|2,0,0]=4 14596 B15R1.5448 CC(=O)CCOCc1cc(cc(c1)Cl)F 7a_100011217560_100000053229 [0,2,0,0,0,0|2,0,0]=4 14597 B15R1.5448 CC(=O)CCOCc1cc(cc(c1)Cl)N 7a_100012002482_100000053229 [0,2,0,0,0,0|2,0,0]=4 14598 B15R1.5448 CC(=O)CCOCc1cc(cc(c1)F)C 34a_100000759926_100011219130 [0,2,0,0,0,0|2,0,0]=4 14599 B15R1.5448 CC(=O)CCOCc1cc(cc(c1)F)C 7a_100000759926_100011219130 [0,2,0,0,0,0|2,0,0]=4 14600 B15R1.5448 CC(=O)CCOCc1cc(cc(c1)F)C 7a_100011217934_100000053229 [0,2,0,0,0,0|2,0,0]=4 14601 B15R1.5448 CC(=O)CCOCc1cc(cc(c1)F)F 34a_100000759926_100000697002 [0,2,0,0,0,0|2,0,0]=4 14602 B15R1.5448 CC(=O)CCOCc1cc(cc(c1)F)F 7a_100000759926_100000697002 [0,2,0,0,0,0|2,0,0]=4 14603 B15R1.5448 CC(=O)CCOCc1cc(cc(c1)F)F 7a_100011215443_100000053229 [0,2,0,0,0,0|2,0,0]=4 14604 B15R1.5448 CC(=O)CCOCc1cc(cc(c1)I)Br 34a_100000759926_100010146614 [0,2,0,0,0,0|2,0,0]=4 14605 B15R1.5448 CC(=O)CCOCc1cc(cc(c1)I)Br 7a_100000759926_100010146614 [0,2,0,0,0,0|2,0,0]=4 14606 B15R1.5448 CC(=O)CCOCc1cc(cc(c1)I)Br 7a_100009814756_100000053229 [0,2,0,0,0,0|2,0,0]=4 14607 B15R1.5448 CC(=O)CCOCc1cc(cc(c1)I)F 34a_100000759926_100010149605 [0,2,0,0,0,0|2,0,0]=4 14608 B15R1.5448 CC(=O)CCOCc1cc(cc(c1)I)F 7a_100000759926_100010149605 [0,2,0,0,0,0|2,0,0]=4 14609 B15R1.5448 CC(=O)CCOCc1cc(cc(c1)I)F 7a_100010149598_100000053229 [0,2,0,0,0,0|2,0,0]=4 14610 B15R1.5448 CC(=O)CCOCc1cc(cc(c1)I)I 7a_100010205817_100000053229 [0,2,0,0,0,0|2,0,0]=4 14611 B15R1.5448 CC(=O)CCSCc1cc(cc(c1)Br)Br 62a_100000053229_100011216082 [0,2,0,0,0,0|2,0,0]=4 14612 B15R1.5448 CC(=O)CCSCc1cc(cc(c1)Br)Br 62a_100011216082_100000053229 [0,2,0,0,0,0|2,0,0]=4 14613 B15R1.5448 CC(=O)CCSCc1cc(cc(c1)Br)C 62a_100000053229_100012348363 [0,2,0,0,0,0|2,0,0]=4 14614 B15R1.5448 CC(=O)CCSCc1cc(cc(c1)Br)C 62a_100012348363_100000053229 [0,2,0,0,0,0|2,0,0]=4 14615 B15R1.5448 CC(=O)CCSCc1cc(cc(c1)Br)F 62a_100000053229_100000766940 [0,2,0,0,0,0|2,0,0]=4 14616 B15R1.5448 CC(=O)CCSCc1cc(cc(c1)Br)F 62a_100000766940_100000053229 [0,2,0,0,0,0|2,0,0]=4 14617 B15R1.5448 CC(=O)CCSCc1cc(cc(c1)C)C 62a_100000053229_100000181317 [0,2,0,0,0,0|2,0,0]=4 14618 B15R1.5448 CC(=O)CCSCc1cc(cc(c1)C)C 62a_100000181317_100000053229 [0,2,0,0,0,0|2,0,0]=4 14619 B15R1.5448 CC(=O)CCSCc1cc(cc(c1)Cl)Cl 62a_100000053229_100011219208 [0,2,0,0,0,0|2,0,0]=4 14620 B15R1.5448 CC(=O)CCSCc1cc(cc(c1)Cl)Cl 62a_100011219208_100000053229 [0,2,0,0,0,0|2,0,0]=4 14621 B15R1.5448 CC(=O)CCSCc1cc(cc(c1)Cl)F 62a_100000053229_100011219885 [0,2,0,0,0,0|2,0,0]=4 14622 B15R1.5448 CC(=O)CCSCc1cc(cc(c1)Cl)F 62a_100011219885_100000053229 [0,2,0,0,0,0|2,0,0]=4 14623 B15R1.5448 CC(=O)CCSCc1cc(cc(c1)F)C 62a_100000053229_100011219130 [0,2,0,0,0,0|2,0,0]=4 14624 B15R1.5448 CC(=O)CCSCc1cc(cc(c1)F)C 62a_100011219130_100000053229 [0,2,0,0,0,0|2,0,0]=4 14625 B15R1.5448 CC(=O)CCSCc1cc(cc(c1)F)F 62a_100000053229_100000697002 [0,2,0,0,0,0|2,0,0]=4 14626 B15R1.5448 CC(=O)CCSCc1cc(cc(c1)F)F 62a_100000697002_100000053229 [0,2,0,0,0,0|2,0,0]=4 14627 B15R1.5448 CC(=O)CCSCc1cc(cc(c1)I)Br 62a_100000053229_100010146614 [0,2,0,0,0,0|2,0,0]=4 14628 B15R1.5448 CC(=O)CCSCc1cc(cc(c1)I)Br 62a_100010146614_100000053229 [0,2,0,0,0,0|2,0,0]=4 14629 B15R1.5448 CC(=O)CCSCc1cc(cc(c1)I)F 62a_100000053229_100010149605 [0,2,0,0,0,0|2,0,0]=4 14630 B15R1.5448 CC(=O)CCSCc1cc(cc(c1)I)F 62a_100010149605_100000053229 [0,2,0,0,0,0|2,0,0]=4 14631 B15R1.5448 CC(=O)COCCc1cc(cc(c1)Cl)Cl 34a_100000211253_100000691793 [0,2,0,0,0,0|2,0,0]=4 14632 B15R1.5448 CC(=O)COCCc1cc(cc(c1)F)F 34a_100000211253_100011754442 [0,2,0,0,0,0|2,0,0]=4 14633 B15R1.5448 Cc1cc(cc(c1)CNCCC(=O)N)Br 207a_100000740010_100000686105 [0,2,0,0,0,0|2,0,0]=4 14634 B15R1.5448 Cc1cc(cc(c1)CNCCC(=O)N)Br 269862a_100000740010_100000686105 [0,2,0,0,0,0|2,0,0]=4 14635 B15R1.5448 Cc1cc(cc(c1)CNCCC(=O)N)C 207a_100000740010_100000745632 [0,2,0,0,0,0|2,0,0]=4 14636 B15R1.5448 Cc1cc(cc(c1)CNCCC(=O)N)C 2230a_100020591340_100000744528 [0,2,0,0,0,0|2,0,0]=4 14637 B15R1.5448 Cc1cc(cc(c1)CNCCC(=O)N)C 34a_100020591340_100000731001 [0,2,0,0,0,0|2,0,0]=4 14638 B15R1.5448 Cc1cc(cc(c1)CNCCC(=O)N)Cl 207a_100000740010_100000684525 [0,2,0,0,0,0|2,0,0]=4 14639 B15R1.5448 Cc1cc(cc(c1)CNCCC(=O)N)F 207a_100000740010_100011217087 [0,2,0,0,0,0|2,0,0]=4 14640 B15R1.5448 Cc1cc(cc(c1)CNCCC(=O)N)F 2230a_100011830484_100000744528 [0,2,0,0,0,0|2,0,0]=4 14641 B15R1.5448 Cc1cc(cc(c1)CNCCC(=O)N)F 34a_100011830484_100000731001 [0,2,0,0,0,0|2,0,0]=4 14642 B15R1.5448 Cc1cc(cc(c1)CNCCC(=O)N)O 207a_100000740010_100009853434 [0,2,0,0,0,0|2,0,0]=4 14643 B15R1.5448 Cc1cc(cc(c1)CNOCC(=O)O)Br 269956a_100000106656_100012348363 [0,2,0,0,0,0|2,0,0]=4 14644 B15R1.5448 Cc1cc(cc(c1)CNOCC(=O)O)C 269956a_100000106656_100000181317 [0,2,0,0,0,0|2,0,0]=4 14645 B15R1.5448 Cc1cc(cc(c1)CNOCC(=O)O)F 269956a_100000106656_100011219130 [0,2,0,0,0,0|2,0,0]=4 14646 B15R1.5448 Cc1cc(cc(c1)COCCC(=O)N)Br 34a_100000720511_100000731001 [0,2,0,0,0,0|2,0,0]=4 14647 B15R1.5448 Cc1cc(cc(c1)COCCC(=O)N)Br 34a_100000757172_100012348363 [0,2,0,0,0,0|2,0,0]=4 14648 B15R1.5448 Cc1cc(cc(c1)COCCC(=O)N)Br 7a_100000720511_100000744528 [0,2,0,0,0,0|2,0,0]=4 14649 B15R1.5448 Cc1cc(cc(c1)COCCC(=O)N)Br 7a_100000757172_100012348363 [0,2,0,0,0,0|2,0,0]=4 14650 B15R1.5448 Cc1cc(cc(c1)COCCC(=O)N)C 34a_100000757172_100000181317 [0,2,0,0,0,0|2,0,0]=4 14651 B15R1.5448 Cc1cc(cc(c1)COCCC(=O)N)C 34a_100011216556_100000731001 [0,2,0,0,0,0|2,0,0]=4 14652 B15R1.5448 Cc1cc(cc(c1)COCCC(=O)N)C 7a_100000757172_100000181317 [0,2,0,0,0,0|2,0,0]=4 14653 B15R1.5448 Cc1cc(cc(c1)COCCC(=O)N)C 7a_100011216556_100000744528 [0,2,0,0,0,0|2,0,0]=4 14654 B15R1.5448 Cc1cc(cc(c1)COCCC(=O)N)F 34a_100000757172_100011219130 [0,2,0,0,0,0|2,0,0]=4 14655 B15R1.5448 Cc1cc(cc(c1)COCCC(=O)N)F 34a_100011217934_100000731001 [0,2,0,0,0,0|2,0,0]=4 14656 B15R1.5448 Cc1cc(cc(c1)COCCC(=O)N)F 7a_100000757172_100011219130 [0,2,0,0,0,0|2,0,0]=4 14657 B15R1.5448 Cc1cc(cc(c1)COCCC(=O)N)F 7a_100011217934_100000744528 [0,2,0,0,0,0|2,0,0]=4 14658 B15R1.5448 Cc1cc(cc(c1)CSCCC(=O)N)Br 62a_100000744528_100012348363 [0,2,0,0,0,0|2,0,0]=4 14659 B15R1.5448 Cc1cc(cc(c1)CSCCC(=O)N)Br 62a_100012348363_100000744528 [0,2,0,0,0,0|2,0,0]=4 14660 B15R1.5448 Cc1cc(cc(c1)CSCCC(=O)N)C 62a_100000181317_100000744528 [0,2,0,0,0,0|2,0,0]=4 14661 B15R1.5448 Cc1cc(cc(c1)CSCCC(=O)N)C 62a_100000744528_100000181317 [0,2,0,0,0,0|2,0,0]=4 14662 B15R1.5448 Cc1cc(cc(c1)CSCCC(=O)N)F 62a_100000744528_100011219130 [0,2,0,0,0,0|2,0,0]=4 14663 B15R1.5448 Cc1cc(cc(c1)CSCCC(=O)N)F 62a_100011219130_100000744528 [0,2,0,0,0,0|2,0,0]=4 14664 B15R1.5448 Cc1cc(cc(c1)NCCCC(=O)N)Br 34a_100000695972_100102525003 [0,2,0,0,0,0|2,0,0]=4 14665 B15R1.5448 Cc1cc(cc(c1)NCCCC(=O)N)Br 7a_100000695972_100102525003 [0,2,0,0,0,0|2,0,0]=4 14666 B15R1.5448 Cc1cc(cc(c1)NCCCC(=O)N)C 34a_100000210930_100102525003 [0,2,0,0,0,0|2,0,0]=4 14667 B15R1.5448 Cc1cc(cc(c1)NCCCC(=O)N)C 7a_100000210930_100102525003 [0,2,0,0,0,0|2,0,0]=4 14668 B15R1.5448 Cc1cc(cc(c1)NCCCC(=O)N)Cl 34a_100012022512_100102525003 [0,2,0,0,0,0|2,0,0]=4 14669 B15R1.5448 Cc1cc(cc(c1)NCCCC(=O)N)Cl 7a_100012022512_100102525003 [0,2,0,0,0,0|2,0,0]=4 14670 B15R1.5448 Cc1cc(cc(c1)NCCCC(=O)N)F 34a_100000742734_100102525003 [0,2,0,0,0,0|2,0,0]=4 14671 B15R1.5448 Cc1cc(cc(c1)NCCCC(=O)N)F 7a_100000742734_100102525003 [0,2,0,0,0,0|2,0,0]=4 14672 B15R1.5448 Cc1cc(cc(c1)NCCCC(=O)N)O 34a_100011995906_100102525003 [0,2,0,0,0,0|2,0,0]=4 14673 B15R1.5448 Cc1cc(cc(c1)NCCCC(=O)N)O 7a_100011995906_100102525003 [0,2,0,0,0,0|2,0,0]=4 14674 B15R1.5448 Cc1cc(cc(c1)OCCCC(=O)N)Br 34a_100011999630_100102525003 [0,2,0,0,0,0|2,0,0]=4 14675 B15R1.5448 Cc1cc(cc(c1)OCCCC(=O)N)Br 7a_100011999630_100102525003 [0,2,0,0,0,0|2,0,0]=4 14676 B15R1.5448 Cc1cc(cc(c1)OCCCC(=O)N)C 34a_100000210933_100102525003 [0,2,0,0,0,0|2,0,0]=4 14677 B15R1.5448 Cc1cc(cc(c1)OCCCC(=O)N)C 7a_100000210933_100102525003 [0,2,0,0,0,0|2,0,0]=4 14678 B15R1.5448 Cc1cc(cc(c1)OCCCC(=O)N)Cl 34a_100000087485_100102525003 [0,2,0,0,0,0|2,0,0]=4 14679 B15R1.5448 Cc1cc(cc(c1)OCCCC(=O)N)Cl 7a_100000087485_100102525003 [0,2,0,0,0,0|2,0,0]=4 14680 B15R1.5448 Cc1cc(cc(c1)OCCCC(=O)N)F 34a_100011830401_100102525003 [0,2,0,0,0,0|2,0,0]=4 14681 B15R1.5448 Cc1cc(cc(c1)OCCCC(=O)N)F 7a_100011830401_100102525003 [0,2,0,0,0,0|2,0,0]=4 14682 B15R1.5448 Cc1cc(cc(c1)OCCCC(=O)N)N 34a_100011995906_100102525003 [0,2,0,0,0,0|2,0,0]=4 14683 B15R1.5448 Cc1cc(cc(c1)OCCCC(=O)N)N 7a_100011995906_100102525003 [0,2,0,0,0,0|2,0,0]=4 14684 B15R1.5448 Cc1cc(cc(c1)SCCCC(=O)N)C 62a_100011215608_100102525003 [0,2,0,0,0,0|2,0,0]=4 14685 B15R1.5448 Cc1cc(cc(c1)SCCCC(=O)N)C 62a_100102525003_100011215608 [0,2,0,0,0,0|2,0,0]=4 14686 B15R1.5448 Cc1cc(cc(c1)SCCCC(=O)N)Cl 62a_100010172791_100102525003 [0,2,0,0,0,0|2,0,0]=4 14687 B15R1.5448 Cc1cc(cc(c1)SCCCC(=O)N)Cl 62a_100102525003_100010172791 [0,2,0,0,0,0|2,0,0]=4 14688 B15R1.5448 Cc1cc(cc(c1)SCCCC(=O)N)F 62a_100011356977_100102525003 [0,2,0,0,0,0|2,0,0]=4 14689 B15R1.5448 Cc1cc(cc(c1)SCCCC(=O)N)F 62a_100102525003_100011356977 [0,2,0,0,0,0|2,0,0]=4 14690 B15R1.5448 Cc1cc(cc(c1)SCCCC(=O)N)N 62a_100000695972_100102525003 [0,2,0,0,0,0|2,0,0]=4 14691 B15R1.5448 Cc1cc(cc(c1)SCCCC(=O)N)N 62a_100102525003_100000695972 [0,2,0,0,0,0|2,0,0]=4 14692 B15R1.5448 Cc1cc(cc(c1)SCCCC(=O)N)O 62a_100102525003_100011999630 [0,2,0,0,0,0|2,0,0]=4 14693 B15R1.5448 NC(=O)CCCNc1cc(cc(c1)Br)Br 27a_100000739312_100009814770 [0,2,0,0,0,0|2,0,0]=4 14694 B15R1.5448 NC(=O)CCCNc1cc(cc(c1)Br)Br 34a_100012047176_100102525003 [0,2,0,0,0,0|2,0,0]=4 14695 B15R1.5448 NC(=O)CCCNc1cc(cc(c1)Br)Br 7a_100012047176_100102525003 [0,2,0,0,0,0|2,0,0]=4 14696 B15R1.5448 NC(=O)CCCNc1cc(cc(c1)Br)Cl 34a_100011934539_100102525003 [0,2,0,0,0,0|2,0,0]=4 14697 B15R1.5448 NC(=O)CCCNc1cc(cc(c1)Br)Cl 7a_100011934539_100102525003 [0,2,0,0,0,0|2,0,0]=4 14698 B15R1.5448 NC(=O)CCCNc1cc(cc(c1)Br)F 34a_100000705686_100102525003 [0,2,0,0,0,0|2,0,0]=4 14699 B15R1.5448 NC(=O)CCCNc1cc(cc(c1)Br)F 7a_100000705686_100102525003 [0,2,0,0,0,0|2,0,0]=4 14700 B15R1.5448 NC(=O)CCCNc1cc(cc(c1)Cl)Cl 34a_100000210456_100102525003 [0,2,0,0,0,0|2,0,0]=4 14701 B15R1.5448 NC(=O)CCCNc1cc(cc(c1)Cl)Cl 7a_100000210456_100102525003 [0,2,0,0,0,0|2,0,0]=4 14702 B15R1.5448 NC(=O)CCCNc1cc(cc(c1)Cl)F 34a_100000686136_100102525003 [0,2,0,0,0,0|2,0,0]=4 14703 B15R1.5448 NC(=O)CCCNc1cc(cc(c1)Cl)F 7a_100000686136_100102525003 [0,2,0,0,0,0|2,0,0]=4 14704 B15R1.5448 NC(=O)CCCNc1cc(cc(c1)Cl)O 34a_100000123917_100102525003 [0,2,0,0,0,0|2,0,0]=4 14705 B15R1.5448 NC(=O)CCCNc1cc(cc(c1)Cl)O 7a_100000123917_100102525003 [0,2,0,0,0,0|2,0,0]=4 14706 B15R1.5448 NC(=O)CCCNc1cc(cc(c1)F)F 34a_100000233717_100102525003 [0,2,0,0,0,0|2,0,0]=4 14707 B15R1.5448 NC(=O)CCCNc1cc(cc(c1)F)F 7a_100000233717_100102525003 [0,2,0,0,0,0|2,0,0]=4 14708 B15R1.5448 NC(=O)CCCNc1cc(cc(c1)I)Br 7a_100009814763_100102525003 [0,2,0,0,0,0|2,0,0]=4 14709 B15R1.5448 NC(=O)CCCNc1cc(cc(c1)I)Cl 7a_100010147676_100102525003 [0,2,0,0,0,0|2,0,0]=4 14710 B15R1.5448 NC(=O)CCCNc1cc(cc(c1)I)F 34a_100011356972_100102525003 [0,2,0,0,0,0|2,0,0]=4 14711 B15R1.5448 NC(=O)CCCNc1cc(cc(c1)I)F 7a_100011356972_100102525003 [0,2,0,0,0,0|2,0,0]=4 14712 B15R1.5448 NC(=O)CCCNc1cc(cc(c1)I)I 7a_200000696836_100102525003 [0,2,0,0,0,0|2,0,0]=4 14713 B15R1.5448 NC(=O)CCCNc1cc(cc(c1)O)O 34a_100000043371_100102525003 [0,2,0,0,0,0|2,0,0]=4 14714 B15R1.5448 NC(=O)CCCOc1cc(cc(c1)Br)Br 34a_100010167048_100102525003 [0,2,0,0,0,0|2,0,0]=4 14715 B15R1.5448 NC(=O)CCCOc1cc(cc(c1)Br)Br 7a_100010167048_100102525003 [0,2,0,0,0,0|2,0,0]=4 14716 B15R1.5448 NC(=O)CCCOc1cc(cc(c1)Br)Cl 34a_100010185897_100102525003 [0,2,0,0,0,0|2,0,0]=4 14717 B15R1.5448 NC(=O)CCCOc1cc(cc(c1)Br)Cl 7a_100010185897_100102525003 [0,2,0,0,0,0|2,0,0]=4 14718 B15R1.5448 NC(=O)CCCOc1cc(cc(c1)Br)F 34a_100000688818_100102525003 [0,2,0,0,0,0|2,0,0]=4 14719 B15R1.5448 NC(=O)CCCOc1cc(cc(c1)Br)F 7a_100000688818_100102525003 [0,2,0,0,0,0|2,0,0]=4 14720 B15R1.5448 NC(=O)CCCOc1cc(cc(c1)Cl)Cl 34a_100000181315_100102525003 [0,2,0,0,0,0|2,0,0]=4 14721 B15R1.5448 NC(=O)CCCOc1cc(cc(c1)Cl)Cl 7a_100000181315_100102525003 [0,2,0,0,0,0|2,0,0]=4 14722 B15R1.5448 NC(=O)CCCOc1cc(cc(c1)Cl)F 34a_100011219751_100102525003 [0,2,0,0,0,0|2,0,0]=4 14723 B15R1.5448 NC(=O)CCCOc1cc(cc(c1)Cl)F 7a_100011219751_100102525003 [0,2,0,0,0,0|2,0,0]=4 14724 B15R1.5448 NC(=O)CCCOc1cc(cc(c1)Cl)N 34a_100000123917_100102525003 [0,2,0,0,0,0|2,0,0]=4 14725 B15R1.5448 NC(=O)CCCOc1cc(cc(c1)Cl)N 7a_100000123917_100102525003 [0,2,0,0,0,0|2,0,0]=4 14726 B15R1.5448 NC(=O)CCCOc1cc(cc(c1)F)F 34a_100000747503_100102525003 [0,2,0,0,0,0|2,0,0]=4 14727 B15R1.5448 NC(=O)CCCOc1cc(cc(c1)F)F 7a_100000747503_100102525003 [0,2,0,0,0,0|2,0,0]=4 14728 B15R1.5448 NC(=O)CCCOc1cc(cc(c1)I)Br 34a_100010068917_100102525003 [0,2,0,0,0,0|2,0,0]=4 14729 B15R1.5448 NC(=O)CCCOc1cc(cc(c1)I)Br 7a_100010068917_100102525003 [0,2,0,0,0,0|2,0,0]=4 14730 B15R1.5448 NC(=O)CCCOc1cc(cc(c1)I)Cl 34a_100010068924_100102525003 [0,2,0,0,0,0|2,0,0]=4 14731 B15R1.5448 NC(=O)CCCOc1cc(cc(c1)I)Cl 7a_100010068924_100102525003 [0,2,0,0,0,0|2,0,0]=4 14732 B15R1.5448 NC(=O)CCCOc1cc(cc(c1)I)F 34a_100000717995_100102525003 [0,2,0,0,0,0|2,0,0]=4 14733 B15R1.5448 NC(=O)CCCOc1cc(cc(c1)I)F 7a_100000717995_100102525003 [0,2,0,0,0,0|2,0,0]=4 14734 B15R1.5448 NC(=O)CCCSc1cc(cc(c1)Br)Br 62a_100009814770_100102525003 [0,2,0,0,0,0|2,0,0]=4 14735 B15R1.5448 NC(=O)CCCSc1cc(cc(c1)Br)Br 62a_100102525003_100009814770 [0,2,0,0,0,0|2,0,0]=4 14736 B15R1.5448 NC(=O)CCCSc1cc(cc(c1)Br)Cl 62a_100009814755_100102525003 [0,2,0,0,0,0|2,0,0]=4 14737 B15R1.5448 NC(=O)CCCSc1cc(cc(c1)Br)Cl 62a_100102525003_100009814755 [0,2,0,0,0,0|2,0,0]=4 14738 B15R1.5448 NC(=O)CCCSc1cc(cc(c1)Br)F 62a_100009814764_100102525003 [0,2,0,0,0,0|2,0,0]=4 14739 B15R1.5448 NC(=O)CCCSc1cc(cc(c1)Br)F 62a_100102525003_100009814764 [0,2,0,0,0,0|2,0,0]=4 14740 B15R1.5448 NC(=O)CCCSc1cc(cc(c1)Br)N 62a_100009814763_100102525003 [0,2,0,0,0,0|2,0,0]=4 14741 B15R1.5448 NC(=O)CCCSc1cc(cc(c1)Br)N 62a_100102525003_100009814763 [0,2,0,0,0,0|2,0,0]=4 14742 B15R1.5448 NC(=O)CCCSc1cc(cc(c1)Br)O 62a_100010068917_100102525003 [0,2,0,0,0,0|2,0,0]=4 14743 B15R1.5448 NC(=O)CCCSc1cc(cc(c1)Br)O 62a_100102525003_100010068917 [0,2,0,0,0,0|2,0,0]=4 14744 B15R1.5448 NC(=O)CCCSc1cc(cc(c1)Cl)Cl 62a_100000747138_100102525003 [0,2,0,0,0,0|2,0,0]=4 14745 B15R1.5448 NC(=O)CCCSc1cc(cc(c1)Cl)Cl 62a_100102525003_100000747138 [0,2,0,0,0,0|2,0,0]=4 14746 B15R1.5448 NC(=O)CCCSc1cc(cc(c1)Cl)F 62a_100013859453_100102525003 [0,2,0,0,0,0|2,0,0]=4 14747 B15R1.5448 NC(=O)CCCSc1cc(cc(c1)Cl)F 62a_100102525003_100013859453 [0,2,0,0,0,0|2,0,0]=4 14748 B15R1.5448 NC(=O)CCCSc1cc(cc(c1)Cl)N 62a_100010147676_100102525003 [0,2,0,0,0,0|2,0,0]=4 14749 B15R1.5448 NC(=O)CCCSc1cc(cc(c1)Cl)N 62a_100102525003_100010147676 [0,2,0,0,0,0|2,0,0]=4 14750 B15R1.5448 NC(=O)CCCSc1cc(cc(c1)Cl)O 62a_100010068924_100102525003 [0,2,0,0,0,0|2,0,0]=4 14751 B15R1.5448 NC(=O)CCCSc1cc(cc(c1)Cl)O 62a_100102525003_100010068924 [0,2,0,0,0,0|2,0,0]=4 14752 B15R1.5448 NC(=O)CCCSc1cc(cc(c1)F)F 62a_100000233788_100102525003 [0,2,0,0,0,0|2,0,0]=4 14753 B15R1.5448 NC(=O)CCCSc1cc(cc(c1)F)F 62a_100102525003_100000233788 [0,2,0,0,0,0|2,0,0]=4 14754 B15R1.5448 NC(=O)CCCSc1cc(cc(c1)F)N 62a_100011356972_100102525003 [0,2,0,0,0,0|2,0,0]=4 14755 B15R1.5448 NC(=O)CCCSc1cc(cc(c1)F)N 62a_100102525003_100011356972 [0,2,0,0,0,0|2,0,0]=4 14756 B15R1.5448 NC(=O)CCCSc1cc(cc(c1)F)O 62a_100000688818_100102525003 [0,2,0,0,0,0|2,0,0]=4 14757 B15R1.5448 NC(=O)CCCSc1cc(cc(c1)F)O 62a_100102525003_100000688818 [0,2,0,0,0,0|2,0,0]=4 14758 B15R1.5448 NC(=O)CCCSc1cc(cc(c1)N)N 62a_100011999608_100102525003 [0,2,0,0,0,0|2,0,0]=4 14759 B15R1.5448 NC(=O)CCCSc1cc(cc(c1)N)N 62a_100102525003_100011999608 [0,2,0,0,0,0|2,0,0]=4 14760 B15R1.5448 NC(=O)CCCSc1cc(cc(c1)O)O 62a_100102525003_100009868816 [0,2,0,0,0,0|2,0,0]=4 14761 B15R1.5448 NC(=O)CCNCc1cc(cc(c1)Br)Br 207a_100000740010_100000719502 [0,2,0,0,0,0|2,0,0]=4 14762 B15R1.5448 NC(=O)CCNCc1cc(cc(c1)Br)Br 2230a_100015211796_100000744528 [0,2,0,0,0,0|2,0,0]=4 14763 B15R1.5448 NC(=O)CCNCc1cc(cc(c1)Br)Br 269862a_100000740010_100000719502 [0,2,0,0,0,0|2,0,0]=4 14764 B15R1.5448 NC(=O)CCNCc1cc(cc(c1)Br)Br 34a_100015211796_100000731001 [0,2,0,0,0,0|2,0,0]=4 14765 B15R1.5448 NC(=O)CCNCc1cc(cc(c1)Br)Cl 207a_100000740010_100011934515 [0,2,0,0,0,0|2,0,0]=4 14766 B15R1.5448 NC(=O)CCNCc1cc(cc(c1)Br)Cl 269862a_100000740010_100011934515 [0,2,0,0,0,0|2,0,0]=4 14767 B15R1.5448 NC(=O)CCNCc1cc(cc(c1)Br)F 207a_100000740010_100011794424 [0,2,0,0,0,0|2,0,0]=4 14768 B15R1.5448 NC(=O)CCNCc1cc(cc(c1)Br)F 2230a_100020611034_100000744528 [0,2,0,0,0,0|2,0,0]=4 14769 B15R1.5448 NC(=O)CCNCc1cc(cc(c1)Br)F 269862a_100000740010_100011794424 [0,2,0,0,0,0|2,0,0]=4 14770 B15R1.5448 NC(=O)CCNCc1cc(cc(c1)Br)F 34a_100020611034_100000731001 [0,2,0,0,0,0|2,0,0]=4 14771 B15R1.5448 NC(=O)CCNCc1cc(cc(c1)Br)O 207a_100000740010_100010176088 [0,2,0,0,0,0|2,0,0]=4 14772 B15R1.5448 NC(=O)CCNCc1cc(cc(c1)Cl)Cl 207a_100000740010_100000741761 [0,2,0,0,0,0|2,0,0]=4 14773 B15R1.5448 NC(=O)CCNCc1cc(cc(c1)Cl)Cl 2230a_100011211636_100000744528 [0,2,0,0,0,0|2,0,0]=4 14774 B15R1.5448 NC(=O)CCNCc1cc(cc(c1)Cl)Cl 34a_100011211636_100000731001 [0,2,0,0,0,0|2,0,0]=4 14775 B15R1.5448 NC(=O)CCNCc1cc(cc(c1)Cl)F 207a_100000740010_100000703917 [0,2,0,0,0,0|2,0,0]=4 14776 B15R1.5448 NC(=O)CCNCc1cc(cc(c1)Cl)F 2230a_100137329012_100000744528 [0,2,0,0,0,0|2,0,0]=4 14777 B15R1.5448 NC(=O)CCNCc1cc(cc(c1)Cl)F 269862a_100000740010_100000703917 [0,2,0,0,0,0|2,0,0]=4 14778 B15R1.5448 NC(=O)CCNCc1cc(cc(c1)Cl)F 34a_100137329012_100000731001 [0,2,0,0,0,0|2,0,0]=4 14779 B15R1.5448 NC(=O)CCNCc1cc(cc(c1)Cl)O 207a_100000740010_100000050827 [0,2,0,0,0,0|2,0,0]=4 14780 B15R1.5448 NC(=O)CCNCc1cc(cc(c1)Cl)O 2230a_107254831445_100000744528 [0,2,0,0,0,0|2,0,0]=4 14781 B15R1.5448 NC(=O)CCNCc1cc(cc(c1)Cl)O 34a_107254831445_100000731001 [0,2,0,0,0,0|2,0,0]=4 14782 B15R1.5448 NC(=O)CCNCc1cc(cc(c1)F)F 207a_100000740010_100000743029 [0,2,0,0,0,0|2,0,0]=4 14783 B15R1.5448 NC(=O)CCNCc1cc(cc(c1)F)F 2230a_100000737602_100000744528 [0,2,0,0,0,0|2,0,0]=4 14784 B15R1.5448 NC(=O)CCNCc1cc(cc(c1)F)F 269862a_100000740010_100000743029 [0,2,0,0,0,0|2,0,0]=4 14785 B15R1.5448 NC(=O)CCNCc1cc(cc(c1)F)F 34a_100000737602_100000731001 [0,2,0,0,0,0|2,0,0]=4 14786 B15R1.5448 NC(=O)CCNCc1cc(cc(c1)F)O 207a_100000740010_100000703664 [0,2,0,0,0,0|2,0,0]=4 14787 B15R1.5448 NC(=O)CCNCc1cc(cc(c1)F)O 2230a_100160469513_100000744528 [0,2,0,0,0,0|2,0,0]=4 14788 B15R1.5448 NC(=O)CCNCc1cc(cc(c1)F)O 34a_100160469513_100000731001 [0,2,0,0,0,0|2,0,0]=4 14789 B15R1.5448 NC(=O)CCNCc1cc(cc(c1)I)Br 207a_100000740010_100010185649 [0,2,0,0,0,0|2,0,0]=4 14790 B15R1.5448 NC(=O)CCNCc1cc(cc(c1)I)Br 269862a_100000740010_100010185649 [0,2,0,0,0,0|2,0,0]=4 14791 B15R1.5448 NC(=O)CCNCc1cc(cc(c1)I)F 207a_100000740010_100010185655 [0,2,0,0,0,0|2,0,0]=4 14792 B15R1.5448 NC(=O)CCNCc1cc(cc(c1)I)F 269862a_100000740010_100010185655 [0,2,0,0,0,0|2,0,0]=4 14793 B15R1.5448 NC(=O)CCNCc1cc(cc(c1)I)I 207a_100000740010_100010185653 [0,2,0,0,0,0|2,0,0]=4 14794 B15R1.5448 NC(=O)CCNCc1cc(cc(c1)I)I 269862a_100000740010_100010185653 [0,2,0,0,0,0|2,0,0]=4 14795 B15R1.5448 NC(=O)CCNCc1cc(cc(c1)O)O 207a_100000740010_100000043415 [0,2,0,0,0,0|2,0,0]=4 14796 B15R1.5448 NC(=O)CCNCc1cc(cc(c1)O)O 2230a_100159270720_100000744528 [0,2,0,0,0,0|2,0,0]=4 14797 B15R1.5448 NC(=O)CCNCc1cc(cc(c1)O)O 34a_100159270720_100000731001 [0,2,0,0,0,0|2,0,0]=4 14798 B15R1.5448 NC(=O)CCOCc1cc(cc(c1)Br)Br 34a_100000757172_100011216082 [0,2,0,0,0,0|2,0,0]=4 14799 B15R1.5448 NC(=O)CCOCc1cc(cc(c1)Br)Br 34a_100011218366_100000731001 [0,2,0,0,0,0|2,0,0]=4 14800 B15R1.5448 NC(=O)CCOCc1cc(cc(c1)Br)Br 7a_100000757172_100011216082 [0,2,0,0,0,0|2,0,0]=4 14801 B15R1.5448 NC(=O)CCOCc1cc(cc(c1)Br)Br 7a_100011218366_100000744528 [0,2,0,0,0,0|2,0,0]=4 14802 B15R1.5448 NC(=O)CCOCc1cc(cc(c1)Br)Cl 34a_100012353933_100000731001 [0,2,0,0,0,0|2,0,0]=4 14803 B15R1.5448 NC(=O)CCOCc1cc(cc(c1)Br)Cl 7a_100012353933_100000744528 [0,2,0,0,0,0|2,0,0]=4 14804 B15R1.5448 NC(=O)CCOCc1cc(cc(c1)Br)F 34a_100000757172_100000766940 [0,2,0,0,0,0|2,0,0]=4 14805 B15R1.5448 NC(=O)CCOCc1cc(cc(c1)Br)F 34a_100000766897_100000731001 [0,2,0,0,0,0|2,0,0]=4 14806 B15R1.5448 NC(=O)CCOCc1cc(cc(c1)Br)F 7a_100000757172_100000766940 [0,2,0,0,0,0|2,0,0]=4 14807 B15R1.5448 NC(=O)CCOCc1cc(cc(c1)Br)F 7a_100000766897_100000744528 [0,2,0,0,0,0|2,0,0]=4 14808 B15R1.5448 NC(=O)CCOCc1cc(cc(c1)Cl)Cl 34a_100011218629_100000731001 [0,2,0,0,0,0|2,0,0]=4 14809 B15R1.5448 NC(=O)CCOCc1cc(cc(c1)Cl)Cl 7a_100000757172_100011219208 [0,2,0,0,0,0|2,0,0]=4 14810 B15R1.5448 NC(=O)CCOCc1cc(cc(c1)Cl)Cl 7a_100011218629_100000744528 [0,2,0,0,0,0|2,0,0]=4 14811 B15R1.5448 NC(=O)CCOCc1cc(cc(c1)Cl)F 34a_100000757172_100011219885 [0,2,0,0,0,0|2,0,0]=4 14812 B15R1.5448 NC(=O)CCOCc1cc(cc(c1)Cl)F 34a_100011217560_100000731001 [0,2,0,0,0,0|2,0,0]=4 14813 B15R1.5448 NC(=O)CCOCc1cc(cc(c1)Cl)F 7a_100000757172_100011219885 [0,2,0,0,0,0|2,0,0]=4 14814 B15R1.5448 NC(=O)CCOCc1cc(cc(c1)Cl)F 7a_100011217560_100000744528 [0,2,0,0,0,0|2,0,0]=4 14815 B15R1.5448 NC(=O)CCOCc1cc(cc(c1)Cl)N 34a_100012002482_100000731001 [0,2,0,0,0,0|2,0,0]=4 14816 B15R1.5448 NC(=O)CCOCc1cc(cc(c1)Cl)N 7a_100012002482_100000744528 [0,2,0,0,0,0|2,0,0]=4 14817 B15R1.5448 NC(=O)CCOCc1cc(cc(c1)F)F 34a_100000757172_100000697002 [0,2,0,0,0,0|2,0,0]=4 14818 B15R1.5448 NC(=O)CCOCc1cc(cc(c1)F)F 34a_100011215443_100000731001 [0,2,0,0,0,0|2,0,0]=4 14819 B15R1.5448 NC(=O)CCOCc1cc(cc(c1)F)F 7a_100000757172_100000697002 [0,2,0,0,0,0|2,0,0]=4 14820 B15R1.5448 NC(=O)CCOCc1cc(cc(c1)F)F 7a_100011215443_100000744528 [0,2,0,0,0,0|2,0,0]=4 14821 B15R1.5448 NC(=O)CCOCc1cc(cc(c1)I)Br 34a_100000757172_100010146614 [0,2,0,0,0,0|2,0,0]=4 14822 B15R1.5448 NC(=O)CCOCc1cc(cc(c1)I)Br 7a_100000757172_100010146614 [0,2,0,0,0,0|2,0,0]=4 14823 B15R1.5448 NC(=O)CCOCc1cc(cc(c1)I)Br 7a_100009814756_100000744528 [0,2,0,0,0,0|2,0,0]=4 14824 B15R1.5448 NC(=O)CCOCc1cc(cc(c1)I)F 34a_100000757172_100010149605 [0,2,0,0,0,0|2,0,0]=4 14825 B15R1.5448 NC(=O)CCOCc1cc(cc(c1)I)F 34a_100010149598_100000731001 [0,2,0,0,0,0|2,0,0]=4 14826 B15R1.5448 NC(=O)CCOCc1cc(cc(c1)I)F 7a_100000757172_100010149605 [0,2,0,0,0,0|2,0,0]=4 14827 B15R1.5448 NC(=O)CCOCc1cc(cc(c1)I)F 7a_100010149598_100000744528 [0,2,0,0,0,0|2,0,0]=4 14828 B15R1.5448 NC(=O)CCOCc1cc(cc(c1)I)I 7a_100010205817_100000744528 [0,2,0,0,0,0|2,0,0]=4 14829 B15R1.5448 NC(=O)CCOCc1cc(cc(c1)N)N 34a_100000032468_100000731001 [0,2,0,0,0,0|2,0,0]=4 14830 B15R1.5448 NC(=O)CCSCc1cc(cc(c1)Br)Br 62a_100000744528_100011216082 [0,2,0,0,0,0|2,0,0]=4 14831 B15R1.5448 NC(=O)CCSCc1cc(cc(c1)Br)Br 62a_100011216082_100000744528 [0,2,0,0,0,0|2,0,0]=4 14832 B15R1.5448 NC(=O)CCSCc1cc(cc(c1)Br)F 62a_100000744528_100000766940 [0,2,0,0,0,0|2,0,0]=4 14833 B15R1.5448 NC(=O)CCSCc1cc(cc(c1)Br)F 62a_100000766940_100000744528 [0,2,0,0,0,0|2,0,0]=4 14834 B15R1.5448 NC(=O)CCSCc1cc(cc(c1)Cl)Cl 62a_100000744528_100011219208 [0,2,0,0,0,0|2,0,0]=4 14835 B15R1.5448 NC(=O)CCSCc1cc(cc(c1)Cl)Cl 62a_100011219208_100000744528 [0,2,0,0,0,0|2,0,0]=4 14836 B15R1.5448 NC(=O)CCSCc1cc(cc(c1)Cl)F 62a_100000744528_100011219885 [0,2,0,0,0,0|2,0,0]=4 14837 B15R1.5448 NC(=O)CCSCc1cc(cc(c1)Cl)F 62a_100011219885_100000744528 [0,2,0,0,0,0|2,0,0]=4 14838 B15R1.5448 NC(=O)CCSCc1cc(cc(c1)F)F 62a_100000697002_100000744528 [0,2,0,0,0,0|2,0,0]=4 14839 B15R1.5448 NC(=O)CCSCc1cc(cc(c1)F)F 62a_100000744528_100000697002 [0,2,0,0,0,0|2,0,0]=4 14840 B15R1.5448 NC(=O)CCSCc1cc(cc(c1)I)Br 62a_100000744528_100010146614 [0,2,0,0,0,0|2,0,0]=4 14841 B15R1.5448 NC(=O)CCSCc1cc(cc(c1)I)Br 62a_100010146614_100000744528 [0,2,0,0,0,0|2,0,0]=4 14842 B15R1.5448 NC(=O)CCSCc1cc(cc(c1)I)F 62a_100000744528_100010149605 [0,2,0,0,0,0|2,0,0]=4 14843 B15R1.5448 NC(=O)CCSCc1cc(cc(c1)I)F 62a_100010149605_100000744528 [0,2,0,0,0,0|2,0,0]=4 14844 B15R1.5448 NC(=O)CNCCc1cc(cc(c1)Cl)Cl 2230a_100000711301_100000691793 [0,2,0,0,0,0|2,0,0]=4 14845 B15R1.5448 NC(=O)CNCCc1cc(cc(c1)Cl)Cl 2230a_100000746052_100000747473 [0,2,0,0,0,0|2,0,0]=4 14846 B15R1.5448 NC(=O)CNCCc1cc(cc(c1)Cl)Cl 34a_100000746052_100000187820 [0,2,0,0,0,0|2,0,0]=4 14847 B15R1.5448 NC(=O)CNCCc1cc(cc(c1)F)F 2230a_100000711301_100011754442 [0,2,0,0,0,0|2,0,0]=4 14848 B15R1.5448 NC(=O)CNCCc1cc(cc(c1)F)F 2230a_100000748410_100000747473 [0,2,0,0,0,0|2,0,0]=4 14849 B15R1.5448 NC(=O)CNCCc1cc(cc(c1)F)F 34a_100000748410_100000187820 [0,2,0,0,0,0|2,0,0]=4 14850 B15R1.5448 NC(=O)COCCc1cc(cc(c1)Br)Br 34a_100010243668_100000187820 [0,2,0,0,0,0|2,0,0]=4 14851 B15R1.5448 NC(=O)COCCc1cc(cc(c1)Br)Br 7a_100010243668_100000187820 [0,2,0,0,0,0|2,0,0]=4 14852 B15R1.5448 NC(=O)COCCc1cc(cc(c1)Br)F 34a_100012630564_100000187820 [0,2,0,0,0,0|2,0,0]=4 14853 B15R1.5448 NC(=O)COCCc1cc(cc(c1)Br)F 7a_100012630564_100000187820 [0,2,0,0,0,0|2,0,0]=4 14854 B15R1.5448 NC(=O)COCCc1cc(cc(c1)Cl)Cl 34a_100000720051_100000187820 [0,2,0,0,0,0|2,0,0]=4 14855 B15R1.5448 NC(=O)COCCc1cc(cc(c1)Cl)Cl 7a_100000720051_100000187820 [0,2,0,0,0,0|2,0,0]=4 14856 B15R1.5448 NC(=O)COCCc1cc(cc(c1)F)F 34a_100011754358_100000187820 [0,2,0,0,0,0|2,0,0]=4 14857 B15R1.5448 NC(=O)COCCc1cc(cc(c1)F)F 7a_100011754358_100000187820 [0,2,0,0,0,0|2,0,0]=4 14858 B15R1.5448 NC(=O)CSCCc1cc(cc(c1)Cl)Cl 62a_100000691793_100000747473 [0,2,0,0,0,0|2,0,0]=4 14859 B15R1.5448 NC(=O)CSCCc1cc(cc(c1)Cl)Cl 62a_100000747473_100000691793 [0,2,0,0,0,0|2,0,0]=4 14860 B15R1.5448 NC(=O)CSCCc1cc(cc(c1)F)F 62a_100000747473_100011754442 [0,2,0,0,0,0|2,0,0]=4 14861 B15R1.5448 NC(=O)CSCCc1cc(cc(c1)F)F 62a_100011754442_100000747473 [0,2,0,0,0,0|2,0,0]=4 14862 B15R1.5448 O=C(O)CNCCc1cc(cc(c1)Cl)Cl 269956a_100016091260_100000691793 [0,2,0,0,0,0|1,0,0]=3 14863 B15R1.5448 O=C(O)CNCCc1cc(cc(c1)F)F 269956a_100016091260_100011754442 [0,2,0,0,0,0|1,0,0]=3 14864 B15R1.5448 O=C(O)CONCc1cc(cc(c1)Br)Br 269956a_100000106656_100011216082 [0,2,0,0,0,0|2,0,0]=4 14865 B15R1.5448 O=C(O)CONCc1cc(cc(c1)Br)F 269956a_100000106656_100000766940 [0,2,0,0,0,0|2,0,0]=4 14866 B15R1.5448 O=C(O)CONCc1cc(cc(c1)Cl)Cl 269956a_100000106656_100011219208 [0,2,0,0,0,0|2,0,0]=4 14867 B15R1.5448 O=C(O)CONCc1cc(cc(c1)Cl)F 269956a_100000106656_100011219885 [0,2,0,0,0,0|2,0,0]=4 14868 B15R1.5448 O=C(O)CONCc1cc(cc(c1)F)F 269956a_100000106656_100000697002 [0,2,0,0,0,0|2,0,0]=4 14869 B15R1.5448 O=C(O)CONCc1cc(cc(c1)I)Br 269956a_100000106656_100010146614 [0,2,0,0,0,0|2,0,0]=4 14870 B15R1.5448 O=C(O)CONCc1cc(cc(c1)I)F 269956a_100000106656_100010149605 [0,2,0,0,0,0|2,0,0]=4 14871 B15R1.5448 O=C([O-])CNCCc1cc(cc(c1)Cl)Cl 34a_100000746052_100020667443 [0,2,0,0,0,0|1,0,1]=4 14872 B15R1.5448 O=C([O-])CNCCc1cc(cc(c1)F)F 34a_100000748410_100020667443 [0,2,0,0,0,0|1,0,1]=4 14873 B15R1.5448 O=C([O-])COCCc1cc(cc(c1)Br)Br 34a_100010243668_100020667443 [0,2,0,0,0,0|1,0,1]=4 14874 B15R1.5448 O=C([O-])COCCc1cc(cc(c1)Br)F 34a_100012630564_100020667443 [0,2,0,0,0,0|1,0,1]=4 14875 B15R1.5448 O=C([O-])COCCc1cc(cc(c1)Cl)Cl 34a_100000720051_100020667443 [0,2,0,0,0,0|1,0,1]=4 14876 B15R1.5448 O=C([O-])COCCc1cc(cc(c1)F)F 34a_100011754358_100020667443 [0,2,0,0,0,0|1,0,1]=4 14877 B15R1.5448 O=C([O-])CSCCc1cc(cc(c1)Cl)Cl 62a_100000691793_100020667443 [0,2,0,0,0,0|1,0,1]=4 14878 B15R1.5448 O=C([O-])CSCCc1cc(cc(c1)Cl)Cl 62a_100020667443_100000691793 [0,2,0,0,0,0|1,0,1]=4 14879 B15R1.5448 O=C([O-])CSCCc1cc(cc(c1)F)F 62a_100011754442_100020667443 [0,2,0,0,0,0|1,0,1]=4 14880 B15R1.5448 O=C([O-])CSCCc1cc(cc(c1)F)F 62a_100020667443_100011754442 [0,2,0,0,0,0|1,0,1]=4 14881 B15R1.8263 CN(CCc1cccc(c1)Br)CC(=O)N 2230a_100000739694_100011740638 [0,2,0,0,0,0|2,0,0]=4 14882 B15R1.8263 CN(CCc1cccc(c1)Br)CC(=O)O 269956a_100000746989_100011740638 [0,2,0,0,0,0|1,0,0]=3 14883 B15R1.8263 CN(CCc1cccc(c1)Cl)CC(=O)N 2230a_100000739694_100011713710 [0,2,0,0,0,0|2,0,0]=4 14884 B15R1.8263 CN(CCc1cccc(c1)Cl)CC(=O)N 2230a_106726388433_100000747473 [0,2,0,0,0,0|2,0,0]=4 14885 B15R1.8263 CN(CCc1cccc(c1)Cl)CC(=O)N 269982a_106726388433_100000187820 [0,2,0,0,0,0|2,0,0]=4 14886 B15R1.8263 CN(CCc1cccc(c1)Cl)CC(=O)N 34a_106726388433_100000187820 [0,2,0,0,0,0|2,0,0]=4 14887 B15R1.8263 CN(CCc1cccc(c1)Cl)CC(=O)O 269956a_100000746989_100011713710 [0,2,0,0,0,0|1,0,0]=3 14888 B15R1.8263 CN(CCc1cccc(c1)Cl)CC(=O)[O-] 269982a_106726388433_100020667443 [0,2,0,0,0,0|1,0,1]=4 14889 B15R1.8263 CN(CCc1cccc(c1)Cl)CC(=O)[O-] 34a_106726388433_100020667443 [0,2,0,0,0,0|1,0,1]=4 14890 B15R1.8263 CN(CCc1cccc(c1)F)CC(=O)N 2230a_100000739694_100011217235 [0,2,0,0,0,0|2,0,0]=4 14891 B15R1.8263 CN(CCc1cccc(c1)F)CC(=O)N 2230a_106726388868_100000747473 [0,2,0,0,0,0|2,0,0]=4 14892 B15R1.8263 CN(CCc1cccc(c1)F)CC(=O)N 269982a_106726388868_100000187820 [0,2,0,0,0,0|2,0,0]=4 14893 B15R1.8263 CN(CCc1cccc(c1)F)CC(=O)N 34a_106726388868_100000187820 [0,2,0,0,0,0|2,0,0]=4 14894 B15R1.8263 CN(CCc1cccc(c1)F)CC(=O)O 269956a_100000746989_100011217235 [0,2,0,0,0,0|1,0,0]=3 14895 B15R1.8263 CN(CCc1cccc(c1)F)CC(=O)[O-] 269982a_106726388868_100020667443 [0,2,0,0,0,0|1,0,1]=4 14896 B15R1.8263 CN(CCc1cccc(c1)F)CC(=O)[O-] 34a_106726388868_100020667443 [0,2,0,0,0,0|1,0,1]=4 14897 B15R1.8263 Cc1cccc(c1)CCC(=O)CC(=O)N 1458a_100000234952_100000187820 [0,2,0,0,0,0|1,0,1]=4 14898 B15R1.8263 Cc1cccc(c1)CCC(=O)CC(=O)N 1458a_100134613110_100011713685 [0,2,0,0,0,0|1,0,1]=4 14899 B15R1.8263 Cc1cccc(c1)CCC(=O)CC(=O)[O-] 1458a_100000234952_100020667443 [0,2,0,0,0,0|0,0,2]=4 14900 B15R1.8263 Cc1cccc(c1)CCN(C)CC(=O)N 2230a_100000739694_100011713685 [0,2,0,0,0,0|2,0,0]=4 14901 B15R1.8263 Cc1cccc(c1)CCN(C)CC(=O)N 2230a_114849113767_100000747473 [0,2,0,0,0,0|2,0,0]=4 14902 B15R1.8263 Cc1cccc(c1)CCN(C)CC(=O)N 269982a_114849113767_100000187820 [0,2,0,0,0,0|2,0,0]=4 14903 B15R1.8263 Cc1cccc(c1)CCN(C)CC(=O)N 34a_114849113767_100000187820 [0,2,0,0,0,0|2,0,0]=4 14904 B15R1.8263 Cc1cccc(c1)CCN(C)CC(=O)O 269956a_100000746989_100011713685 [0,2,0,0,0,0|1,0,0]=3 14905 B15R1.8263 Cc1cccc(c1)CCN(C)CC(=O)[O-] 269982a_114849113767_100020667443 [0,2,0,0,0,0|1,0,1]=4 14906 B15R1.8263 Cc1cccc(c1)CCN(C)CC(=O)[O-] 34a_114849113767_100020667443 [0,2,0,0,0,0|1,0,1]=4 14907 B15R1.8263 NC(=O)CC(=O)CCc1cccc(c1)Br 1458a_100000184314_100000187820 [0,2,0,0,0,0|1,0,1]=4 14908 B15R1.8263 NC(=O)CC(=O)CCc1cccc(c1)Br 1458a_100134613110_100011740638 [0,2,0,0,0,0|1,0,1]=4 14909 B15R1.8263 NC(=O)CC(=O)CCc1cccc(c1)Cl 1458a_100000235675_100000187820 [0,2,0,0,0,0|1,0,1]=4 14910 B15R1.8263 NC(=O)CC(=O)CCc1cccc(c1)Cl 1458a_100134613110_100011713710 [0,2,0,0,0,0|1,0,1]=4 14911 B15R1.8263 NC(=O)CC(=O)CCc1cccc(c1)F 1458a_100000235673_100000187820 [0,2,0,0,0,0|1,0,1]=4 14912 B15R1.8263 NC(=O)CC(=O)CCc1cccc(c1)F 1458a_100134613110_100011217235 [0,2,0,0,0,0|1,0,1]=4 14913 B15R1.8263 NC(=O)CC(=O)CCc1cccc(c1)I 1458a_100010007846_100000187820 [0,2,0,0,0,0|1,0,1]=4 14914 B15R1.8263 NC(=O)CC(=O)CCc1cccc(c1)O 1458a_100011216126_100000187820 [0,2,0,0,0,0|1,0,1]=4 14915 B15R1.8263 O=C([O-])CC(=O)CCc1cccc(c1)Br 1458a_100000184314_100020667443 [0,2,0,0,0,0|0,0,2]=4 14916 B15R1.8263 O=C([O-])CC(=O)CCc1cccc(c1)Cl 1458a_100000235675_100020667443 [0,2,0,0,0,0|0,0,2]=4 14917 B15R1.8263 O=C([O-])CC(=O)CCc1cccc(c1)F 1458a_100000235673_100020667443 [0,2,0,0,0,0|0,0,2]=4 14918 B15R1.8263 O=C([O-])CC(=O)CCc1cccc(c1)I 1458a_100010007846_100020667443 [0,2,0,0,0,0|0,0,2]=4 14919 B15R1.8263 O=C([O-])CC(=O)CCc1cccc(c1)O 1458a_100011216126_100020667443 [0,2,0,0,0,0|0,0,2]=4 14920 B15R1.8273 CC(=O)CCCC(=O)c1cccc(c1)Br 1458a_100000210664_100011215641 [0,2,0,0,0,0|1,0,1]=4 14921 B15R1.8273 CC(=O)CCCC(=O)c1cccc(c1)C 1458a_100000189346_100011215641 [0,2,0,0,0,0|1,0,1]=4 14922 B15R1.8273 CC(=O)CCCC(=O)c1cccc(c1)Cl 1458a_100000210390_100011215641 [0,2,0,0,0,0|1,0,1]=4 14923 B15R1.8273 CC(=O)CCCC(=O)c1cccc(c1)F 1458a_100000210950_100011215641 [0,2,0,0,0,0|1,0,1]=4 14924 B15R1.8273 CC(=O)CCCC(=O)c1cccc(c1)I 1458a_100000184098_100011215641 [0,2,0,0,0,0|1,0,1]=4 14925 B15R1.8273 CC(=O)CCCC(=O)c1cccc(c1)O 1458a_100000183914_100011215641 [0,2,0,0,0,0|1,0,1]=4 14926 B15R1.8273 CC(=O)CCCN(C)c1cccc(c1)Br 269982a_100000219648_100011215641 [0,2,0,0,0,0|2,0,0]=4 14927 B15R1.8273 CC(=O)CCCN(C)c1cccc(c1)Br 34a_100000219648_100000685027 [0,2,0,0,0,0|2,0,0]=4 14928 B15R1.8273 CC(=O)CCCN(C)c1cccc(c1)C 269982a_100000219674_100011215641 [0,2,0,0,0,0|2,0,0]=4 14929 B15R1.8273 CC(=O)CCCN(C)c1cccc(c1)C 34a_100000219674_100000685027 [0,2,0,0,0,0|2,0,0]=4 14930 B15R1.8273 CC(=O)CCCN(C)c1cccc(c1)Cl 269982a_100000220044_100011215641 [0,2,0,0,0,0|2,0,0]=4 14931 B15R1.8273 CC(=O)CCCN(C)c1cccc(c1)Cl 34a_100000220044_100000685027 [0,2,0,0,0,0|2,0,0]=4 14932 B15R1.8273 CC(=O)CCCN(C)c1cccc(c1)F 269982a_100020633736_100011215641 [0,2,0,0,0,0|2,0,0]=4 14933 B15R1.8273 CC(=O)CCCN(C)c1cccc(c1)F 34a_100020633736_100000685027 [0,2,0,0,0,0|2,0,0]=4 14934 B15R1.8273 CC(=O)CCCN(C)c1cccc(c1)I 269982a_100000221217_100011215641 [0,2,0,0,0,0|2,0,0]=4 14935 B15R1.8273 CC(=O)CCCN(C)c1cccc(c1)I 34a_100000221217_100000685027 [0,2,0,0,0,0|2,0,0]=4 14936 B15R1.8273 CC(=O)CCCN(C)c1cccc(c1)O 269982a_100000756613_100011215641 [0,2,0,0,0,0|2,0,0]=4 14937 B15R1.8273 CC(=O)CCCN(C)c1cccc(c1)O 34a_100000756613_100000685027 [0,2,0,0,0,0|2,0,0]=4 14938 B15R1.8273 CC(=O)CCOC(C)c1cccc(c1)Br 7a_100000246457_100000053229 [0,2,0,0,0,0|2,0,0]=4 14939 B15R1.8273 CC(=O)CCOC(C)c1cccc(c1)C 7a_100000757818_100000053229 [0,2,0,0,0,0|2,0,0]=4 14940 B15R1.8273 CC(=O)CCOC(C)c1cccc(c1)F 7a_100000744526_100000053229 [0,2,0,0,0,0|2,0,0]=4 14941 B15R1.8273 CC(=O)CCOC(C)c1cccc(c1)I 7a_100013085317_100000053229 [0,2,0,0,0,0|2,0,0]=4 14942 B15R1.8273 CC(=O)CCOC(C)c1cccc(c1)N 7a_100011217120_100000053229 [0,2,0,0,0,0|2,0,0]=4 14943 B15R1.8273 CC(=O)CCO[C@H](C)c1cccc(c1)Cl 7a_100000747380_100000053229 [0,2,0,0,0,0|2,0,0]=4 14944 B15R1.8273 CC(NCCC(=O)N)c1cccc(c1)Br 2230a_100020642005_100000744528 [0,2,0,0,0,0|2,0,0]=4 14945 B15R1.8273 CC(NCCC(=O)N)c1cccc(c1)Br 269862a_100000740010_100000210093 [0,2,0,0,0,0|2,0,0]=4 14946 B15R1.8273 CC(NCCC(=O)N)c1cccc(c1)Cl 2230a_100102723534_100000744528 [0,2,0,0,0,0|2,0,0]=4 14947 B15R1.8273 CC(NCCC(=O)N)c1cccc(c1)Cl 269862a_100000740010_200000210964 [0,2,0,0,0,0|2,0,0]=4 14948 B15R1.8273 CC(NCCC(=O)N)c1cccc(c1)Cl 34a_100102723534_100000731001 [0,2,0,0,0,0|2,0,0]=4 14949 B15R1.8273 CC(NCCC(=O)N)c1cccc(c1)F 269862a_100000740010_100000187083 [0,2,0,0,0,0|2,0,0]=4 14950 B15R1.8273 CC(NCCC(=O)N)c1cccc(c1)I 269862a_100000740010_100011356966 [0,2,0,0,0,0|2,0,0]=4 14951 B15R1.8273 CC(NCCC(=O)N)c1cccc(c1)O 2230a_100000740644_100000744528 [0,2,0,0,0,0|2,0,0]=4 14952 B15R1.8273 CC(NCCC(=O)N)c1cccc(c1)O 269862a_100000740010_100000211620 [0,2,0,0,0,0|2,0,0]=4 14953 B15R1.8273 CC(OCCC(=O)N)c1cccc(c1)Br 34a_100000246457_100000731001 [0,2,0,0,0,0|2,0,0]=4 14954 B15R1.8273 CC(OCCC(=O)N)c1cccc(c1)Br 7a_100000246457_100000744528 [0,2,0,0,0,0|2,0,0]=4 14955 B15R1.8273 CC(OCCC(=O)N)c1cccc(c1)F 34a_100000744526_100000731001 [0,2,0,0,0,0|2,0,0]=4 14956 B15R1.8273 CC(OCCC(=O)N)c1cccc(c1)F 7a_100000744526_100000744528 [0,2,0,0,0,0|2,0,0]=4 14957 B15R1.8273 CC(OCCC(=O)N)c1cccc(c1)I 34a_100013085317_100000731001 [0,2,0,0,0,0|2,0,0]=4 14958 B15R1.8273 CC(OCCC(=O)N)c1cccc(c1)I 7a_100013085317_100000744528 [0,2,0,0,0,0|2,0,0]=4 14959 B15R1.8273 CC(OCCC(=O)N)c1cccc(c1)N 34a_100011217120_100000731001 [0,2,0,0,0,0|2,0,0]=4 14960 B15R1.8273 CC(OCCC(=O)N)c1cccc(c1)N 7a_100011217120_100000744528 [0,2,0,0,0,0|2,0,0]=4 14961 B15R1.8273 CN(CCCC(=O)N)c1cccc(c1)Br 269982a_100000219648_100102525003 [0,2,0,0,0,0|2,0,0]=4 14962 B15R1.8273 CN(CCCC(=O)N)c1cccc(c1)Br 34a_100000219648_100102525003 [0,2,0,0,0,0|2,0,0]=4 14963 B15R1.8273 CN(CCCC(=O)N)c1cccc(c1)Cl 269982a_100000220044_100102525003 [0,2,0,0,0,0|2,0,0]=4 14964 B15R1.8273 CN(CCCC(=O)N)c1cccc(c1)Cl 34a_100000220044_100102525003 [0,2,0,0,0,0|2,0,0]=4 14965 B15R1.8273 CN(CCCC(=O)N)c1cccc(c1)F 269982a_100020633736_100102525003 [0,2,0,0,0,0|2,0,0]=4 14966 B15R1.8273 CN(CCCC(=O)N)c1cccc(c1)F 34a_100020633736_100102525003 [0,2,0,0,0,0|2,0,0]=4 14967 B15R1.8273 CN(CCCC(=O)N)c1cccc(c1)I 269982a_100000221217_100102525003 [0,2,0,0,0,0|2,0,0]=4 14968 B15R1.8273 CN(CCCC(=O)N)c1cccc(c1)I 34a_100000221217_100102525003 [0,2,0,0,0,0|2,0,0]=4 14969 B15R1.8273 CN(CCCC(=O)N)c1cccc(c1)O 269982a_100000756613_100102525003 [0,2,0,0,0,0|2,0,0]=4 14970 B15R1.8273 CN(CCCC(=O)N)c1cccc(c1)O 34a_100000756613_100102525003 [0,2,0,0,0,0|2,0,0]=4 14971 B15R1.8273 C[C@@H](NCCC(=O)N)c1cccc(c1)F 2230a_100015193778_100000744528 [0,2,0,0,0,0|2,0,0]=4 14972 B15R1.8273 C[C@@H](NCCC(=O)N)c1cccc(c1)F 34a_100015193778_100000731001 [0,2,0,0,0,0|2,0,0]=4 14973 B15R1.8273 C[C@@H](OCCC(=O)N)c1cccc(c1)Cl 34a_100000747380_100000731001 [0,2,0,0,0,0|2,0,0]=4 14974 B15R1.8273 C[C@@H](OCCC(=O)N)c1cccc(c1)Cl 7a_100000747380_100000744528 [0,2,0,0,0,0|2,0,0]=4 14975 B15R1.8273 Cc1cccc(c1)C(=O)CCCC(=O)N 1458a_100000189346_100102525003 [0,2,0,0,0,0|1,0,1]=4 14976 B15R1.8273 Cc1cccc(c1)C(=O)CNCC(=O)O 269956a_100016091260_100000739480 [0,2,0,0,0,0|1,0,1]=4 14977 B15R1.8273 Cc1cccc(c1)C(C)NCCC(=O)N 269862a_100000740010_100000211476 [0,2,0,0,0,0|2,0,0]=4 14978 B15R1.8273 Cc1cccc(c1)C(C)OCCC(=O)N 34a_100000757818_100000731001 [0,2,0,0,0,0|2,0,0]=4 14979 B15R1.8273 Cc1cccc(c1)C(C)OCCC(=O)N 7a_100000757818_100000744528 [0,2,0,0,0,0|2,0,0]=4 14980 B15R1.8273 Cc1cccc(c1)N(C)CCCC(=O)N 269982a_100000219674_100102525003 [0,2,0,0,0,0|2,0,0]=4 14981 B15R1.8273 Cc1cccc(c1)N(C)CCCC(=O)N 34a_100000219674_100102525003 [0,2,0,0,0,0|2,0,0]=4 14982 B15R1.8273 Cc1cccc(c1)[C@@H](C)NCCC(=O)N 2230a_100000698126_100000744528 [0,2,0,0,0,0|2,0,0]=4 14983 B15R1.8273 Cc1cccc(c1)[C@@H](C)NCCC(=O)N 34a_100000698126_100000731001 [0,2,0,0,0,0|2,0,0]=4 14984 B15R1.8273 Cc1cccc(c1)[C@H](N)COCC(=O)N 34a_100009818812_100000187820 [0,2,0,0,0,0|2,0,0]=4 14985 B15R1.8273 Cc1cccc(c1)[C@H](N)COCC(=O)[O-] 34a_100009818812_100020667443 [0,2,0,0,0,0|1,0,1]=4 14986 B15R1.8273 NC(=O)CCCC(=O)c1cccc(c1)Br 1458a_100000210664_100102525003 [0,2,0,0,0,0|1,0,1]=4 14987 B15R1.8273 NC(=O)CCCC(=O)c1cccc(c1)Cl 1458a_100000210390_100102525003 [0,2,0,0,0,0|1,0,1]=4 14988 B15R1.8273 NC(=O)CCCC(=O)c1cccc(c1)F 1458a_100000210950_100102525003 [0,2,0,0,0,0|1,0,1]=4 14989 B15R1.8273 NC(=O)CCCC(=O)c1cccc(c1)I 1458a_100000184098_100102525003 [0,2,0,0,0,0|1,0,1]=4 14990 B15R1.8273 NC(=O)CCCC(=O)c1cccc(c1)O 1458a_100000183914_100102525003 [0,2,0,0,0,0|1,0,1]=4 14991 B15R1.8273 NC(=O)CNCC(O)c1cccc(c1)O 2230a_100020657549_100000747473 [0,2,0,0,0,0|2,0,0]=4 14992 B15R1.8273 NC(=O)CNCC(O)c1cccc(c1)O 34a_100020657549_100000187820 [0,2,0,0,0,0|2,0,0]=4 14993 B15R1.8273 NC(=O)COCC(N)c1cccc(c1)Br 34a_100000690078_100000187820 [0,2,0,0,0,0|2,0,0]=4 14994 B15R1.8273 NC(=O)COC[C@@H](N)c1cccc(c1)F 34a_100020641251_100000187820 [0,2,0,0,0,0|2,0,0]=4 14995 B15R1.8273 NC(=O)COC[C@H](N)c1cccc(c1)Cl 34a_100032004910_100000187820 [0,2,0,0,0,0|2,0,0]=4 14996 B15R1.8273 NC(COCC(=O)[O-])c1cccc(c1)Br 34a_100000690078_100020667443 [0,2,0,0,0,0|1,0,1]=4 14997 B15R1.8273 N[C@@H](COCC(=O)[O-])c1cccc(c1)Cl 34a_100032004910_100020667443 [0,2,0,0,0,0|1,0,1]=4 14998 B15R1.8273 N[C@H](COCC(=O)[O-])c1cccc(c1)F 34a_100020641251_100020667443 [0,2,0,0,0,0|1,0,1]=4 14999 B15R1.8273 O=C(O)CNCC(=O)c1cccc(c1)Br 269956a_100016091260_100000212080 [0,2,0,0,0,0|1,0,1]=4 15000 B15R1.8273 O=C(O)CNCC(=O)c1cccc(c1)Cl 269956a_100016091260_100000211444 [0,2,0,0,0,0|1,0,1]=4 15001 B15R1.8273 O=C(O)CNCC(=O)c1cccc(c1)F 269956a_100016091260_100000215616 [0,2,0,0,0,0|1,0,1]=4 15002 B15R1.8273 O=C(O)CNCC(=O)c1cccc(c1)O 269956a_100016091260_100009813753 [0,2,0,0,0,0|1,0,1]=4 15003 B15R1.8273 O=C([O-])CNCC(O)c1cccc(c1)O 34a_100020657549_100020667443 [0,2,0,0,0,0|1,0,1]=4 15004 B15R1.8448 CC(=O)CCCNc1cc(ccc1Br)Br 34a_100000737762_100000685027 [0,2,0,0,0,0|2,0,0]=4 15005 B15R1.8448 CC(=O)CCCNc1cc(ccc1Br)C 34a_100000745044_100000685027 [0,2,0,0,0,0|2,0,0]=4 15006 B15R1.8448 CC(=O)CCCNc1cc(ccc1Br)Cl 34a_100000687073_100000685027 [0,2,0,0,0,0|2,0,0]=4 15007 B15R1.8448 CC(=O)CCCNc1cc(ccc1Br)F 34a_100000687223_100000685027 [0,2,0,0,0,0|2,0,0]=4 15008 B15R1.8448 CC(=O)CCCNc1cc(ccc1Br)O 34a_100011999798_100000685027 [0,2,0,0,0,0|2,0,0]=4 15009 B15R1.8448 CC(=O)CCCNc1cc(ccc1C)Br 34a_100000741167_100000685027 [0,2,0,0,0,0|2,0,0]=4 15010 B15R1.8448 CC(=O)CCCNc1cc(ccc1C)Br 7a_100000741167_100011215641 [0,2,0,0,0,0|2,0,0]=4 15011 B15R1.8448 CC(=O)CCCNc1cc(ccc1C)C 34a_100000185781_100000685027 [0,2,0,0,0,0|2,0,0]=4 15012 B15R1.8448 CC(=O)CCCNc1cc(ccc1C)C 7a_100000185781_100011215641 [0,2,0,0,0,0|2,0,0]=4 15013 B15R1.8448 CC(=O)CCCNc1cc(ccc1C)Cl 34a_100000211374_100000685027 [0,2,0,0,0,0|2,0,0]=4 15014 B15R1.8448 CC(=O)CCCNc1cc(ccc1C)Cl 7a_100000211374_100011215641 [0,2,0,0,0,0|2,0,0]=4 15015 B15R1.8448 CC(=O)CCCNc1cc(ccc1C)F 34a_100000211107_100000685027 [0,2,0,0,0,0|2,0,0]=4 15016 B15R1.8448 CC(=O)CCCNc1cc(ccc1C)F 7a_100000211107_100011215641 [0,2,0,0,0,0|2,0,0]=4 15017 B15R1.8448 CC(=O)CCCNc1cc(ccc1C)I 7a_100000761890_100011215641 [0,2,0,0,0,0|2,0,0]=4 15018 B15R1.8448 CC(=O)CCCNc1cc(ccc1C)O 34a_100011216113_100000685027 [0,2,0,0,0,0|2,0,0]=4 15019 B15R1.8448 CC(=O)CCCNc1cc(ccc1Cl)Br 34a_100000750497_100000685027 [0,2,0,0,0,0|2,0,0]=4 15020 B15R1.8448 CC(=O)CCCNc1cc(ccc1Cl)C 34a_100011215360_100000685027 [0,2,0,0,0,0|2,0,0]=4 15021 B15R1.8448 CC(=O)CCCNc1cc(ccc1Cl)Cl 34a_100000184485_100000685027 [0,2,0,0,0,0|2,0,0]=4 15022 B15R1.8448 CC(=O)CCCNc1cc(ccc1Cl)F 34a_100000751338_100000685027 [0,2,0,0,0,0|2,0,0]=4 15023 B15R1.8448 CC(=O)CCCNc1cc(ccc1Cl)I 34a_200000761891_100000685027 [0,2,0,0,0,0|2,0,0]=4 15024 B15R1.8448 CC(=O)CCCNc1cc(ccc1Cl)O 34a_100011934297_100000685027 [0,2,0,0,0,0|2,0,0]=4 15025 B15R1.8448 CC(=O)CCCNc1cc(ccc1F)Br 34a_100000740924_100000685027 [0,2,0,0,0,0|2,0,0]=4 15026 B15R1.8448 CC(=O)CCCNc1cc(ccc1F)C 34a_100000211285_100000685027 [0,2,0,0,0,0|2,0,0]=4 15027 B15R1.8448 CC(=O)CCCNc1cc(ccc1F)Cl 34a_100000212115_100000685027 [0,2,0,0,0,0|2,0,0]=4 15028 B15R1.8448 CC(=O)CCCNc1cc(ccc1F)F 34a_100000210742_100000685027 [0,2,0,0,0,0|2,0,0]=4 15029 B15R1.8448 CC(=O)CCCNc1cc(ccc1F)I 34a_100011464823_100000685027 [0,2,0,0,0,0|2,0,0]=4 15030 B15R1.8448 CC(=O)CCCNc1cc(ccc1F)O 34a_100012017239_100000685027 [0,2,0,0,0,0|2,0,0]=4 15031 B15R1.8448 CC(=O)CCCNc1cc(ccc1I)Br 34a_100000743836_100000685027 [0,2,0,0,0,0|2,0,0]=4 15032 B15R1.8448 CC(=O)CCCNc1cc(ccc1I)C 34a_100011216686_100000685027 [0,2,0,0,0,0|2,0,0]=4 15033 B15R1.8448 CC(=O)CCCNc1cc(ccc1I)Cl 34a_100000761886_100000685027 [0,2,0,0,0,0|2,0,0]=4 15034 B15R1.8448 CC(=O)CCCNc1cc(ccc1I)F 34a_100011218093_100000685027 [0,2,0,0,0,0|2,0,0]=4 15035 B15R1.8448 CC(=O)CCCNc1cc(ccc1O)Br 34a_100000752626_100000685027 [0,2,0,0,0,0|2,0,0]=4 15036 B15R1.8448 CC(=O)CCCNc1cc(ccc1O)C 34a_100011215204_100000685027 [0,2,0,0,0,0|2,0,0]=4 15037 B15R1.8448 CC(=O)CCCNc1cc(ccc1O)Cl 34a_100000210500_100000685027 [0,2,0,0,0,0|2,0,0]=4 15038 B15R1.8448 CC(=O)CCCNc1cc(ccc1O)F 34a_100000759472_100000685027 [0,2,0,0,0,0|2,0,0]=4 15039 B15R1.8448 CC(=O)CCCOc1cc(ccc1Br)Br 34a_100011220040_100000685027 [0,2,0,0,0,0|2,0,0]=4 15040 B15R1.8448 CC(=O)CCCOc1cc(ccc1Br)Br 7a_100011220040_100011215641 [0,2,0,0,0,0|2,0,0]=4 15041 B15R1.8448 CC(=O)CCCOc1cc(ccc1Br)C 34a_100012002257_100000685027 [0,2,0,0,0,0|2,0,0]=4 15042 B15R1.8448 CC(=O)CCCOc1cc(ccc1Br)C 7a_100012002257_100011215641 [0,2,0,0,0,0|2,0,0]=4 15043 B15R1.8448 CC(=O)CCCOc1cc(ccc1Br)Cl 34a_100012339455_100000685027 [0,2,0,0,0,0|2,0,0]=4 15044 B15R1.8448 CC(=O)CCCOc1cc(ccc1Br)Cl 7a_100012339455_100011215641 [0,2,0,0,0,0|2,0,0]=4 15045 B15R1.8448 CC(=O)CCCOc1cc(ccc1Br)F 34a_100000690578_100000685027 [0,2,0,0,0,0|2,0,0]=4 15046 B15R1.8448 CC(=O)CCCOc1cc(ccc1Br)F 7a_100000690578_100011215641 [0,2,0,0,0,0|2,0,0]=4 15047 B15R1.8448 CC(=O)CCCOc1cc(ccc1Br)I 34a_100012356990_100000685027 [0,2,0,0,0,0|2,0,0]=4 15048 B15R1.8448 CC(=O)CCCOc1cc(ccc1Br)I 7a_100012356990_100011215641 [0,2,0,0,0,0|2,0,0]=4 15049 B15R1.8448 CC(=O)CCCOc1cc(ccc1C)Br 34a_100000685420_100000685027 [0,2,0,0,0,0|2,0,0]=4 15050 B15R1.8448 CC(=O)CCCOc1cc(ccc1C)Br 7a_100000685420_100011215641 [0,2,0,0,0,0|2,0,0]=4 15051 B15R1.8448 CC(=O)CCCOc1cc(ccc1C)C 34a_100000210931_100000685027 [0,2,0,0,0,0|2,0,0]=4 15052 B15R1.8448 CC(=O)CCCOc1cc(ccc1C)C 7a_100000210931_100011215641 [0,2,0,0,0,0|2,0,0]=4 15053 B15R1.8448 CC(=O)CCCOc1cc(ccc1C)Cl 34a_100000756515_100000685027 [0,2,0,0,0,0|2,0,0]=4 15054 B15R1.8448 CC(=O)CCCOc1cc(ccc1C)Cl 7a_100000756515_100011215641 [0,2,0,0,0,0|2,0,0]=4 15055 B15R1.8448 CC(=O)CCCOc1cc(ccc1C)F 34a_100000690566_100000685027 [0,2,0,0,0,0|2,0,0]=4 15056 B15R1.8448 CC(=O)CCCOc1cc(ccc1C)F 7a_100000690566_100011215641 [0,2,0,0,0,0|2,0,0]=4 15057 B15R1.8448 CC(=O)CCCOc1cc(ccc1C)I 7a_100000766334_100011215641 [0,2,0,0,0,0|2,0,0]=4 15058 B15R1.8448 CC(=O)CCCOc1cc(ccc1C)N 34a_100000759471_100000685027 [0,2,0,0,0,0|2,0,0]=4 15059 B15R1.8448 CC(=O)CCCOc1cc(ccc1C)N 7a_100000759471_100011215641 [0,2,0,0,0,0|2,0,0]=4 15060 B15R1.8448 CC(=O)CCCOc1cc(ccc1Cl)Br 34a_100000738945_100000685027 [0,2,0,0,0,0|2,0,0]=4 15061 B15R1.8448 CC(=O)CCCOc1cc(ccc1Cl)Br 7a_100000738945_100011215641 [0,2,0,0,0,0|2,0,0]=4 15062 B15R1.8448 CC(=O)CCCOc1cc(ccc1Cl)C 34a_100000211493_100000685027 [0,2,0,0,0,0|2,0,0]=4 15063 B15R1.8448 CC(=O)CCCOc1cc(ccc1Cl)C 7a_100000211493_100011215641 [0,2,0,0,0,0|2,0,0]=4 15064 B15R1.8448 CC(=O)CCCOc1cc(ccc1Cl)Cl 34a_100000211422_100000685027 [0,2,0,0,0,0|2,0,0]=4 15065 B15R1.8448 CC(=O)CCCOc1cc(ccc1Cl)Cl 7a_100000211422_100011215641 [0,2,0,0,0,0|2,0,0]=4 15066 B15R1.8448 CC(=O)CCCOc1cc(ccc1Cl)F 34a_100000692107_100000685027 [0,2,0,0,0,0|2,0,0]=4 15067 B15R1.8448 CC(=O)CCCOc1cc(ccc1Cl)F 7a_100000692107_100011215641 [0,2,0,0,0,0|2,0,0]=4 15068 B15R1.8448 CC(=O)CCCOc1cc(ccc1Cl)I 34a_100011356854_100000685027 [0,2,0,0,0,0|2,0,0]=4 15069 B15R1.8448 CC(=O)CCCOc1cc(ccc1Cl)I 7a_100011356854_100011215641 [0,2,0,0,0,0|2,0,0]=4 15070 B15R1.8448 CC(=O)CCCOc1cc(ccc1Cl)N 34a_100011934209_100000685027 [0,2,0,0,0,0|2,0,0]=4 15071 B15R1.8448 CC(=O)CCCOc1cc(ccc1F)Br 34a_100000686035_100000685027 [0,2,0,0,0,0|2,0,0]=4 15072 B15R1.8448 CC(=O)CCCOc1cc(ccc1F)Br 7a_100000686035_100011215641 [0,2,0,0,0,0|2,0,0]=4 15073 B15R1.8448 CC(=O)CCCOc1cc(ccc1F)C 34a_100000759540_100000685027 [0,2,0,0,0,0|2,0,0]=4 15074 B15R1.8448 CC(=O)CCCOc1cc(ccc1F)C 7a_100000759540_100011215641 [0,2,0,0,0,0|2,0,0]=4 15075 B15R1.8448 CC(=O)CCCOc1cc(ccc1F)Cl 34a_100000757397_100000685027 [0,2,0,0,0,0|2,0,0]=4 15076 B15R1.8448 CC(=O)CCCOc1cc(ccc1F)Cl 7a_100000757397_100011215641 [0,2,0,0,0,0|2,0,0]=4 15077 B15R1.8448 CC(=O)CCCOc1cc(ccc1F)F 34a_100000752141_100000685027 [0,2,0,0,0,0|2,0,0]=4 15078 B15R1.8448 CC(=O)CCCOc1cc(ccc1F)F 7a_100000752141_100011215641 [0,2,0,0,0,0|2,0,0]=4 15079 B15R1.8448 CC(=O)CCCOc1cc(ccc1F)I 34a_100009958187_100000685027 [0,2,0,0,0,0|2,0,0]=4 15080 B15R1.8448 CC(=O)CCCOc1cc(ccc1F)I 7a_100009958187_100011215641 [0,2,0,0,0,0|2,0,0]=4 15081 B15R1.8448 CC(=O)CCCOc1cc(ccc1F)N 34a_100012017398_100000685027 [0,2,0,0,0,0|2,0,0]=4 15082 B15R1.8448 CC(=O)CCCOc1cc(ccc1F)N 7a_100012017398_100011215641 [0,2,0,0,0,0|2,0,0]=4 15083 B15R1.8448 CC(=O)CCCOc1cc(ccc1I)Br 34a_100012344904_100000685027 [0,2,0,0,0,0|2,0,0]=4 15084 B15R1.8448 CC(=O)CCCOc1cc(ccc1I)Br 7a_100012344904_100011215641 [0,2,0,0,0,0|2,0,0]=4 15085 B15R1.8448 CC(=O)CCCOc1cc(ccc1I)Cl 34a_100000050036_100000685027 [0,2,0,0,0,0|2,0,0]=4 15086 B15R1.8448 CC(=O)CCCOc1cc(ccc1I)Cl 7a_100000050036_100011215641 [0,2,0,0,0,0|2,0,0]=4 15087 B15R1.8448 CC(=O)CCCOc1cc(ccc1I)F 34a_100010084537_100000685027 [0,2,0,0,0,0|2,0,0]=4 15088 B15R1.8448 CC(=O)CCCOc1cc(ccc1I)F 7a_100010084537_100011215641 [0,2,0,0,0,0|2,0,0]=4 15089 B15R1.8448 CC(=O)CCCOc1cc(ccc1N)Br 34a_100000739049_100000685027 [0,2,0,0,0,0|2,0,0]=4 15090 B15R1.8448 CC(=O)CCCOc1cc(ccc1N)Br 7a_100000739049_100011215641 [0,2,0,0,0,0|2,0,0]=4 15091 B15R1.8448 CC(=O)CCCOc1cc(ccc1N)C 34a_100000211527_100000685027 [0,2,0,0,0,0|2,0,0]=4 15092 B15R1.8448 CC(=O)CCCOc1cc(ccc1N)C 7a_100000211527_100011215641 [0,2,0,0,0,0|2,0,0]=4 15093 B15R1.8448 CC(=O)CCCOc1cc(ccc1N)Cl 34a_100000185728_100000685027 [0,2,0,0,0,0|2,0,0]=4 15094 B15R1.8448 CC(=O)CCCOc1cc(ccc1N)Cl 7a_100000185728_100011215641 [0,2,0,0,0,0|2,0,0]=4 15095 B15R1.8448 CC(=O)CCCOc1cc(ccc1N)F 34a_100000753323_100000685027 [0,2,0,0,0,0|2,0,0]=4 15096 B15R1.8448 CC(=O)CCCOc1cc(ccc1N)F 7a_100000753323_100011215641 [0,2,0,0,0,0|2,0,0]=4 15097 B15R1.8448 CC(=O)CCCOc1cc(ccc1N)I 34a_100000057187_100000685027 [0,2,0,0,0,0|2,0,0]=4 15098 B15R1.8448 CC(=O)CCCOc1cc(ccc1N)I 7a_100000057187_100011215641 [0,2,0,0,0,0|2,0,0]=4 15099 B15R1.8448 CC(=O)CCCOc1cc(ccc1N)N 34a_100025717382_100000685027 [0,2,0,0,0,0|2,0,0]=4 15100 B15R1.8448 CC(=O)CCCSc1cc(ccc1Br)Br 62a_100011215641_100011483371 [0,2,0,0,0,0|2,0,0]=4 15101 B15R1.8448 CC(=O)CCCSc1cc(ccc1Br)Br 62a_100011483371_100011215641 [0,2,0,0,0,0|2,0,0]=4 15102 B15R1.8448 CC(=O)CCCSc1cc(ccc1Br)C 62a_100011215641_100012353751 [0,2,0,0,0,0|2,0,0]=4 15103 B15R1.8448 CC(=O)CCCSc1cc(ccc1Br)C 62a_100012353751_100011215641 [0,2,0,0,0,0|2,0,0]=4 15104 B15R1.8448 CC(=O)CCCSc1cc(ccc1Br)Cl 62a_100011215641_100012339723 [0,2,0,0,0,0|2,0,0]=4 15105 B15R1.8448 CC(=O)CCCSc1cc(ccc1Br)Cl 62a_100012339723_100011215641 [0,2,0,0,0,0|2,0,0]=4 15106 B15R1.8448 CC(=O)CCCSc1cc(ccc1Br)F 62a_100011215641_100011217576 [0,2,0,0,0,0|2,0,0]=4 15107 B15R1.8448 CC(=O)CCCSc1cc(ccc1Br)F 62a_100011217576_100011215641 [0,2,0,0,0,0|2,0,0]=4 15108 B15R1.8448 CC(=O)CCCSc1cc(ccc1Br)N 62a_100000750459_100011215641 [0,2,0,0,0,0|2,0,0]=4 15109 B15R1.8448 CC(=O)CCCSc1cc(ccc1Br)N 62a_100011215641_100000750459 [0,2,0,0,0,0|2,0,0]=4 15110 B15R1.8448 CC(=O)CCCSc1cc(ccc1Br)O 62a_100011215641_100012339312 [0,2,0,0,0,0|2,0,0]=4 15111 B15R1.8448 CC(=O)CCCSc1cc(ccc1Br)O 62a_100012339312_100011215641 [0,2,0,0,0,0|2,0,0]=4 15112 B15R1.8448 CC(=O)CCCSc1cc(ccc1C)Br 62a_100011215641_100011344865 [0,2,0,0,0,0|2,0,0]=4 15113 B15R1.8448 CC(=O)CCCSc1cc(ccc1C)Br 62a_100011344865_100011215641 [0,2,0,0,0,0|2,0,0]=4 15114 B15R1.8448 CC(=O)CCCSc1cc(ccc1C)C 62a_100000210833_100011215641 [0,2,0,0,0,0|2,0,0]=4 15115 B15R1.8448 CC(=O)CCCSc1cc(ccc1C)C 62a_100011215641_100000210833 [0,2,0,0,0,0|2,0,0]=4 15116 B15R1.8448 CC(=O)CCCSc1cc(ccc1C)Cl 62a_100011215641_100011263213 [0,2,0,0,0,0|2,0,0]=4 15117 B15R1.8448 CC(=O)CCCSc1cc(ccc1C)Cl 62a_100011263213_100011215641 [0,2,0,0,0,0|2,0,0]=4 15118 B15R1.8448 CC(=O)CCCSc1cc(ccc1C)F 62a_100011215641_100011218078 [0,2,0,0,0,0|2,0,0]=4 15119 B15R1.8448 CC(=O)CCCSc1cc(ccc1C)F 62a_100011218078_100011215641 [0,2,0,0,0,0|2,0,0]=4 15120 B15R1.8448 CC(=O)CCCSc1cc(ccc1C)N 62a_100000736455_100011215641 [0,2,0,0,0,0|2,0,0]=4 15121 B15R1.8448 CC(=O)CCCSc1cc(ccc1C)N 62a_100011215641_100000736455 [0,2,0,0,0,0|2,0,0]=4 15122 B15R1.8448 CC(=O)CCCSc1cc(ccc1C)O 62a_100011215641_100011380479 [0,2,0,0,0,0|2,0,0]=4 15123 B15R1.8448 CC(=O)CCCSc1cc(ccc1C)O 62a_100011380479_100011215641 [0,2,0,0,0,0|2,0,0]=4 15124 B15R1.8448 CC(=O)CCCSc1cc(ccc1Cl)Br 62a_100011215641_100011772130 [0,2,0,0,0,0|2,0,0]=4 15125 B15R1.8448 CC(=O)CCCSc1cc(ccc1Cl)Br 62a_100011772130_100011215641 [0,2,0,0,0,0|2,0,0]=4 15126 B15R1.8448 CC(=O)CCCSc1cc(ccc1Cl)C 62a_100011215641_100012356289 [0,2,0,0,0,0|2,0,0]=4 15127 B15R1.8448 CC(=O)CCCSc1cc(ccc1Cl)C 62a_100012356289_100011215641 [0,2,0,0,0,0|2,0,0]=4 15128 B15R1.8448 CC(=O)CCCSc1cc(ccc1Cl)Cl 62a_100000707729_100011215641 [0,2,0,0,0,0|2,0,0]=4 15129 B15R1.8448 CC(=O)CCCSc1cc(ccc1Cl)Cl 62a_100011215641_100000707729 [0,2,0,0,0,0|2,0,0]=4 15130 B15R1.8448 CC(=O)CCCSc1cc(ccc1Cl)F 62a_100011215641_100011217299 [0,2,0,0,0,0|2,0,0]=4 15131 B15R1.8448 CC(=O)CCCSc1cc(ccc1Cl)F 62a_100011217299_100011215641 [0,2,0,0,0,0|2,0,0]=4 15132 B15R1.8448 CC(=O)CCCSc1cc(ccc1Cl)N 62a_100011215641_100012360549 [0,2,0,0,0,0|2,0,0]=4 15133 B15R1.8448 CC(=O)CCCSc1cc(ccc1Cl)N 62a_100012360549_100011215641 [0,2,0,0,0,0|2,0,0]=4 15134 B15R1.8448 CC(=O)CCCSc1cc(ccc1Cl)O 62a_100000049588_100011215641 [0,2,0,0,0,0|2,0,0]=4 15135 B15R1.8448 CC(=O)CCCSc1cc(ccc1Cl)O 62a_100011215641_100000049588 [0,2,0,0,0,0|2,0,0]=4 15136 B15R1.8448 CC(=O)CCCSc1cc(ccc1F)Br 62a_100011215641_100011217312 [0,2,0,0,0,0|2,0,0]=4 15137 B15R1.8448 CC(=O)CCCSc1cc(ccc1F)Br 62a_100011217312_100011215641 [0,2,0,0,0,0|2,0,0]=4 15138 B15R1.8448 CC(=O)CCCSc1cc(ccc1F)C 62a_100000736223_100011215641 [0,2,0,0,0,0|2,0,0]=4 15139 B15R1.8448 CC(=O)CCCSc1cc(ccc1F)C 62a_100011215641_100000736223 [0,2,0,0,0,0|2,0,0]=4 15140 B15R1.8448 CC(=O)CCCSc1cc(ccc1F)Cl 62a_100011215641_100011218116 [0,2,0,0,0,0|2,0,0]=4 15141 B15R1.8448 CC(=O)CCCSc1cc(ccc1F)Cl 62a_100011218116_100011215641 [0,2,0,0,0,0|2,0,0]=4 15142 B15R1.8448 CC(=O)CCCSc1cc(ccc1F)F 62a_100011215641_100011219198 [0,2,0,0,0,0|2,0,0]=4 15143 B15R1.8448 CC(=O)CCCSc1cc(ccc1F)F 62a_100011219198_100011215641 [0,2,0,0,0,0|2,0,0]=4 15144 B15R1.8448 CC(=O)CCCSc1cc(ccc1F)N 62a_100000760356_100011215641 [0,2,0,0,0,0|2,0,0]=4 15145 B15R1.8448 CC(=O)CCCSc1cc(ccc1F)N 62a_100011215641_100000760356 [0,2,0,0,0,0|2,0,0]=4 15146 B15R1.8448 CC(=O)CCCSc1cc(ccc1F)O 62a_100000693481_100011215641 [0,2,0,0,0,0|2,0,0]=4 15147 B15R1.8448 CC(=O)CCCSc1cc(ccc1F)O 62a_100011215641_100000693481 [0,2,0,0,0,0|2,0,0]=4 15148 B15R1.8448 CC(=O)CCCSc1cc(ccc1N)Br 62a_100000187925_100011215641 [0,2,0,0,0,0|2,0,0]=4 15149 B15R1.8448 CC(=O)CCCSc1cc(ccc1N)Br 62a_100011215641_100000187925 [0,2,0,0,0,0|2,0,0]=4 15150 B15R1.8448 CC(=O)CCCSc1cc(ccc1N)C 62a_100011215641_100011356834 [0,2,0,0,0,0|2,0,0]=4 15151 B15R1.8448 CC(=O)CCCSc1cc(ccc1N)C 62a_100011356834_100011215641 [0,2,0,0,0,0|2,0,0]=4 15152 B15R1.8448 CC(=O)CCCSc1cc(ccc1N)Cl 62a_100000761889_100011215641 [0,2,0,0,0,0|2,0,0]=4 15153 B15R1.8448 CC(=O)CCCSc1cc(ccc1N)Cl 62a_100011215641_100000761889 [0,2,0,0,0,0|2,0,0]=4 15154 B15R1.8448 CC(=O)CCCSc1cc(ccc1N)F 62a_100000760547_100011215641 [0,2,0,0,0,0|2,0,0]=4 15155 B15R1.8448 CC(=O)CCCSc1cc(ccc1N)F 62a_100011215641_100000760547 [0,2,0,0,0,0|2,0,0]=4 15156 B15R1.8448 CC(=O)CCCSc1cc(ccc1N)N 62a_100011215641_100011534242 [0,2,0,0,0,0|2,0,0]=4 15157 B15R1.8448 CC(=O)CCCSc1cc(ccc1N)N 62a_100011534242_100011215641 [0,2,0,0,0,0|2,0,0]=4 15158 B15R1.8448 CC(=O)CCCSc1cc(ccc1N)O 62a_100011215641_100012001276 [0,2,0,0,0,0|2,0,0]=4 15159 B15R1.8448 CC(=O)CCCSc1cc(ccc1N)O 62a_100012001276_100011215641 [0,2,0,0,0,0|2,0,0]=4 15160 B15R1.8448 CC(=O)CCCSc1cc(ccc1O)Br 62a_100011215641_100012355227 [0,2,0,0,0,0|2,0,0]=4 15161 B15R1.8448 CC(=O)CCCSc1cc(ccc1O)Br 62a_100012355227_100011215641 [0,2,0,0,0,0|2,0,0]=4 15162 B15R1.8448 CC(=O)CCCSc1cc(ccc1O)C 62a_100000765521_100011215641 [0,2,0,0,0,0|2,0,0]=4 15163 B15R1.8448 CC(=O)CCCSc1cc(ccc1O)C 62a_100011215641_100000765521 [0,2,0,0,0,0|2,0,0]=4 15164 B15R1.8448 CC(=O)CCCSc1cc(ccc1O)Cl 62a_100011215641_100011356953 [0,2,0,0,0,0|2,0,0]=4 15165 B15R1.8448 CC(=O)CCCSc1cc(ccc1O)Cl 62a_100011356953_100011215641 [0,2,0,0,0,0|2,0,0]=4 15166 B15R1.8448 CC(=O)CCCSc1cc(ccc1O)F 62a_100000211999_100011215641 [0,2,0,0,0,0|2,0,0]=4 15167 B15R1.8448 CC(=O)CCCSc1cc(ccc1O)F 62a_100011215641_100000211999 [0,2,0,0,0,0|2,0,0]=4 15168 B15R1.8448 CC(=O)CCCSc1cc(ccc1O)N 62a_100011215641_100011534360 [0,2,0,0,0,0|2,0,0]=4 15169 B15R1.8448 CC(=O)CCCSc1cc(ccc1O)N 62a_100011534360_100011215641 [0,2,0,0,0,0|2,0,0]=4 15170 B15R1.8448 CC(=O)CCCSc1cc(ccc1O)O 62a_100011215641_100009813629 [0,2,0,0,0,0|2,0,0]=4 15171 B15R1.8448 CC(=O)CCOCc1cc(ccc1Br)Br 34a_100000759926_100011982794 [0,2,0,0,0,0|2,0,0]=4 15172 B15R1.8448 CC(=O)CCOCc1cc(ccc1Br)Br 7a_100000759926_100011982794 [0,2,0,0,0,0|2,0,0]=4 15173 B15R1.8448 CC(=O)CCOCc1cc(ccc1Br)Br 7a_100011266457_100000053229 [0,2,0,0,0,0|2,0,0]=4 15174 B15R1.8448 CC(=O)CCOCc1cc(ccc1Br)C 7a_100012361352_100000053229 [0,2,0,0,0,0|2,0,0]=4 15175 B15R1.8448 CC(=O)CCOCc1cc(ccc1Br)Cl 34a_100000759926_100000733903 [0,2,0,0,0,0|2,0,0]=4 15176 B15R1.8448 CC(=O)CCOCc1cc(ccc1Br)Cl 7a_100000759926_100000733903 [0,2,0,0,0,0|2,0,0]=4 15177 B15R1.8448 CC(=O)CCOCc1cc(ccc1Br)Cl 7a_100012355668_100000053229 [0,2,0,0,0,0|2,0,0]=4 15178 B15R1.8448 CC(=O)CCOCc1cc(ccc1Br)F 34a_100000759926_100000736370 [0,2,0,0,0,0|2,0,0]=4 15179 B15R1.8448 CC(=O)CCOCc1cc(ccc1Br)F 7a_100000759926_100000736370 [0,2,0,0,0,0|2,0,0]=4 15180 B15R1.8448 CC(=O)CCOCc1cc(ccc1Br)F 7a_100011217561_100000053229 [0,2,0,0,0,0|2,0,0]=4 15181 B15R1.8448 CC(=O)CCOCc1cc(ccc1Br)I 34a_100000759926_100012355412 [0,2,0,0,0,0|2,0,0]=4 15182 B15R1.8448 CC(=O)CCOCc1cc(ccc1Br)I 7a_100000759926_100012355412 [0,2,0,0,0,0|2,0,0]=4 15183 B15R1.8448 CC(=O)CCOCc1cc(ccc1Br)I 7a_100012359683_100000053229 [0,2,0,0,0,0|2,0,0]=4 15184 B15R1.8448 CC(=O)CCOCc1cc(ccc1C)Br 7a_100000700630_100000053229 [0,2,0,0,0,0|2,0,0]=4 15185 B15R1.8448 CC(=O)CCOCc1cc(ccc1C)C 34a_100000759926_100000184699 [0,2,0,0,0,0|2,0,0]=4 15186 B15R1.8448 CC(=O)CCOCc1cc(ccc1C)C 7a_100000759926_100000184699 [0,2,0,0,0,0|2,0,0]=4 15187 B15R1.8448 CC(=O)CCOCc1cc(ccc1C)C 7a_200011215349_100000053229 [0,2,0,0,0,0|2,0,0]=4 15188 B15R1.8448 CC(=O)CCOCc1cc(ccc1C)Cl 34a_100000759926_100012186985 [0,2,0,0,0,0|2,0,0]=4 15189 B15R1.8448 CC(=O)CCOCc1cc(ccc1C)Cl 7a_100000759926_100012186985 [0,2,0,0,0,0|2,0,0]=4 15190 B15R1.8448 CC(=O)CCOCc1cc(ccc1C)Cl 7a_100012002407_100000053229 [0,2,0,0,0,0|2,0,0]=4 15191 B15R1.8448 CC(=O)CCOCc1cc(ccc1C)F 34a_100000759926_100000709795 [0,2,0,0,0,0|2,0,0]=4 15192 B15R1.8448 CC(=O)CCOCc1cc(ccc1C)F 7a_100000759926_100000709795 [0,2,0,0,0,0|2,0,0]=4 15193 B15R1.8448 CC(=O)CCOCc1cc(ccc1C)F 7a_100011219218_100000053229 [0,2,0,0,0,0|2,0,0]=4 15194 B15R1.8448 CC(=O)CCOCc1cc(ccc1C)I 7a_100010150140_100000053229 [0,2,0,0,0,0|2,0,0]=4 15195 B15R1.8448 CC(=O)CCOCc1cc(ccc1Cl)Br 34a_100000759926_100000763347 [0,2,0,0,0,0|2,0,0]=4 15196 B15R1.8448 CC(=O)CCOCc1cc(ccc1Cl)Br 7a_100000759926_100000763347 [0,2,0,0,0,0|2,0,0]=4 15197 B15R1.8448 CC(=O)CCOCc1cc(ccc1Cl)Br 7a_100011215897_100000053229 [0,2,0,0,0,0|2,0,0]=4 15198 B15R1.8448 CC(=O)CCOCc1cc(ccc1Cl)C 34a_100000759926_100009871730 [0,2,0,0,0,0|2,0,0]=4 15199 B15R1.8448 CC(=O)CCOCc1cc(ccc1Cl)C 7a_100000759926_100009871730 [0,2,0,0,0,0|2,0,0]=4 15200 B15R1.8448 CC(=O)CCOCc1cc(ccc1Cl)C 7a_100009878994_100000053229 [0,2,0,0,0,0|2,0,0]=4 15201 B15R1.8448 CC(=O)CCOCc1cc(ccc1Cl)Cl 34a_100000759926_100000756322 [0,2,0,0,0,0|2,0,0]=4 15202 B15R1.8448 CC(=O)CCOCc1cc(ccc1Cl)Cl 7a_100000698905_100000053229 [0,2,0,0,0,0|2,0,0]=4 15203 B15R1.8448 CC(=O)CCOCc1cc(ccc1Cl)Cl 7a_100000759926_100000756322 [0,2,0,0,0,0|2,0,0]=4 15204 B15R1.8448 CC(=O)CCOCc1cc(ccc1Cl)F 34a_100000759926_100000709952 [0,2,0,0,0,0|2,0,0]=4 15205 B15R1.8448 CC(=O)CCOCc1cc(ccc1Cl)F 7a_100000759926_100000709952 [0,2,0,0,0,0|2,0,0]=4 15206 B15R1.8448 CC(=O)CCOCc1cc(ccc1Cl)F 7a_100011218361_100000053229 [0,2,0,0,0,0|2,0,0]=4 15207 B15R1.8448 CC(=O)CCOCc1cc(ccc1Cl)I 34a_100000759926_100010188191 [0,2,0,0,0,0|2,0,0]=4 15208 B15R1.8448 CC(=O)CCOCc1cc(ccc1Cl)I 7a_100000759926_100010188191 [0,2,0,0,0,0|2,0,0]=4 15209 B15R1.8448 CC(=O)CCOCc1cc(ccc1Cl)I 7a_100010128486_100000053229 [0,2,0,0,0,0|2,0,0]=4 15210 B15R1.8448 CC(=O)CCOCc1cc(ccc1F)Br 34a_100000759926_100000736399 [0,2,0,0,0,0|2,0,0]=4 15211 B15R1.8448 CC(=O)CCOCc1cc(ccc1F)Br 7a_100000246282_100000053229 [0,2,0,0,0,0|2,0,0]=4 15212 B15R1.8448 CC(=O)CCOCc1cc(ccc1F)Br 7a_100000759926_100000736399 [0,2,0,0,0,0|2,0,0]=4 15213 B15R1.8448 CC(=O)CCOCc1cc(ccc1F)C 34a_100000759926_100011260760 [0,2,0,0,0,0|2,0,0]=4 15214 B15R1.8448 CC(=O)CCOCc1cc(ccc1F)C 7a_100000759926_100011260760 [0,2,0,0,0,0|2,0,0]=4 15215 B15R1.8448 CC(=O)CCOCc1cc(ccc1F)C 7a_100011692775_100000053229 [0,2,0,0,0,0|2,0,0]=4 15216 B15R1.8448 CC(=O)CCOCc1cc(ccc1F)Cl 34a_100000759926_100000716957 [0,2,0,0,0,0|2,0,0]=4 15217 B15R1.8448 CC(=O)CCOCc1cc(ccc1F)Cl 7a_100000759926_100000716957 [0,2,0,0,0,0|2,0,0]=4 15218 B15R1.8448 CC(=O)CCOCc1cc(ccc1F)Cl 7a_100011217248_100000053229 [0,2,0,0,0,0|2,0,0]=4 15219 B15R1.8448 CC(=O)CCOCc1cc(ccc1F)F 34a_100000759926_100000741279 [0,2,0,0,0,0|2,0,0]=4 15220 B15R1.8448 CC(=O)CCOCc1cc(ccc1F)F 7a_100000759926_100000741279 [0,2,0,0,0,0|2,0,0]=4 15221 B15R1.8448 CC(=O)CCOCc1cc(ccc1F)F 7a_100011217725_100000053229 [0,2,0,0,0,0|2,0,0]=4 15222 B15R1.8448 CC(=O)CCOCc1cc(ccc1F)I 34a_100000759926_200010149601 [0,2,0,0,0,0|2,0,0]=4 15223 B15R1.8448 CC(=O)CCOCc1cc(ccc1F)I 7a_100000049604_100000053229 [0,2,0,0,0,0|2,0,0]=4 15224 B15R1.8448 CC(=O)CCOCc1cc(ccc1F)I 7a_100000759926_200010149601 [0,2,0,0,0,0|2,0,0]=4 15225 B15R1.8448 CC(=O)CCOCc1cc(ccc1I)Br 34a_100000759926_100012362523 [0,2,0,0,0,0|2,0,0]=4 15226 B15R1.8448 CC(=O)CCOCc1cc(ccc1I)Br 7a_100000759926_100012362523 [0,2,0,0,0,0|2,0,0]=4 15227 B15R1.8448 CC(=O)CCOCc1cc(ccc1I)Br 7a_100011356890_100000053229 [0,2,0,0,0,0|2,0,0]=4 15228 B15R1.8448 CC(=O)CCOCc1cc(ccc1I)Cl 34a_100000759926_100012348826 [0,2,0,0,0,0|2,0,0]=4 15229 B15R1.8448 CC(=O)CCOCc1cc(ccc1I)Cl 7a_100000759926_100012348826 [0,2,0,0,0,0|2,0,0]=4 15230 B15R1.8448 CC(=O)CCOCc1cc(ccc1I)F 34a_100000759926_100010149606 [0,2,0,0,0,0|2,0,0]=4 15231 B15R1.8448 CC(=O)CCOCc1cc(ccc1I)F 7a_100000759926_100010149606 [0,2,0,0,0,0|2,0,0]=4 15232 B15R1.8448 CC(=O)CCOCc1cc(ccc1I)F 7a_100010255287_100000053229 [0,2,0,0,0,0|2,0,0]=4 15233 B15R1.8448 CC(=O)CCOCc1cc(ccc1N)Br 7a_100012353972_100000053229 [0,2,0,0,0,0|2,0,0]=4 15234 B15R1.8448 CC(=O)CCOCc1cc(ccc1N)C 7a_100011215565_100000053229 [0,2,0,0,0,0|2,0,0]=4 15235 B15R1.8448 CC(=O)CCOCc1cc(ccc1N)Cl 7a_100011214999_100000053229 [0,2,0,0,0,0|2,0,0]=4 15236 B15R1.8448 CC(=O)CCOCc1cc(ccc1N)F 7a_100011296978_100000053229 [0,2,0,0,0,0|2,0,0]=4 15237 B15R1.8448 CC(=O)CCOCc1cc(ccc1O)F 34a_100000759926_100010161318 [0,2,0,0,0,0|2,0,0]=4 15238 B15R1.8448 CC(=O)CCOCc1cc(ccc1O)F 7a_100000759926_100010161318 [0,2,0,0,0,0|2,0,0]=4 15239 B15R1.8448 CC(=O)CCSCc1cc(ccc1Br)Br 62a_100000053229_100011982794 [0,2,0,0,0,0|2,0,0]=4 15240 B15R1.8448 CC(=O)CCSCc1cc(ccc1Br)Br 62a_100011982794_100000053229 [0,2,0,0,0,0|2,0,0]=4 15241 B15R1.8448 CC(=O)CCSCc1cc(ccc1Br)Cl 62a_100000053229_100000733903 [0,2,0,0,0,0|2,0,0]=4 15242 B15R1.8448 CC(=O)CCSCc1cc(ccc1Br)Cl 62a_100000733903_100000053229 [0,2,0,0,0,0|2,0,0]=4 15243 B15R1.8448 CC(=O)CCSCc1cc(ccc1Br)F 62a_100000053229_100000736370 [0,2,0,0,0,0|2,0,0]=4 15244 B15R1.8448 CC(=O)CCSCc1cc(ccc1Br)F 62a_100000736370_100000053229 [0,2,0,0,0,0|2,0,0]=4 15245 B15R1.8448 CC(=O)CCSCc1cc(ccc1Br)I 62a_100000053229_100012355412 [0,2,0,0,0,0|2,0,0]=4 15246 B15R1.8448 CC(=O)CCSCc1cc(ccc1Br)I 62a_100012355412_100000053229 [0,2,0,0,0,0|2,0,0]=4 15247 B15R1.8448 CC(=O)CCSCc1cc(ccc1C)C 62a_100000053229_100000184699 [0,2,0,0,0,0|2,0,0]=4 15248 B15R1.8448 CC(=O)CCSCc1cc(ccc1C)C 62a_100000184699_100000053229 [0,2,0,0,0,0|2,0,0]=4 15249 B15R1.8448 CC(=O)CCSCc1cc(ccc1C)Cl 62a_100000053229_100012186985 [0,2,0,0,0,0|2,0,0]=4 15250 B15R1.8448 CC(=O)CCSCc1cc(ccc1C)Cl 62a_100012186985_100000053229 [0,2,0,0,0,0|2,0,0]=4 15251 B15R1.8448 CC(=O)CCSCc1cc(ccc1C)F 62a_100000053229_100000709795 [0,2,0,0,0,0|2,0,0]=4 15252 B15R1.8448 CC(=O)CCSCc1cc(ccc1C)F 62a_100000709795_100000053229 [0,2,0,0,0,0|2,0,0]=4 15253 B15R1.8448 CC(=O)CCSCc1cc(ccc1Cl)Br 62a_100000053229_100000763347 [0,2,0,0,0,0|2,0,0]=4 15254 B15R1.8448 CC(=O)CCSCc1cc(ccc1Cl)Br 62a_100000763347_100000053229 [0,2,0,0,0,0|2,0,0]=4 15255 B15R1.8448 CC(=O)CCSCc1cc(ccc1Cl)C 62a_100000053229_100009871730 [0,2,0,0,0,0|2,0,0]=4 15256 B15R1.8448 CC(=O)CCSCc1cc(ccc1Cl)C 62a_100009871730_100000053229 [0,2,0,0,0,0|2,0,0]=4 15257 B15R1.8448 CC(=O)CCSCc1cc(ccc1Cl)Cl 62a_100000053229_100000756322 [0,2,0,0,0,0|2,0,0]=4 15258 B15R1.8448 CC(=O)CCSCc1cc(ccc1Cl)Cl 62a_100000756322_100000053229 [0,2,0,0,0,0|2,0,0]=4 15259 B15R1.8448 CC(=O)CCSCc1cc(ccc1Cl)F 62a_100000053229_100000709952 [0,2,0,0,0,0|2,0,0]=4 15260 B15R1.8448 CC(=O)CCSCc1cc(ccc1Cl)F 62a_100000709952_100000053229 [0,2,0,0,0,0|2,0,0]=4 15261 B15R1.8448 CC(=O)CCSCc1cc(ccc1Cl)I 62a_100000053229_100010188191 [0,2,0,0,0,0|2,0,0]=4 15262 B15R1.8448 CC(=O)CCSCc1cc(ccc1Cl)I 62a_100010188191_100000053229 [0,2,0,0,0,0|2,0,0]=4 15263 B15R1.8448 CC(=O)CCSCc1cc(ccc1F)Br 62a_100000053229_100000736399 [0,2,0,0,0,0|2,0,0]=4 15264 B15R1.8448 CC(=O)CCSCc1cc(ccc1F)Br 62a_100000736399_100000053229 [0,2,0,0,0,0|2,0,0]=4 15265 B15R1.8448 CC(=O)CCSCc1cc(ccc1F)C 62a_100000053229_100011260760 [0,2,0,0,0,0|2,0,0]=4 15266 B15R1.8448 CC(=O)CCSCc1cc(ccc1F)C 62a_100011260760_100000053229 [0,2,0,0,0,0|2,0,0]=4 15267 B15R1.8448 CC(=O)CCSCc1cc(ccc1F)Cl 62a_100000053229_100000716957 [0,2,0,0,0,0|2,0,0]=4 15268 B15R1.8448 CC(=O)CCSCc1cc(ccc1F)Cl 62a_100000716957_100000053229 [0,2,0,0,0,0|2,0,0]=4 15269 B15R1.8448 CC(=O)CCSCc1cc(ccc1F)F 62a_100000053229_100000685659 [0,2,0,0,0,0|2,0,0]=4 15270 B15R1.8448 CC(=O)CCSCc1cc(ccc1F)F 62a_100000685659_100000053229 [0,2,0,0,0,0|2,0,0]=4 15271 B15R1.8448 CC(=O)CCSCc1cc(ccc1F)I 62a_100000053229_200010149601 [0,2,0,0,0,0|2,0,0]=4 15272 B15R1.8448 CC(=O)CCSCc1cc(ccc1F)I 62a_200010149601_100000053229 [0,2,0,0,0,0|2,0,0]=4 15273 B15R1.8448 CC(=O)CCSCc1cc(ccc1I)Br 62a_100000053229_100012362523 [0,2,0,0,0,0|2,0,0]=4 15274 B15R1.8448 CC(=O)CCSCc1cc(ccc1I)Br 62a_100012362523_100000053229 [0,2,0,0,0,0|2,0,0]=4 15275 B15R1.8448 CC(=O)CCSCc1cc(ccc1I)Cl 62a_100000053229_100012348826 [0,2,0,0,0,0|2,0,0]=4 15276 B15R1.8448 CC(=O)CCSCc1cc(ccc1I)Cl 62a_100012348826_100000053229 [0,2,0,0,0,0|2,0,0]=4 15277 B15R1.8448 CC(=O)CCSCc1cc(ccc1I)F 62a_100000053229_100010149606 [0,2,0,0,0,0|2,0,0]=4 15278 B15R1.8448 CC(=O)CCSCc1cc(ccc1I)F 62a_100010149606_100000053229 [0,2,0,0,0,0|2,0,0]=4 15279 B15R1.8448 CC(=O)CCSCc1cc(ccc1O)F 62a_100000053229_100010161318 [0,2,0,0,0,0|2,0,0]=4 15280 B15R1.8448 CC(=O)CCSCc1cc(ccc1O)F 62a_100010161318_100000053229 [0,2,0,0,0,0|2,0,0]=4 15281 B15R1.8448 CC(=O)COCCc1cc(ccc1F)F 34a_100000211253_100011755056 [0,2,0,0,0,0|2,0,0]=4 15282 B15R1.8448 Cc1ccc(c(c1)CCNCC(=O)N)C 2230a_200011485678_100000747473 [0,2,0,0,0,0|2,0,0]=4 15283 B15R1.8448 Cc1ccc(c(c1)CCNCC(=O)N)C 34a_200011485678_100000187820 [0,2,0,0,0,0|2,0,0]=4 15284 B15R1.8448 Cc1ccc(c(c1)CCNCC(=O)[O-])C 34a_200011485678_100020667443 [0,2,0,0,0,0|1,0,1]=4 15285 B15R1.8448 Cc1ccc(c(c1)CCOCC(=O)N)C 34a_100011694955_100000187820 [0,2,0,0,0,0|2,0,0]=4 15286 B15R1.8448 Cc1ccc(c(c1)CCOCC(=O)N)C 7a_100011694955_100000187820 [0,2,0,0,0,0|2,0,0]=4 15287 B15R1.8448 Cc1ccc(c(c1)CCOCC(=O)[O-])C 34a_100011694955_100020667443 [0,2,0,0,0,0|1,0,1]=4 15288 B15R1.8448 Cc1ccc(c(c1)CNCCC(=O)N)Br 207a_100000740010_100011551863 [0,2,0,0,0,0|2,0,0]=4 15289 B15R1.8448 Cc1ccc(c(c1)CNCCC(=O)N)C 207a_100000740010_100000211343 [0,2,0,0,0,0|2,0,0]=4 15290 B15R1.8448 Cc1ccc(c(c1)CNCCC(=O)N)C 34a_100000174964_100000731001 [0,2,0,0,0,0|2,0,0]=4 15291 B15R1.8448 Cc1ccc(c(c1)CNCCC(=O)N)Cl 207a_100000740010_100011551332 [0,2,0,0,0,0|2,0,0]=4 15292 B15R1.8448 Cc1ccc(c(c1)CNCCC(=O)N)Cl 2230a_100025705715_100000744528 [0,2,0,0,0,0|2,0,0]=4 15293 B15R1.8448 Cc1ccc(c(c1)CNCCC(=O)N)Cl 34a_100025705715_100000731001 [0,2,0,0,0,0|2,0,0]=4 15294 B15R1.8448 Cc1ccc(c(c1)CNCCC(=O)N)F 207a_100000740010_100000756917 [0,2,0,0,0,0|2,0,0]=4 15295 B15R1.8448 Cc1ccc(c(c1)CNCCC(=O)N)F 34a_100102693586_100000731001 [0,2,0,0,0,0|2,0,0]=4 15296 B15R1.8448 Cc1ccc(c(c1)CNCCC(=O)N)I 207a_100000740010_100010150105 [0,2,0,0,0,0|2,0,0]=4 15297 B15R1.8448 Cc1ccc(c(c1)CNOCC(=O)O)C 269956a_100000106656_100000184699 [0,2,0,0,0,0|2,0,0]=4 15298 B15R1.8448 Cc1ccc(c(c1)CNOCC(=O)O)Cl 269956a_100000106656_100009871730 [0,2,0,0,0,0|2,0,0]=4 15299 B15R1.8448 Cc1ccc(c(c1)CNOCC(=O)O)F 269956a_100000106656_100011260760 [0,2,0,0,0,0|2,0,0]=4 15300 B15R1.8448 Cc1ccc(c(c1)COCCC(=O)N)Br 34a_100012361352_100000731001 [0,2,0,0,0,0|2,0,0]=4 15301 B15R1.8448 Cc1ccc(c(c1)COCCC(=O)N)Br 7a_100012361352_100000744528 [0,2,0,0,0,0|2,0,0]=4 15302 B15R1.8448 Cc1ccc(c(c1)COCCC(=O)N)C 34a_100000757172_100000184699 [0,2,0,0,0,0|2,0,0]=4 15303 B15R1.8448 Cc1ccc(c(c1)COCCC(=O)N)C 34a_200011215349_100000731001 [0,2,0,0,0,0|2,0,0]=4 15304 B15R1.8448 Cc1ccc(c(c1)COCCC(=O)N)C 7a_100000757172_100000184699 [0,2,0,0,0,0|2,0,0]=4 15305 B15R1.8448 Cc1ccc(c(c1)COCCC(=O)N)C 7a_200011215349_100000744528 [0,2,0,0,0,0|2,0,0]=4 15306 B15R1.8448 Cc1ccc(c(c1)COCCC(=O)N)Cl 34a_100000757172_100009871730 [0,2,0,0,0,0|2,0,0]=4 15307 B15R1.8448 Cc1ccc(c(c1)COCCC(=O)N)Cl 34a_100009878994_100000731001 [0,2,0,0,0,0|2,0,0]=4 15308 B15R1.8448 Cc1ccc(c(c1)COCCC(=O)N)Cl 7a_100000757172_100009871730 [0,2,0,0,0,0|2,0,0]=4 15309 B15R1.8448 Cc1ccc(c(c1)COCCC(=O)N)Cl 7a_100009878994_100000744528 [0,2,0,0,0,0|2,0,0]=4 15310 B15R1.8448 Cc1ccc(c(c1)COCCC(=O)N)F 34a_100000757172_100011260760 [0,2,0,0,0,0|2,0,0]=4 15311 B15R1.8448 Cc1ccc(c(c1)COCCC(=O)N)F 34a_100011692775_100000731001 [0,2,0,0,0,0|2,0,0]=4 15312 B15R1.8448 Cc1ccc(c(c1)COCCC(=O)N)F 7a_100000757172_100011260760 [0,2,0,0,0,0|2,0,0]=4 15313 B15R1.8448 Cc1ccc(c(c1)COCCC(=O)N)F 7a_100011692775_100000744528 [0,2,0,0,0,0|2,0,0]=4 15314 B15R1.8448 Cc1ccc(c(c1)COCCC(=O)N)N 34a_100011215565_100000731001 [0,2,0,0,0,0|2,0,0]=4 15315 B15R1.8448 Cc1ccc(c(c1)COCCC(=O)N)N 7a_100011215565_100000744528 [0,2,0,0,0,0|2,0,0]=4 15316 B15R1.8448 Cc1ccc(c(c1)CSCCC(=O)N)C 62a_100000184699_100000744528 [0,2,0,0,0,0|2,0,0]=4 15317 B15R1.8448 Cc1ccc(c(c1)CSCCC(=O)N)C 62a_100000744528_100000184699 [0,2,0,0,0,0|2,0,0]=4 15318 B15R1.8448 Cc1ccc(c(c1)CSCCC(=O)N)Cl 62a_100000744528_100009871730 [0,2,0,0,0,0|2,0,0]=4 15319 B15R1.8448 Cc1ccc(c(c1)CSCCC(=O)N)Cl 62a_100009871730_100000744528 [0,2,0,0,0,0|2,0,0]=4 15320 B15R1.8448 Cc1ccc(c(c1)CSCCC(=O)N)F 62a_100000744528_100011260760 [0,2,0,0,0,0|2,0,0]=4 15321 B15R1.8448 Cc1ccc(c(c1)CSCCC(=O)N)F 62a_100011260760_100000744528 [0,2,0,0,0,0|2,0,0]=4 15322 B15R1.8448 Cc1ccc(c(c1)NCCCC(=O)N)Br 34a_100000745044_100102525003 [0,2,0,0,0,0|2,0,0]=4 15323 B15R1.8448 Cc1ccc(c(c1)NCCCC(=O)N)C 34a_100000185781_100102525003 [0,2,0,0,0,0|2,0,0]=4 15324 B15R1.8448 Cc1ccc(c(c1)NCCCC(=O)N)C 7a_100000185781_100102525003 [0,2,0,0,0,0|2,0,0]=4 15325 B15R1.8448 Cc1ccc(c(c1)NCCCC(=O)N)Cl 34a_100011215360_100102525003 [0,2,0,0,0,0|2,0,0]=4 15326 B15R1.8448 Cc1ccc(c(c1)NCCCC(=O)N)F 34a_100000211285_100102525003 [0,2,0,0,0,0|2,0,0]=4 15327 B15R1.8448 Cc1ccc(c(c1)NCCCC(=O)N)I 34a_100011216686_100102525003 [0,2,0,0,0,0|2,0,0]=4 15328 B15R1.8448 Cc1ccc(c(c1)NCCCC(=O)N)O 34a_100011215204_100102525003 [0,2,0,0,0,0|2,0,0]=4 15329 B15R1.8448 Cc1ccc(c(c1)OCCCC(=O)N)Br 34a_100012002257_100102525003 [0,2,0,0,0,0|2,0,0]=4 15330 B15R1.8448 Cc1ccc(c(c1)OCCCC(=O)N)Br 7a_100012002257_100102525003 [0,2,0,0,0,0|2,0,0]=4 15331 B15R1.8448 Cc1ccc(c(c1)OCCCC(=O)N)C 34a_100000210931_100102525003 [0,2,0,0,0,0|2,0,0]=4 15332 B15R1.8448 Cc1ccc(c(c1)OCCCC(=O)N)C 7a_100000210931_100102525003 [0,2,0,0,0,0|2,0,0]=4 15333 B15R1.8448 Cc1ccc(c(c1)OCCCC(=O)N)Cl 34a_100000211493_100102525003 [0,2,0,0,0,0|2,0,0]=4 15334 B15R1.8448 Cc1ccc(c(c1)OCCCC(=O)N)Cl 7a_100000211493_100102525003 [0,2,0,0,0,0|2,0,0]=4 15335 B15R1.8448 Cc1ccc(c(c1)OCCCC(=O)N)F 34a_100000759540_100102525003 [0,2,0,0,0,0|2,0,0]=4 15336 B15R1.8448 Cc1ccc(c(c1)OCCCC(=O)N)F 7a_100000759540_100102525003 [0,2,0,0,0,0|2,0,0]=4 15337 B15R1.8448 Cc1ccc(c(c1)OCCCC(=O)N)N 34a_100000211527_100102525003 [0,2,0,0,0,0|2,0,0]=4 15338 B15R1.8448 Cc1ccc(c(c1)OCCCC(=O)N)N 7a_100000211527_100102525003 [0,2,0,0,0,0|2,0,0]=4 15339 B15R1.8448 Cc1ccc(c(c1)SCCCC(=O)N)Br 62a_100012353751_100102525003 [0,2,0,0,0,0|2,0,0]=4 15340 B15R1.8448 Cc1ccc(c(c1)SCCCC(=O)N)Br 62a_100102525003_100012353751 [0,2,0,0,0,0|2,0,0]=4 15341 B15R1.8448 Cc1ccc(c(c1)SCCCC(=O)N)C 62a_100000210833_100102525003 [0,2,0,0,0,0|2,0,0]=4 15342 B15R1.8448 Cc1ccc(c(c1)SCCCC(=O)N)C 62a_100102525003_100000210833 [0,2,0,0,0,0|2,0,0]=4 15343 B15R1.8448 Cc1ccc(c(c1)SCCCC(=O)N)Cl 62a_100012356289_100102525003 [0,2,0,0,0,0|2,0,0]=4 15344 B15R1.8448 Cc1ccc(c(c1)SCCCC(=O)N)Cl 62a_100102525003_100012356289 [0,2,0,0,0,0|2,0,0]=4 15345 B15R1.8448 Cc1ccc(c(c1)SCCCC(=O)N)F 62a_100000736223_100102525003 [0,2,0,0,0,0|2,0,0]=4 15346 B15R1.8448 Cc1ccc(c(c1)SCCCC(=O)N)F 62a_100102525003_100000736223 [0,2,0,0,0,0|2,0,0]=4 15347 B15R1.8448 Cc1ccc(c(c1)SCCCC(=O)N)N 62a_100011356834_100102525003 [0,2,0,0,0,0|2,0,0]=4 15348 B15R1.8448 Cc1ccc(c(c1)SCCCC(=O)N)N 62a_100102525003_100011356834 [0,2,0,0,0,0|2,0,0]=4 15349 B15R1.8448 Cc1ccc(c(c1)SCCCC(=O)N)O 62a_100000765521_100102525003 [0,2,0,0,0,0|2,0,0]=4 15350 B15R1.8448 Cc1ccc(c(c1)SCCCC(=O)N)O 62a_100102525003_100000765521 [0,2,0,0,0,0|2,0,0]=4 15351 B15R1.8448 Cc1ccc(cc1CNCCC(=O)N)Br 207a_100000740010_100011361606 [0,2,0,0,0,0|2,0,0]=4 15352 B15R1.8448 Cc1ccc(cc1CNCCC(=O)N)Cl 207a_100000740010_100011551331 [0,2,0,0,0,0|2,0,0]=4 15353 B15R1.8448 Cc1ccc(cc1CNCCC(=O)N)Cl 34a_100000717755_100000731001 [0,2,0,0,0,0|2,0,0]=4 15354 B15R1.8448 Cc1ccc(cc1CNCCC(=O)N)F 207a_100000740010_100000697687 [0,2,0,0,0,0|2,0,0]=4 15355 B15R1.8448 Cc1ccc(cc1CNCCC(=O)N)F 34a_100011217291_100000731001 [0,2,0,0,0,0|2,0,0]=4 15356 B15R1.8448 Cc1ccc(cc1CNCCC(=O)N)O 34a_200009844824_100000731001 [0,2,0,0,0,0|2,0,0]=4 15357 B15R1.8448 Cc1ccc(cc1CNOCC(=O)O)Cl 269956a_100000106656_100012186985 [0,2,0,0,0,0|2,0,0]=4 15358 B15R1.8448 Cc1ccc(cc1CNOCC(=O)O)F 269956a_100000106656_100000709795 [0,2,0,0,0,0|2,0,0]=4 15359 B15R1.8448 Cc1ccc(cc1COCCC(=O)N)Br 34a_100000700630_100000731001 [0,2,0,0,0,0|2,0,0]=4 15360 B15R1.8448 Cc1ccc(cc1COCCC(=O)N)Br 7a_100000700630_100000744528 [0,2,0,0,0,0|2,0,0]=4 15361 B15R1.8448 Cc1ccc(cc1COCCC(=O)N)Cl 34a_100000757172_100012186985 [0,2,0,0,0,0|2,0,0]=4 15362 B15R1.8448 Cc1ccc(cc1COCCC(=O)N)Cl 34a_100012002407_100000731001 [0,2,0,0,0,0|2,0,0]=4 15363 B15R1.8448 Cc1ccc(cc1COCCC(=O)N)Cl 7a_100000757172_100012186985 [0,2,0,0,0,0|2,0,0]=4 15364 B15R1.8448 Cc1ccc(cc1COCCC(=O)N)Cl 7a_100012002407_100000744528 [0,2,0,0,0,0|2,0,0]=4 15365 B15R1.8448 Cc1ccc(cc1COCCC(=O)N)F 34a_100000757172_100000709795 [0,2,0,0,0,0|2,0,0]=4 15366 B15R1.8448 Cc1ccc(cc1COCCC(=O)N)F 34a_100011219218_100000731001 [0,2,0,0,0,0|2,0,0]=4 15367 B15R1.8448 Cc1ccc(cc1COCCC(=O)N)F 7a_100000757172_100000709795 [0,2,0,0,0,0|2,0,0]=4 15368 B15R1.8448 Cc1ccc(cc1COCCC(=O)N)F 7a_100011219218_100000744528 [0,2,0,0,0,0|2,0,0]=4 15369 B15R1.8448 Cc1ccc(cc1COCCC(=O)N)I 34a_100010150140_100000731001 [0,2,0,0,0,0|2,0,0]=4 15370 B15R1.8448 Cc1ccc(cc1COCCC(=O)N)I 7a_100010150140_100000744528 [0,2,0,0,0,0|2,0,0]=4 15371 B15R1.8448 Cc1ccc(cc1CSCCC(=O)N)Cl 62a_100000744528_100012186985 [0,2,0,0,0,0|2,0,0]=4 15372 B15R1.8448 Cc1ccc(cc1CSCCC(=O)N)Cl 62a_100012186985_100000744528 [0,2,0,0,0,0|2,0,0]=4 15373 B15R1.8448 Cc1ccc(cc1CSCCC(=O)N)F 62a_100000709795_100000744528 [0,2,0,0,0,0|2,0,0]=4 15374 B15R1.8448 Cc1ccc(cc1CSCCC(=O)N)F 62a_100000744528_100000709795 [0,2,0,0,0,0|2,0,0]=4 15375 B15R1.8448 Cc1ccc(cc1NCCCC(=O)N)Br 34a_100000741167_100102525003 [0,2,0,0,0,0|2,0,0]=4 15376 B15R1.8448 Cc1ccc(cc1NCCCC(=O)N)Br 7a_100000741167_100102525003 [0,2,0,0,0,0|2,0,0]=4 15377 B15R1.8448 Cc1ccc(cc1NCCCC(=O)N)Cl 34a_100000211374_100102525003 [0,2,0,0,0,0|2,0,0]=4 15378 B15R1.8448 Cc1ccc(cc1NCCCC(=O)N)Cl 7a_100000211374_100102525003 [0,2,0,0,0,0|2,0,0]=4 15379 B15R1.8448 Cc1ccc(cc1NCCCC(=O)N)F 34a_100000211107_100102525003 [0,2,0,0,0,0|2,0,0]=4 15380 B15R1.8448 Cc1ccc(cc1NCCCC(=O)N)F 7a_100000211107_100102525003 [0,2,0,0,0,0|2,0,0]=4 15381 B15R1.8448 Cc1ccc(cc1NCCCC(=O)N)I 7a_100000761890_100102525003 [0,2,0,0,0,0|2,0,0]=4 15382 B15R1.8448 Cc1ccc(cc1NCCCC(=O)N)O 34a_100011216113_100102525003 [0,2,0,0,0,0|2,0,0]=4 15383 B15R1.8448 Cc1ccc(cc1OCCCC(=O)N)Br 34a_100000685420_100102525003 [0,2,0,0,0,0|2,0,0]=4 15384 B15R1.8448 Cc1ccc(cc1OCCCC(=O)N)Br 7a_100000685420_100102525003 [0,2,0,0,0,0|2,0,0]=4 15385 B15R1.8448 Cc1ccc(cc1OCCCC(=O)N)Cl 34a_100000756515_100102525003 [0,2,0,0,0,0|2,0,0]=4 15386 B15R1.8448 Cc1ccc(cc1OCCCC(=O)N)Cl 7a_100000756515_100102525003 [0,2,0,0,0,0|2,0,0]=4 15387 B15R1.8448 Cc1ccc(cc1OCCCC(=O)N)F 34a_100000690566_100102525003 [0,2,0,0,0,0|2,0,0]=4 15388 B15R1.8448 Cc1ccc(cc1OCCCC(=O)N)F 7a_100000690566_100102525003 [0,2,0,0,0,0|2,0,0]=4 15389 B15R1.8448 Cc1ccc(cc1OCCCC(=O)N)I 7a_100000766334_100102525003 [0,2,0,0,0,0|2,0,0]=4 15390 B15R1.8448 Cc1ccc(cc1OCCCC(=O)N)N 34a_100000759471_100102525003 [0,2,0,0,0,0|2,0,0]=4 15391 B15R1.8448 Cc1ccc(cc1OCCCC(=O)N)N 7a_100000759471_100102525003 [0,2,0,0,0,0|2,0,0]=4 15392 B15R1.8448 Cc1ccc(cc1SCCCC(=O)N)Br 62a_100011344865_100102525003 [0,2,0,0,0,0|2,0,0]=4 15393 B15R1.8448 Cc1ccc(cc1SCCCC(=O)N)Br 62a_100102525003_100011344865 [0,2,0,0,0,0|2,0,0]=4 15394 B15R1.8448 Cc1ccc(cc1SCCCC(=O)N)Cl 62a_100011263213_100102525003 [0,2,0,0,0,0|2,0,0]=4 15395 B15R1.8448 Cc1ccc(cc1SCCCC(=O)N)Cl 62a_100102525003_100011263213 [0,2,0,0,0,0|2,0,0]=4 15396 B15R1.8448 Cc1ccc(cc1SCCCC(=O)N)F 62a_100011218078_100102525003 [0,2,0,0,0,0|2,0,0]=4 15397 B15R1.8448 Cc1ccc(cc1SCCCC(=O)N)F 62a_100102525003_100011218078 [0,2,0,0,0,0|2,0,0]=4 15398 B15R1.8448 Cc1ccc(cc1SCCCC(=O)N)N 62a_100000736455_100102525003 [0,2,0,0,0,0|2,0,0]=4 15399 B15R1.8448 Cc1ccc(cc1SCCCC(=O)N)N 62a_100102525003_100000736455 [0,2,0,0,0,0|2,0,0]=4 15400 B15R1.8448 Cc1ccc(cc1SCCCC(=O)N)O 62a_100011380479_100102525003 [0,2,0,0,0,0|2,0,0]=4 15401 B15R1.8448 Cc1ccc(cc1SCCCC(=O)N)O 62a_100102525003_100011380479 [0,2,0,0,0,0|2,0,0]=4 15402 B15R1.8448 NC(=O)CCCNc1cc(ccc1Br)Br 34a_100000737762_100102525003 [0,2,0,0,0,0|2,0,0]=4 15403 B15R1.8448 NC(=O)CCCNc1cc(ccc1Br)Cl 34a_100000687073_100102525003 [0,2,0,0,0,0|2,0,0]=4 15404 B15R1.8448 NC(=O)CCCNc1cc(ccc1Br)F 34a_100000687223_100102525003 [0,2,0,0,0,0|2,0,0]=4 15405 B15R1.8448 NC(=O)CCCNc1cc(ccc1Br)O 34a_100011999798_100102525003 [0,2,0,0,0,0|2,0,0]=4 15406 B15R1.8448 NC(=O)CCCNc1cc(ccc1Cl)Br 34a_100000750497_100102525003 [0,2,0,0,0,0|2,0,0]=4 15407 B15R1.8448 NC(=O)CCCNc1cc(ccc1Cl)Cl 34a_100000184485_100102525003 [0,2,0,0,0,0|2,0,0]=4 15408 B15R1.8448 NC(=O)CCCNc1cc(ccc1Cl)F 34a_100000751338_100102525003 [0,2,0,0,0,0|2,0,0]=4 15409 B15R1.8448 NC(=O)CCCNc1cc(ccc1Cl)I 34a_200000761891_100102525003 [0,2,0,0,0,0|2,0,0]=4 15410 B15R1.8448 NC(=O)CCCNc1cc(ccc1Cl)O 34a_100011934297_100102525003 [0,2,0,0,0,0|2,0,0]=4 15411 B15R1.8448 NC(=O)CCCNc1cc(ccc1F)Br 34a_100000740924_100102525003 [0,2,0,0,0,0|2,0,0]=4 15412 B15R1.8448 NC(=O)CCCNc1cc(ccc1F)Cl 34a_100000212115_100102525003 [0,2,0,0,0,0|2,0,0]=4 15413 B15R1.8448 NC(=O)CCCNc1cc(ccc1F)F 34a_100000210742_100102525003 [0,2,0,0,0,0|2,0,0]=4 15414 B15R1.8448 NC(=O)CCCNc1cc(ccc1F)I 34a_100011464823_100102525003 [0,2,0,0,0,0|2,0,0]=4 15415 B15R1.8448 NC(=O)CCCNc1cc(ccc1F)O 34a_100012017239_100102525003 [0,2,0,0,0,0|2,0,0]=4 15416 B15R1.8448 NC(=O)CCCNc1cc(ccc1I)Br 34a_100000743836_100102525003 [0,2,0,0,0,0|2,0,0]=4 15417 B15R1.8448 NC(=O)CCCNc1cc(ccc1I)Cl 34a_100000761886_100102525003 [0,2,0,0,0,0|2,0,0]=4 15418 B15R1.8448 NC(=O)CCCNc1cc(ccc1I)F 34a_100011218093_100102525003 [0,2,0,0,0,0|2,0,0]=4 15419 B15R1.8448 NC(=O)CCCNc1cc(ccc1O)Br 34a_100000752626_100102525003 [0,2,0,0,0,0|2,0,0]=4 15420 B15R1.8448 NC(=O)CCCNc1cc(ccc1O)Cl 34a_100000210500_100102525003 [0,2,0,0,0,0|2,0,0]=4 15421 B15R1.8448 NC(=O)CCCNc1cc(ccc1O)F 34a_100000759472_100102525003 [0,2,0,0,0,0|2,0,0]=4 15422 B15R1.8448 NC(=O)CCCOc1cc(ccc1Br)Br 34a_100011220040_100102525003 [0,2,0,0,0,0|2,0,0]=4 15423 B15R1.8448 NC(=O)CCCOc1cc(ccc1Br)Br 7a_100011220040_100102525003 [0,2,0,0,0,0|2,0,0]=4 15424 B15R1.8448 NC(=O)CCCOc1cc(ccc1Br)Cl 34a_100012339455_100102525003 [0,2,0,0,0,0|2,0,0]=4 15425 B15R1.8448 NC(=O)CCCOc1cc(ccc1Br)Cl 7a_100012339455_100102525003 [0,2,0,0,0,0|2,0,0]=4 15426 B15R1.8448 NC(=O)CCCOc1cc(ccc1Br)F 34a_100000690578_100102525003 [0,2,0,0,0,0|2,0,0]=4 15427 B15R1.8448 NC(=O)CCCOc1cc(ccc1Br)F 7a_100000690578_100102525003 [0,2,0,0,0,0|2,0,0]=4 15428 B15R1.8448 NC(=O)CCCOc1cc(ccc1Br)I 34a_100012356990_100102525003 [0,2,0,0,0,0|2,0,0]=4 15429 B15R1.8448 NC(=O)CCCOc1cc(ccc1Br)I 7a_100012356990_100102525003 [0,2,0,0,0,0|2,0,0]=4 15430 B15R1.8448 NC(=O)CCCOc1cc(ccc1Cl)Br 34a_100000738945_100102525003 [0,2,0,0,0,0|2,0,0]=4 15431 B15R1.8448 NC(=O)CCCOc1cc(ccc1Cl)Br 7a_100000738945_100102525003 [0,2,0,0,0,0|2,0,0]=4 15432 B15R1.8448 NC(=O)CCCOc1cc(ccc1Cl)Cl 34a_100000211422_100102525003 [0,2,0,0,0,0|2,0,0]=4 15433 B15R1.8448 NC(=O)CCCOc1cc(ccc1Cl)Cl 7a_100000211422_100102525003 [0,2,0,0,0,0|2,0,0]=4 15434 B15R1.8448 NC(=O)CCCOc1cc(ccc1Cl)F 34a_100000692107_100102525003 [0,2,0,0,0,0|2,0,0]=4 15435 B15R1.8448 NC(=O)CCCOc1cc(ccc1Cl)F 7a_100000692107_100102525003 [0,2,0,0,0,0|2,0,0]=4 15436 B15R1.8448 NC(=O)CCCOc1cc(ccc1Cl)I 34a_100011356854_100102525003 [0,2,0,0,0,0|2,0,0]=4 15437 B15R1.8448 NC(=O)CCCOc1cc(ccc1Cl)I 7a_100011356854_100102525003 [0,2,0,0,0,0|2,0,0]=4 15438 B15R1.8448 NC(=O)CCCOc1cc(ccc1Cl)N 34a_100011934209_100102525003 [0,2,0,0,0,0|2,0,0]=4 15439 B15R1.8448 NC(=O)CCCOc1cc(ccc1F)Br 34a_100000686035_100102525003 [0,2,0,0,0,0|2,0,0]=4 15440 B15R1.8448 NC(=O)CCCOc1cc(ccc1F)Br 7a_100000686035_100102525003 [0,2,0,0,0,0|2,0,0]=4 15441 B15R1.8448 NC(=O)CCCOc1cc(ccc1F)Cl 34a_100000757397_100102525003 [0,2,0,0,0,0|2,0,0]=4 15442 B15R1.8448 NC(=O)CCCOc1cc(ccc1F)Cl 7a_100000757397_100102525003 [0,2,0,0,0,0|2,0,0]=4 15443 B15R1.8448 NC(=O)CCCOc1cc(ccc1F)F 34a_100000752141_100102525003 [0,2,0,0,0,0|2,0,0]=4 15444 B15R1.8448 NC(=O)CCCOc1cc(ccc1F)F 7a_100000752141_100102525003 [0,2,0,0,0,0|2,0,0]=4 15445 B15R1.8448 NC(=O)CCCOc1cc(ccc1F)I 34a_100009958187_100102525003 [0,2,0,0,0,0|2,0,0]=4 15446 B15R1.8448 NC(=O)CCCOc1cc(ccc1F)I 7a_100009958187_100102525003 [0,2,0,0,0,0|2,0,0]=4 15447 B15R1.8448 NC(=O)CCCOc1cc(ccc1F)N 34a_100012017398_100102525003 [0,2,0,0,0,0|2,0,0]=4 15448 B15R1.8448 NC(=O)CCCOc1cc(ccc1F)N 7a_100012017398_100102525003 [0,2,0,0,0,0|2,0,0]=4 15449 B15R1.8448 NC(=O)CCCOc1cc(ccc1I)Br 34a_100012344904_100102525003 [0,2,0,0,0,0|2,0,0]=4 15450 B15R1.8448 NC(=O)CCCOc1cc(ccc1I)Br 7a_100012344904_100102525003 [0,2,0,0,0,0|2,0,0]=4 15451 B15R1.8448 NC(=O)CCCOc1cc(ccc1I)Cl 34a_100000050036_100102525003 [0,2,0,0,0,0|2,0,0]=4 15452 B15R1.8448 NC(=O)CCCOc1cc(ccc1I)Cl 7a_100000050036_100102525003 [0,2,0,0,0,0|2,0,0]=4 15453 B15R1.8448 NC(=O)CCCOc1cc(ccc1I)F 34a_100010084537_100102525003 [0,2,0,0,0,0|2,0,0]=4 15454 B15R1.8448 NC(=O)CCCOc1cc(ccc1I)F 7a_100010084537_100102525003 [0,2,0,0,0,0|2,0,0]=4 15455 B15R1.8448 NC(=O)CCCOc1cc(ccc1N)Br 34a_100000739049_100102525003 [0,2,0,0,0,0|2,0,0]=4 15456 B15R1.8448 NC(=O)CCCOc1cc(ccc1N)Br 7a_100000739049_100102525003 [0,2,0,0,0,0|2,0,0]=4 15457 B15R1.8448 NC(=O)CCCOc1cc(ccc1N)Cl 34a_100000185728_100102525003 [0,2,0,0,0,0|2,0,0]=4 15458 B15R1.8448 NC(=O)CCCOc1cc(ccc1N)Cl 7a_100000185728_100102525003 [0,2,0,0,0,0|2,0,0]=4 15459 B15R1.8448 NC(=O)CCCOc1cc(ccc1N)F 34a_100000753323_100102525003 [0,2,0,0,0,0|2,0,0]=4 15460 B15R1.8448 NC(=O)CCCOc1cc(ccc1N)F 7a_100000753323_100102525003 [0,2,0,0,0,0|2,0,0]=4 15461 B15R1.8448 NC(=O)CCCOc1cc(ccc1N)I 34a_100000057187_100102525003 [0,2,0,0,0,0|2,0,0]=4 15462 B15R1.8448 NC(=O)CCCOc1cc(ccc1N)I 7a_100000057187_100102525003 [0,2,0,0,0,0|2,0,0]=4 15463 B15R1.8448 NC(=O)CCCOc1cc(ccc1N)N 34a_100025717382_100102525003 [0,2,0,0,0,0|2,0,0]=4 15464 B15R1.8448 NC(=O)CCCSc1cc(ccc1Br)Br 62a_100011483371_100102525003 [0,2,0,0,0,0|2,0,0]=4 15465 B15R1.8448 NC(=O)CCCSc1cc(ccc1Br)Br 62a_100102525003_100011483371 [0,2,0,0,0,0|2,0,0]=4 15466 B15R1.8448 NC(=O)CCCSc1cc(ccc1Br)Cl 62a_100012339723_100102525003 [0,2,0,0,0,0|2,0,0]=4 15467 B15R1.8448 NC(=O)CCCSc1cc(ccc1Br)Cl 62a_100102525003_100012339723 [0,2,0,0,0,0|2,0,0]=4 15468 B15R1.8448 NC(=O)CCCSc1cc(ccc1Br)F 62a_100011217576_100102525003 [0,2,0,0,0,0|2,0,0]=4 15469 B15R1.8448 NC(=O)CCCSc1cc(ccc1Br)F 62a_100102525003_100011217576 [0,2,0,0,0,0|2,0,0]=4 15470 B15R1.8448 NC(=O)CCCSc1cc(ccc1Br)N 62a_100000750459_100102525003 [0,2,0,0,0,0|2,0,0]=4 15471 B15R1.8448 NC(=O)CCCSc1cc(ccc1Br)N 62a_100102525003_100000750459 [0,2,0,0,0,0|2,0,0]=4 15472 B15R1.8448 NC(=O)CCCSc1cc(ccc1Br)O 62a_100012339312_100102525003 [0,2,0,0,0,0|2,0,0]=4 15473 B15R1.8448 NC(=O)CCCSc1cc(ccc1Br)O 62a_100102525003_100012339312 [0,2,0,0,0,0|2,0,0]=4 15474 B15R1.8448 NC(=O)CCCSc1cc(ccc1Cl)Br 62a_100011772130_100102525003 [0,2,0,0,0,0|2,0,0]=4 15475 B15R1.8448 NC(=O)CCCSc1cc(ccc1Cl)Br 62a_100102525003_100011772130 [0,2,0,0,0,0|2,0,0]=4 15476 B15R1.8448 NC(=O)CCCSc1cc(ccc1Cl)Cl 62a_100000707729_100102525003 [0,2,0,0,0,0|2,0,0]=4 15477 B15R1.8448 NC(=O)CCCSc1cc(ccc1Cl)Cl 62a_100102525003_100000707729 [0,2,0,0,0,0|2,0,0]=4 15478 B15R1.8448 NC(=O)CCCSc1cc(ccc1Cl)F 62a_100011217299_100102525003 [0,2,0,0,0,0|2,0,0]=4 15479 B15R1.8448 NC(=O)CCCSc1cc(ccc1Cl)F 62a_100102525003_100011217299 [0,2,0,0,0,0|2,0,0]=4 15480 B15R1.8448 NC(=O)CCCSc1cc(ccc1Cl)N 62a_100012360549_100102525003 [0,2,0,0,0,0|2,0,0]=4 15481 B15R1.8448 NC(=O)CCCSc1cc(ccc1Cl)N 62a_100102525003_100012360549 [0,2,0,0,0,0|2,0,0]=4 15482 B15R1.8448 NC(=O)CCCSc1cc(ccc1Cl)O 62a_100000049588_100102525003 [0,2,0,0,0,0|2,0,0]=4 15483 B15R1.8448 NC(=O)CCCSc1cc(ccc1Cl)O 62a_100102525003_100000049588 [0,2,0,0,0,0|2,0,0]=4 15484 B15R1.8448 NC(=O)CCCSc1cc(ccc1F)Br 62a_100011217312_100102525003 [0,2,0,0,0,0|2,0,0]=4 15485 B15R1.8448 NC(=O)CCCSc1cc(ccc1F)Br 62a_100102525003_100011217312 [0,2,0,0,0,0|2,0,0]=4 15486 B15R1.8448 NC(=O)CCCSc1cc(ccc1F)Cl 62a_100011218116_100102525003 [0,2,0,0,0,0|2,0,0]=4 15487 B15R1.8448 NC(=O)CCCSc1cc(ccc1F)Cl 62a_100102525003_100011218116 [0,2,0,0,0,0|2,0,0]=4 15488 B15R1.8448 NC(=O)CCCSc1cc(ccc1F)F 62a_100011219198_100102525003 [0,2,0,0,0,0|2,0,0]=4 15489 B15R1.8448 NC(=O)CCCSc1cc(ccc1F)F 62a_100102525003_100011219198 [0,2,0,0,0,0|2,0,0]=4 15490 B15R1.8448 NC(=O)CCCSc1cc(ccc1F)N 62a_100000760356_100102525003 [0,2,0,0,0,0|2,0,0]=4 15491 B15R1.8448 NC(=O)CCCSc1cc(ccc1F)N 62a_100102525003_100000760356 [0,2,0,0,0,0|2,0,0]=4 15492 B15R1.8448 NC(=O)CCCSc1cc(ccc1F)O 62a_100000693481_100102525003 [0,2,0,0,0,0|2,0,0]=4 15493 B15R1.8448 NC(=O)CCCSc1cc(ccc1F)O 62a_100102525003_100000693481 [0,2,0,0,0,0|2,0,0]=4 15494 B15R1.8448 NC(=O)CCCSc1cc(ccc1N)Br 62a_100000187925_100102525003 [0,2,0,0,0,0|2,0,0]=4 15495 B15R1.8448 NC(=O)CCCSc1cc(ccc1N)Br 62a_100102525003_100000187925 [0,2,0,0,0,0|2,0,0]=4 15496 B15R1.8448 NC(=O)CCCSc1cc(ccc1N)Cl 62a_100000761889_100102525003 [0,2,0,0,0,0|2,0,0]=4 15497 B15R1.8448 NC(=O)CCCSc1cc(ccc1N)Cl 62a_100102525003_100000761889 [0,2,0,0,0,0|2,0,0]=4 15498 B15R1.8448 NC(=O)CCCSc1cc(ccc1N)F 62a_100000760547_100102525003 [0,2,0,0,0,0|2,0,0]=4 15499 B15R1.8448 NC(=O)CCCSc1cc(ccc1N)F 62a_100102525003_100000760547 [0,2,0,0,0,0|2,0,0]=4 15500 B15R1.8448 NC(=O)CCCSc1cc(ccc1N)N 62a_100011534242_100102525003 [0,2,0,0,0,0|2,0,0]=4 15501 B15R1.8448 NC(=O)CCCSc1cc(ccc1N)N 62a_100102525003_100011534242 [0,2,0,0,0,0|2,0,0]=4 15502 B15R1.8448 NC(=O)CCCSc1cc(ccc1N)O 62a_100012001276_100102525003 [0,2,0,0,0,0|2,0,0]=4 15503 B15R1.8448 NC(=O)CCCSc1cc(ccc1N)O 62a_100102525003_100012001276 [0,2,0,0,0,0|2,0,0]=4 15504 B15R1.8448 NC(=O)CCCSc1cc(ccc1O)Br 62a_100012355227_100102525003 [0,2,0,0,0,0|2,0,0]=4 15505 B15R1.8448 NC(=O)CCCSc1cc(ccc1O)Br 62a_100102525003_100012355227 [0,2,0,0,0,0|2,0,0]=4 15506 B15R1.8448 NC(=O)CCCSc1cc(ccc1O)Cl 62a_100011356953_100102525003 [0,2,0,0,0,0|2,0,0]=4 15507 B15R1.8448 NC(=O)CCCSc1cc(ccc1O)Cl 62a_100102525003_100011356953 [0,2,0,0,0,0|2,0,0]=4 15508 B15R1.8448 NC(=O)CCCSc1cc(ccc1O)F 62a_100000211999_100102525003 [0,2,0,0,0,0|2,0,0]=4 15509 B15R1.8448 NC(=O)CCCSc1cc(ccc1O)F 62a_100102525003_100000211999 [0,2,0,0,0,0|2,0,0]=4 15510 B15R1.8448 NC(=O)CCCSc1cc(ccc1O)N 62a_100011534360_100102525003 [0,2,0,0,0,0|2,0,0]=4 15511 B15R1.8448 NC(=O)CCCSc1cc(ccc1O)N 62a_100102525003_100011534360 [0,2,0,0,0,0|2,0,0]=4 15512 B15R1.8448 NC(=O)CCCSc1cc(ccc1O)O 62a_100102525003_100009813629 [0,2,0,0,0,0|2,0,0]=4 15513 B15R1.8448 NC(=O)CCNCc1cc(ccc1Br)Br 207a_100000740010_100011266429 [0,2,0,0,0,0|2,0,0]=4 15514 B15R1.8448 NC(=O)CCNCc1cc(ccc1Br)Br 34a_100000707832_100000731001 [0,2,0,0,0,0|2,0,0]=4 15515 B15R1.8448 NC(=O)CCNCc1cc(ccc1Br)Cl 207a_100000740010_100000746314 [0,2,0,0,0,0|2,0,0]=4 15516 B15R1.8448 NC(=O)CCNCc1cc(ccc1Br)F 207a_100000740010_100000766564 [0,2,0,0,0,0|2,0,0]=4 15517 B15R1.8448 NC(=O)CCNCc1cc(ccc1Br)F 2230a_100000742738_100000744528 [0,2,0,0,0,0|2,0,0]=4 15518 B15R1.8448 NC(=O)CCNCc1cc(ccc1Br)F 34a_100000742738_100000731001 [0,2,0,0,0,0|2,0,0]=4 15519 B15R1.8448 NC(=O)CCNCc1cc(ccc1Br)I 207a_100000740010_100010185652 [0,2,0,0,0,0|2,0,0]=4 15520 B15R1.8448 NC(=O)CCNCc1cc(ccc1Cl)Br 207a_100000740010_100000746309 [0,2,0,0,0,0|2,0,0]=4 15521 B15R1.8448 NC(=O)CCNCc1cc(ccc1Cl)Br 34a_100025772652_100000731001 [0,2,0,0,0,0|2,0,0]=4 15522 B15R1.8448 NC(=O)CCNCc1cc(ccc1Cl)Cl 207a_100000740010_100000746308 [0,2,0,0,0,0|2,0,0]=4 15523 B15R1.8448 NC(=O)CCNCc1cc(ccc1Cl)Cl 34a_100102946428_100000731001 [0,2,0,0,0,0|2,0,0]=4 15524 B15R1.8448 NC(=O)CCNCc1cc(ccc1Cl)F 207a_100000740010_100011218309 [0,2,0,0,0,0|2,0,0]=4 15525 B15R1.8448 NC(=O)CCNCc1cc(ccc1Cl)F 2230a_100011830483_100000744528 [0,2,0,0,0,0|2,0,0]=4 15526 B15R1.8448 NC(=O)CCNCc1cc(ccc1Cl)F 34a_100011830483_100000731001 [0,2,0,0,0,0|2,0,0]=4 15527 B15R1.8448 NC(=O)CCNCc1cc(ccc1Cl)I 207a_100000740010_100010254384 [0,2,0,0,0,0|2,0,0]=4 15528 B15R1.8448 NC(=O)CCNCc1cc(ccc1F)Br 207a_100000740010_100000211465 [0,2,0,0,0,0|2,0,0]=4 15529 B15R1.8448 NC(=O)CCNCc1cc(ccc1F)Br 34a_100009815772_100000731001 [0,2,0,0,0,0|2,0,0]=4 15530 B15R1.8448 NC(=O)CCNCc1cc(ccc1F)Cl 207a_100000740010_100000745245 [0,2,0,0,0,0|2,0,0]=4 15531 B15R1.8448 NC(=O)CCNCc1cc(ccc1F)Cl 34a_100011211646_100000731001 [0,2,0,0,0,0|2,0,0]=4 15532 B15R1.8448 NC(=O)CCNCc1cc(ccc1F)F 207a_100000740010_100000740046 [0,2,0,0,0,0|2,0,0]=4 15533 B15R1.8448 NC(=O)CCNCc1cc(ccc1F)F 34a_100000752317_100000731001 [0,2,0,0,0,0|2,0,0]=4 15534 B15R1.8448 NC(=O)CCNCc1cc(ccc1F)I 207a_100000740010_100000050626 [0,2,0,0,0,0|2,0,0]=4 15535 B15R1.8448 NC(=O)CCNCc1cc(ccc1I)Br 207a_100000740010_100010185651 [0,2,0,0,0,0|2,0,0]=4 15536 B15R1.8448 NC(=O)CCNCc1cc(ccc1I)Cl 207a_100000740010_100010254386 [0,2,0,0,0,0|2,0,0]=4 15537 B15R1.8448 NC(=O)CCNCc1cc(ccc1I)F 207a_100000740010_100010186294 [0,2,0,0,0,0|2,0,0]=4 15538 B15R1.8448 NC(=O)CCNCc1cc(ccc1O)Br 34a_100000730032_100000731001 [0,2,0,0,0,0|2,0,0]=4 15539 B15R1.8448 NC(=O)CCNCc1cc(ccc1O)Cl 34a_100000238540_100000731001 [0,2,0,0,0,0|2,0,0]=4 15540 B15R1.8448 NC(=O)CCOCc1cc(ccc1Br)Br 34a_100000757172_100011982794 [0,2,0,0,0,0|2,0,0]=4 15541 B15R1.8448 NC(=O)CCOCc1cc(ccc1Br)Br 34a_100011266457_100000731001 [0,2,0,0,0,0|2,0,0]=4 15542 B15R1.8448 NC(=O)CCOCc1cc(ccc1Br)Br 7a_100000757172_100011982794 [0,2,0,0,0,0|2,0,0]=4 15543 B15R1.8448 NC(=O)CCOCc1cc(ccc1Br)Br 7a_100011266457_100000744528 [0,2,0,0,0,0|2,0,0]=4 15544 B15R1.8448 NC(=O)CCOCc1cc(ccc1Br)Cl 34a_100000757172_100000733903 [0,2,0,0,0,0|2,0,0]=4 15545 B15R1.8448 NC(=O)CCOCc1cc(ccc1Br)Cl 34a_100012355668_100000731001 [0,2,0,0,0,0|2,0,0]=4 15546 B15R1.8448 NC(=O)CCOCc1cc(ccc1Br)Cl 7a_100000757172_100000733903 [0,2,0,0,0,0|2,0,0]=4 15547 B15R1.8448 NC(=O)CCOCc1cc(ccc1Br)Cl 7a_100012355668_100000744528 [0,2,0,0,0,0|2,0,0]=4 15548 B15R1.8448 NC(=O)CCOCc1cc(ccc1Br)F 34a_100000757172_100000736370 [0,2,0,0,0,0|2,0,0]=4 15549 B15R1.8448 NC(=O)CCOCc1cc(ccc1Br)F 34a_100011217561_100000731001 [0,2,0,0,0,0|2,0,0]=4 15550 B15R1.8448 NC(=O)CCOCc1cc(ccc1Br)F 7a_100000757172_100000736370 [0,2,0,0,0,0|2,0,0]=4 15551 B15R1.8448 NC(=O)CCOCc1cc(ccc1Br)F 7a_100011217561_100000744528 [0,2,0,0,0,0|2,0,0]=4 15552 B15R1.8448 NC(=O)CCOCc1cc(ccc1Br)I 34a_100000757172_100012355412 [0,2,0,0,0,0|2,0,0]=4 15553 B15R1.8448 NC(=O)CCOCc1cc(ccc1Br)I 7a_100000757172_100012355412 [0,2,0,0,0,0|2,0,0]=4 15554 B15R1.8448 NC(=O)CCOCc1cc(ccc1Br)I 7a_100012359683_100000744528 [0,2,0,0,0,0|2,0,0]=4 15555 B15R1.8448 NC(=O)CCOCc1cc(ccc1Br)N 34a_100012347228_100000731001 [0,2,0,0,0,0|2,0,0]=4 15556 B15R1.8448 NC(=O)CCOCc1cc(ccc1Cl)Br 34a_100000757172_100000763347 [0,2,0,0,0,0|2,0,0]=4 15557 B15R1.8448 NC(=O)CCOCc1cc(ccc1Cl)Br 34a_100011215897_100000731001 [0,2,0,0,0,0|2,0,0]=4 15558 B15R1.8448 NC(=O)CCOCc1cc(ccc1Cl)Br 7a_100000757172_100000763347 [0,2,0,0,0,0|2,0,0]=4 15559 B15R1.8448 NC(=O)CCOCc1cc(ccc1Cl)Br 7a_100011215897_100000744528 [0,2,0,0,0,0|2,0,0]=4 15560 B15R1.8448 NC(=O)CCOCc1cc(ccc1Cl)Cl 34a_100000698905_100000731001 [0,2,0,0,0,0|2,0,0]=4 15561 B15R1.8448 NC(=O)CCOCc1cc(ccc1Cl)Cl 34a_100000757172_100000756322 [0,2,0,0,0,0|2,0,0]=4 15562 B15R1.8448 NC(=O)CCOCc1cc(ccc1Cl)Cl 7a_100000698905_100000744528 [0,2,0,0,0,0|2,0,0]=4 15563 B15R1.8448 NC(=O)CCOCc1cc(ccc1Cl)Cl 7a_100000757172_100000756322 [0,2,0,0,0,0|2,0,0]=4 15564 B15R1.8448 NC(=O)CCOCc1cc(ccc1Cl)F 34a_100000757172_100000709952 [0,2,0,0,0,0|2,0,0]=4 15565 B15R1.8448 NC(=O)CCOCc1cc(ccc1Cl)F 34a_100011218361_100000731001 [0,2,0,0,0,0|2,0,0]=4 15566 B15R1.8448 NC(=O)CCOCc1cc(ccc1Cl)F 7a_100000757172_100000709952 [0,2,0,0,0,0|2,0,0]=4 15567 B15R1.8448 NC(=O)CCOCc1cc(ccc1Cl)F 7a_100011218361_100000744528 [0,2,0,0,0,0|2,0,0]=4 15568 B15R1.8448 NC(=O)CCOCc1cc(ccc1Cl)I 34a_100000757172_100010188191 [0,2,0,0,0,0|2,0,0]=4 15569 B15R1.8448 NC(=O)CCOCc1cc(ccc1Cl)I 34a_100010128486_100000731001 [0,2,0,0,0,0|2,0,0]=4 15570 B15R1.8448 NC(=O)CCOCc1cc(ccc1Cl)I 7a_100000757172_100010188191 [0,2,0,0,0,0|2,0,0]=4 15571 B15R1.8448 NC(=O)CCOCc1cc(ccc1Cl)I 7a_100010128486_100000744528 [0,2,0,0,0,0|2,0,0]=4 15572 B15R1.8448 NC(=O)CCOCc1cc(ccc1Cl)N 34a_100011273577_100000731001 [0,2,0,0,0,0|2,0,0]=4 15573 B15R1.8448 NC(=O)CCOCc1cc(ccc1F)Br 34a_100000246282_100000731001 [0,2,0,0,0,0|2,0,0]=4 15574 B15R1.8448 NC(=O)CCOCc1cc(ccc1F)Br 34a_100000757172_100000736399 [0,2,0,0,0,0|2,0,0]=4 15575 B15R1.8448 NC(=O)CCOCc1cc(ccc1F)Br 7a_100000246282_100000744528 [0,2,0,0,0,0|2,0,0]=4 15576 B15R1.8448 NC(=O)CCOCc1cc(ccc1F)Br 7a_100000757172_100000736399 [0,2,0,0,0,0|2,0,0]=4 15577 B15R1.8448 NC(=O)CCOCc1cc(ccc1F)Cl 34a_100000757172_100000716957 [0,2,0,0,0,0|2,0,0]=4 15578 B15R1.8448 NC(=O)CCOCc1cc(ccc1F)Cl 34a_100011217248_100000731001 [0,2,0,0,0,0|2,0,0]=4 15579 B15R1.8448 NC(=O)CCOCc1cc(ccc1F)Cl 7a_100000757172_100000716957 [0,2,0,0,0,0|2,0,0]=4 15580 B15R1.8448 NC(=O)CCOCc1cc(ccc1F)Cl 7a_100011217248_100000744528 [0,2,0,0,0,0|2,0,0]=4 15581 B15R1.8448 NC(=O)CCOCc1cc(ccc1F)F 34a_100000757172_100000741279 [0,2,0,0,0,0|2,0,0]=4 15582 B15R1.8448 NC(=O)CCOCc1cc(ccc1F)F 34a_100011217725_100000731001 [0,2,0,0,0,0|2,0,0]=4 15583 B15R1.8448 NC(=O)CCOCc1cc(ccc1F)F 7a_100000757172_100000741279 [0,2,0,0,0,0|2,0,0]=4 15584 B15R1.8448 NC(=O)CCOCc1cc(ccc1F)F 7a_100011217725_100000744528 [0,2,0,0,0,0|2,0,0]=4 15585 B15R1.8448 NC(=O)CCOCc1cc(ccc1F)I 34a_100000049604_100000731001 [0,2,0,0,0,0|2,0,0]=4 15586 B15R1.8448 NC(=O)CCOCc1cc(ccc1F)I 34a_100000757172_200010149601 [0,2,0,0,0,0|2,0,0]=4 15587 B15R1.8448 NC(=O)CCOCc1cc(ccc1F)I 7a_100000049604_100000744528 [0,2,0,0,0,0|2,0,0]=4 15588 B15R1.8448 NC(=O)CCOCc1cc(ccc1F)I 7a_100000757172_200010149601 [0,2,0,0,0,0|2,0,0]=4 15589 B15R1.8448 NC(=O)CCOCc1cc(ccc1F)N 34a_100011218011_100000731001 [0,2,0,0,0,0|2,0,0]=4 15590 B15R1.8448 NC(=O)CCOCc1cc(ccc1I)Br 34a_100000757172_100012362523 [0,2,0,0,0,0|2,0,0]=4 15591 B15R1.8448 NC(=O)CCOCc1cc(ccc1I)Br 34a_100011356890_100000731001 [0,2,0,0,0,0|2,0,0]=4 15592 B15R1.8448 NC(=O)CCOCc1cc(ccc1I)Br 7a_100000757172_100012362523 [0,2,0,0,0,0|2,0,0]=4 15593 B15R1.8448 NC(=O)CCOCc1cc(ccc1I)Br 7a_100011356890_100000744528 [0,2,0,0,0,0|2,0,0]=4 15594 B15R1.8448 NC(=O)CCOCc1cc(ccc1I)Cl 34a_100000757172_100012348826 [0,2,0,0,0,0|2,0,0]=4 15595 B15R1.8448 NC(=O)CCOCc1cc(ccc1I)Cl 7a_100000757172_100012348826 [0,2,0,0,0,0|2,0,0]=4 15596 B15R1.8448 NC(=O)CCOCc1cc(ccc1I)F 34a_100000757172_100010149606 [0,2,0,0,0,0|2,0,0]=4 15597 B15R1.8448 NC(=O)CCOCc1cc(ccc1I)F 34a_100010255287_100000731001 [0,2,0,0,0,0|2,0,0]=4 15598 B15R1.8448 NC(=O)CCOCc1cc(ccc1I)F 7a_100000757172_100010149606 [0,2,0,0,0,0|2,0,0]=4 15599 B15R1.8448 NC(=O)CCOCc1cc(ccc1I)F 7a_100010255287_100000744528 [0,2,0,0,0,0|2,0,0]=4 15600 B15R1.8448 NC(=O)CCOCc1cc(ccc1N)Br 34a_100012353972_100000731001 [0,2,0,0,0,0|2,0,0]=4 15601 B15R1.8448 NC(=O)CCOCc1cc(ccc1N)Br 7a_100012353972_100000744528 [0,2,0,0,0,0|2,0,0]=4 15602 B15R1.8448 NC(=O)CCOCc1cc(ccc1N)Cl 34a_100011214999_100000731001 [0,2,0,0,0,0|2,0,0]=4 15603 B15R1.8448 NC(=O)CCOCc1cc(ccc1N)Cl 7a_100011214999_100000744528 [0,2,0,0,0,0|2,0,0]=4 15604 B15R1.8448 NC(=O)CCOCc1cc(ccc1N)F 34a_100011296978_100000731001 [0,2,0,0,0,0|2,0,0]=4 15605 B15R1.8448 NC(=O)CCOCc1cc(ccc1N)F 7a_100011296978_100000744528 [0,2,0,0,0,0|2,0,0]=4 15606 B15R1.8448 NC(=O)CCOCc1cc(ccc1O)F 34a_100000757172_100010161318 [0,2,0,0,0,0|2,0,0]=4 15607 B15R1.8448 NC(=O)CCOCc1cc(ccc1O)F 7a_100000757172_100010161318 [0,2,0,0,0,0|2,0,0]=4 15608 B15R1.8448 NC(=O)CCSCc1cc(ccc1Br)Br 62a_100000744528_100011982794 [0,2,0,0,0,0|2,0,0]=4 15609 B15R1.8448 NC(=O)CCSCc1cc(ccc1Br)Br 62a_100011982794_100000744528 [0,2,0,0,0,0|2,0,0]=4 15610 B15R1.8448 NC(=O)CCSCc1cc(ccc1Br)Cl 62a_100000733903_100000744528 [0,2,0,0,0,0|2,0,0]=4 15611 B15R1.8448 NC(=O)CCSCc1cc(ccc1Br)Cl 62a_100000744528_100000733903 [0,2,0,0,0,0|2,0,0]=4 15612 B15R1.8448 NC(=O)CCSCc1cc(ccc1Br)F 62a_100000736370_100000744528 [0,2,0,0,0,0|2,0,0]=4 15613 B15R1.8448 NC(=O)CCSCc1cc(ccc1Br)F 62a_100000744528_100000736370 [0,2,0,0,0,0|2,0,0]=4 15614 B15R1.8448 NC(=O)CCSCc1cc(ccc1Br)I 62a_100000744528_100012355412 [0,2,0,0,0,0|2,0,0]=4 15615 B15R1.8448 NC(=O)CCSCc1cc(ccc1Br)I 62a_100012355412_100000744528 [0,2,0,0,0,0|2,0,0]=4 15616 B15R1.8448 NC(=O)CCSCc1cc(ccc1Cl)Br 62a_100000744528_100000763347 [0,2,0,0,0,0|2,0,0]=4 15617 B15R1.8448 NC(=O)CCSCc1cc(ccc1Cl)Br 62a_100000763347_100000744528 [0,2,0,0,0,0|2,0,0]=4 15618 B15R1.8448 NC(=O)CCSCc1cc(ccc1Cl)Cl 62a_100000744528_100000756322 [0,2,0,0,0,0|2,0,0]=4 15619 B15R1.8448 NC(=O)CCSCc1cc(ccc1Cl)Cl 62a_100000756322_100000744528 [0,2,0,0,0,0|2,0,0]=4 15620 B15R1.8448 NC(=O)CCSCc1cc(ccc1Cl)F 62a_100000709952_100000744528 [0,2,0,0,0,0|2,0,0]=4 15621 B15R1.8448 NC(=O)CCSCc1cc(ccc1Cl)F 62a_100000744528_100000709952 [0,2,0,0,0,0|2,0,0]=4 15622 B15R1.8448 NC(=O)CCSCc1cc(ccc1Cl)I 62a_100000744528_100010188191 [0,2,0,0,0,0|2,0,0]=4 15623 B15R1.8448 NC(=O)CCSCc1cc(ccc1Cl)I 62a_100010188191_100000744528 [0,2,0,0,0,0|2,0,0]=4 15624 B15R1.8448 NC(=O)CCSCc1cc(ccc1F)Br 62a_100000736399_100000744528 [0,2,0,0,0,0|2,0,0]=4 15625 B15R1.8448 NC(=O)CCSCc1cc(ccc1F)Br 62a_100000744528_100000736399 [0,2,0,0,0,0|2,0,0]=4 15626 B15R1.8448 NC(=O)CCSCc1cc(ccc1F)Cl 62a_100000716957_100000744528 [0,2,0,0,0,0|2,0,0]=4 15627 B15R1.8448 NC(=O)CCSCc1cc(ccc1F)Cl 62a_100000744528_100000716957 [0,2,0,0,0,0|2,0,0]=4 15628 B15R1.8448 NC(=O)CCSCc1cc(ccc1F)F 62a_100000685659_100000744528 [0,2,0,0,0,0|2,0,0]=4 15629 B15R1.8448 NC(=O)CCSCc1cc(ccc1F)F 62a_100000744528_100000685659 [0,2,0,0,0,0|2,0,0]=4 15630 B15R1.8448 NC(=O)CCSCc1cc(ccc1F)I 62a_100000744528_200010149601 [0,2,0,0,0,0|2,0,0]=4 15631 B15R1.8448 NC(=O)CCSCc1cc(ccc1F)I 62a_200010149601_100000744528 [0,2,0,0,0,0|2,0,0]=4 15632 B15R1.8448 NC(=O)CCSCc1cc(ccc1I)Br 62a_100000744528_100012362523 [0,2,0,0,0,0|2,0,0]=4 15633 B15R1.8448 NC(=O)CCSCc1cc(ccc1I)Br 62a_100012362523_100000744528 [0,2,0,0,0,0|2,0,0]=4 15634 B15R1.8448 NC(=O)CCSCc1cc(ccc1I)Cl 62a_100000744528_100012348826 [0,2,0,0,0,0|2,0,0]=4 15635 B15R1.8448 NC(=O)CCSCc1cc(ccc1I)Cl 62a_100012348826_100000744528 [0,2,0,0,0,0|2,0,0]=4 15636 B15R1.8448 NC(=O)CCSCc1cc(ccc1I)F 62a_100000744528_100010149606 [0,2,0,0,0,0|2,0,0]=4 15637 B15R1.8448 NC(=O)CCSCc1cc(ccc1I)F 62a_100010149606_100000744528 [0,2,0,0,0,0|2,0,0]=4 15638 B15R1.8448 NC(=O)CCSCc1cc(ccc1O)F 62a_100000744528_100010161318 [0,2,0,0,0,0|2,0,0]=4 15639 B15R1.8448 NC(=O)CCSCc1cc(ccc1O)F 62a_100010161318_100000744528 [0,2,0,0,0,0|2,0,0]=4 15640 B15R1.8448 NC(=O)CNCCc1cc(ccc1Cl)Cl 2230a_100000705354_100000747473 [0,2,0,0,0,0|2,0,0]=4 15641 B15R1.8448 NC(=O)CNCCc1cc(ccc1Cl)Cl 34a_100000705354_100000187820 [0,2,0,0,0,0|2,0,0]=4 15642 B15R1.8448 NC(=O)CNCCc1cc(ccc1F)Cl 2230a_200011997525_100000747473 [0,2,0,0,0,0|2,0,0]=4 15643 B15R1.8448 NC(=O)CNCCc1cc(ccc1F)Cl 34a_200011997525_100000187820 [0,2,0,0,0,0|2,0,0]=4 15644 B15R1.8448 NC(=O)CNCCc1cc(ccc1F)F 2230a_100000711301_100011755056 [0,2,0,0,0,0|2,0,0]=4 15645 B15R1.8448 NC(=O)COCCc1cc(ccc1Br)Cl 34a_100012426913_100000187820 [0,2,0,0,0,0|2,0,0]=4 15646 B15R1.8448 NC(=O)COCCc1cc(ccc1Br)Cl 7a_100012426913_100000187820 [0,2,0,0,0,0|2,0,0]=4 15647 B15R1.8448 NC(=O)COCCc1cc(ccc1Cl)Cl 34a_100011754359_100000187820 [0,2,0,0,0,0|2,0,0]=4 15648 B15R1.8448 NC(=O)COCCc1cc(ccc1Cl)Cl 7a_100011754359_100000187820 [0,2,0,0,0,0|2,0,0]=4 15649 B15R1.8448 NC(=O)COCCc1cc(ccc1F)F 34a_100011755048_100000187820 [0,2,0,0,0,0|2,0,0]=4 15650 B15R1.8448 NC(=O)COCCc1cc(ccc1F)F 7a_100011755048_100000187820 [0,2,0,0,0,0|2,0,0]=4 15651 B15R1.8448 NC(=O)CSCCc1cc(ccc1F)F 62a_100000747473_100011755056 [0,2,0,0,0,0|2,0,0]=4 15652 B15R1.8448 NC(=O)CSCCc1cc(ccc1F)F 62a_100011755056_100000747473 [0,2,0,0,0,0|2,0,0]=4 15653 B15R1.8448 O=C(O)CNCCc1cc(ccc1F)F 269956a_100016091260_100011755056 [0,2,0,0,0,0|1,0,0]=3 15654 B15R1.8448 O=C(O)CONCc1cc(ccc1Br)Br 269956a_100000106656_100011982794 [0,2,0,0,0,0|2,0,0]=4 15655 B15R1.8448 O=C(O)CONCc1cc(ccc1Br)Cl 269956a_100000106656_100000733903 [0,2,0,0,0,0|2,0,0]=4 15656 B15R1.8448 O=C(O)CONCc1cc(ccc1Br)F 269956a_100000106656_100000736370 [0,2,0,0,0,0|2,0,0]=4 15657 B15R1.8448 O=C(O)CONCc1cc(ccc1Br)I 269956a_100000106656_100012355412 [0,2,0,0,0,0|2,0,0]=4 15658 B15R1.8448 O=C(O)CONCc1cc(ccc1Cl)Br 269956a_100000106656_100000763347 [0,2,0,0,0,0|2,0,0]=4 15659 B15R1.8448 O=C(O)CONCc1cc(ccc1Cl)Cl 269956a_100000106656_100000754809 [0,2,0,0,0,0|2,0,0]=4 15660 B15R1.8448 O=C(O)CONCc1cc(ccc1Cl)F 269956a_100000106656_100000709952 [0,2,0,0,0,0|2,0,0]=4 15661 B15R1.8448 O=C(O)CONCc1cc(ccc1Cl)I 269956a_100000106656_100010188191 [0,2,0,0,0,0|2,0,0]=4 15662 B15R1.8448 O=C(O)CONCc1cc(ccc1F)Br 269956a_100000106656_100000736399 [0,2,0,0,0,0|2,0,0]=4 15663 B15R1.8448 O=C(O)CONCc1cc(ccc1F)Cl 269956a_100000106656_100000716957 [0,2,0,0,0,0|2,0,0]=4 15664 B15R1.8448 O=C(O)CONCc1cc(ccc1F)F 269956a_100000106656_100000685659 [0,2,0,0,0,0|2,0,0]=4 15665 B15R1.8448 O=C(O)CONCc1cc(ccc1F)I 269956a_100000106656_200010149601 [0,2,0,0,0,0|2,0,0]=4 15666 B15R1.8448 O=C(O)CONCc1cc(ccc1I)Br 269956a_100000106656_100012362523 [0,2,0,0,0,0|2,0,0]=4 15667 B15R1.8448 O=C(O)CONCc1cc(ccc1I)Cl 269956a_100000106656_100012348826 [0,2,0,0,0,0|2,0,0]=4 15668 B15R1.8448 O=C(O)CONCc1cc(ccc1I)F 269956a_100000106656_100010149606 [0,2,0,0,0,0|2,0,0]=4 15669 B15R1.8448 O=C(O)CONCc1cc(ccc1O)F 269956a_100000106656_100010161318 [0,2,0,0,0,0|2,0,0]=4 15670 B15R1.8448 O=C([O-])CNCCc1cc(ccc1Cl)Cl 34a_100000705354_100020667443 [0,2,0,0,0,0|1,0,1]=4 15671 B15R1.8448 O=C([O-])CNCCc1cc(ccc1F)Cl 34a_200011997525_100020667443 [0,2,0,0,0,0|1,0,1]=4 15672 B15R1.8448 O=C([O-])COCCc1cc(ccc1Br)Cl 34a_100012426913_100020667443 [0,2,0,0,0,0|1,0,1]=4 15673 B15R1.8448 O=C([O-])COCCc1cc(ccc1Cl)Cl 34a_100011754359_100020667443 [0,2,0,0,0,0|1,0,1]=4 15674 B15R1.8448 O=C([O-])COCCc1cc(ccc1F)F 34a_100011755048_100020667443 [0,2,0,0,0,0|1,0,1]=4 15675 B15R1.8448 O=C([O-])CSCCc1cc(ccc1F)F 62a_100011755056_100020667443 [0,2,0,0,0,0|1,0,1]=4 15676 B15R1.8448 O=C([O-])CSCCc1cc(ccc1F)F 62a_100020667443_100011755056 [0,2,0,0,0,0|1,0,1]=4 15677 B15R1.84 C#Cc1ccccc1CNCCC(=O)N 34a_100020634229_100000731001 [0,2,0,0,0,0|2,0,0]=4 15678 B15R1.84 C#Cc1ccccc1COCCC(=O)C 7a_100000054652_100000053229 [0,2,0,0,0,0|2,0,0]=4 15679 B15R1.84 C#Cc1ccccc1COCCC(=O)N 34a_100000054652_100000731001 [0,2,0,0,0,0|2,0,0]=4 15680 B15R1.84 C#Cc1ccccc1COCCC(=O)N 7a_100000054652_100000744528 [0,2,0,0,0,0|2,0,0]=4 15681 B15R1.84 C#Cc1ccccc1NCCCC(=O)C 34a_100011470550_100000685027 [0,2,0,0,0,0|2,0,0]=4 15682 B15R1.84 C#Cc1ccccc1NCCCC(=O)N 34a_100011470550_100102525003 [0,2,0,0,0,0|2,0,0]=4 15683 B15R1.84 C#Cc1ccccc1OCCCC(=O)C 34a_200011470546_100000685027 [0,2,0,0,0,0|2,0,0]=4 15684 B15R1.84 C#Cc1ccccc1OCCCC(=O)C 7a_200011470546_100011215641 [0,2,0,0,0,0|2,0,0]=4 15685 B15R1.84 C#Cc1ccccc1OCCCC(=O)N 34a_200011470546_100102525003 [0,2,0,0,0,0|2,0,0]=4 15686 B15R1.84 C#Cc1ccccc1OCCCC(=O)N 7a_200011470546_100102525003 [0,2,0,0,0,0|2,0,0]=4 15687 B15R1.84 C=Cc1ccccc1COCCC(=O)C 7a_200010883148_100000053229 [0,2,0,0,0,0|2,0,0]=4 15688 B15R1.84 C=Cc1ccccc1COCCC(=O)N 34a_200010883148_100000731001 [0,2,0,0,0,0|2,0,0]=4 15689 B15R1.84 C=Cc1ccccc1COCCC(=O)N 7a_200010883148_100000744528 [0,2,0,0,0,0|2,0,0]=4 15690 B15R1.84 C=Cc1ccccc1NCCCC(=O)C 34a_100012022501_100000685027 [0,2,0,0,0,0|2,0,0]=4 15691 B15R1.84 C=Cc1ccccc1NCCCC(=O)N 34a_100012022501_100102525003 [0,2,0,0,0,0|2,0,0]=4 15692 B15R1.84 C=Cc1ccccc1SCCCC(=O)C 62a_100011215641_100011218376 [0,2,0,0,0,0|2,0,0]=4 15693 B15R1.84 C=Cc1ccccc1SCCCC(=O)C 62a_100011218376_100011215641 [0,2,0,0,0,0|2,0,0]=4 15694 B15R1.84 C=Cc1ccccc1SCCCC(=O)N 62a_100011218376_100102525003 [0,2,0,0,0,0|2,0,0]=4 15695 B15R1.84 C=Cc1ccccc1SCCCC(=O)N 62a_100102525003_100011218376 [0,2,0,0,0,0|2,0,0]=4 15696 B15R1.84 CC(=O)CCCNc1ccccc1C#N 34a_100000211148_100000685027 [0,2,0,0,0,0|2,0,0]=4 15697 B15R1.84 CC(=O)CCCNc1ccccc1CO 34a_100000212039_100000685027 [0,2,0,0,0,0|2,0,0]=4 15698 B15R1.84 CC(=O)CCCOc1ccccc1C#N 34a_100000211048_100000685027 [0,2,0,0,0,0|2,0,0]=4 15699 B15R1.84 CC(=O)CCCOc1ccccc1C#N 7a_100000211048_100011215641 [0,2,0,0,0,0|2,0,0]=4 15700 B15R1.84 CC(=O)CCCOc1ccccc1CN 34a_100000185550_100000685027 [0,2,0,0,0,0|2,0,0]=4 15701 B15R1.84 CC(=O)CCCOc1ccccc1CO 34a_100011216872_100000685027 [0,2,0,0,0,0|2,0,0]=4 15702 B15R1.84 CC(=O)CCCSc1ccccc1C#N 62a_100011215641_100000188569 [0,2,0,0,0,0|2,0,0]=4 15703 B15R1.84 CC(=O)CCCSc1ccccc1C=O 62a_100000210073_100011215641 [0,2,0,0,0,0|2,0,0]=4 15704 B15R1.84 CC(=O)CCCSc1ccccc1C=O 62a_100011215641_100000210073 [0,2,0,0,0,0|2,0,0]=4 15705 B15R1.84 CC(=O)CCCSc1ccccc1CN 62a_100000689332_100011215641 [0,2,0,0,0,0|2,0,0]=4 15706 B15R1.84 CC(=O)CCCSc1ccccc1CN 62a_100011215641_100000689332 [0,2,0,0,0,0|2,0,0]=4 15707 B15R1.84 CC(=O)CCCSc1ccccc1CO 62a_100000187465_100011215641 [0,2,0,0,0,0|2,0,0]=4 15708 B15R1.84 CC(=O)CCCSc1ccccc1CO 62a_100011215641_100000187465 [0,2,0,0,0,0|2,0,0]=4 15709 B15R1.84 CC(=O)CCCSc1ccccc1NN 62a_100000241748_100011215641 [0,2,0,0,0,0|2,0,0]=4 15710 B15R1.84 CC(=O)CCCSc1ccccc1NN 62a_100011215641_100000241748 [0,2,0,0,0,0|2,0,0]=4 15711 B15R1.84 CC(=O)CCOCc1ccccc1C#N 34a_100000759926_100000181865 [0,2,0,0,0,0|2,0,0]=4 15712 B15R1.84 CC(=O)CCOCc1ccccc1C#N 7a_100000759926_100000181865 [0,2,0,0,0,0|2,0,0]=4 15713 B15R1.84 CC(=O)CCOCc1ccccc1C#N 7a_200011269968_100000053229 [0,2,0,0,0,0|2,0,0]=4 15714 B15R1.84 CC(=O)CCOCc1ccccc1C=O 34a_100000759926_200009853537 [0,2,0,0,0,0|2,0,0]=4 15715 B15R1.84 CC(=O)CCOCc1ccccc1C=O 7a_100000759926_200009853537 [0,2,0,0,0,0|2,0,0]=4 15716 B15R1.84 CC(=O)CCOCc1ccccc1CBr 7a_100009816955_100000053229 [0,2,0,0,0,0|2,0,0]=4 15717 B15R1.84 CC(=O)CCOCc1ccccc1CO 34a_100000759926_100009816955 [0,2,0,0,0,0|2,0,0]=4 15718 B15R1.84 CC(=O)CCOCc1ccccc1CO 7a_100000759926_100009816955 [0,2,0,0,0,0|2,0,0]=4 15719 B15R1.84 CC(=O)CCSCc1ccccc1C#N 62a_100000053229_100000181865 [0,2,0,0,0,0|2,0,0]=4 15720 B15R1.84 CC(=O)CCSCc1ccccc1C#N 62a_100000186380_100000053229 [0,2,0,0,0,0|2,0,0]=4 15721 B15R1.84 CC(=O)CCSCc1ccccc1C=O 62a_100000053229_200009853537 [0,2,0,0,0,0|2,0,0]=4 15722 B15R1.84 CC(=O)CCSCc1ccccc1C=O 62a_200009853537_100000053229 [0,2,0,0,0,0|2,0,0]=4 15723 B15R1.84 CC(=O)CCSCc1ccccc1CO 62a_100000053229_100009816955 [0,2,0,0,0,0|2,0,0]=4 15724 B15R1.84 CC(=O)CCSCc1ccccc1CO 62a_100009816955_100000053229 [0,2,0,0,0,0|2,0,0]=4 15725 B15R1.84 CC(=O)COCCc1ccccc1C#N 34a_100000211253_200013032965 [0,2,0,0,0,0|2,0,0]=4 15726 B15R1.84 CC(=O)COCCc1ccccc1C=O 34a_100000211253_100010186698 [0,2,0,0,0,0|2,0,0]=4 15727 B15R1.84 CCc1ccccc1CCNCC(=O)N 2230a_100011663701_100000747473 [0,2,0,0,0,0|2,0,0]=4 15728 B15R1.84 CCc1ccccc1CCNCC(=O)N 34a_100011663701_100000187820 [0,2,0,0,0,0|2,0,0]=4 15729 B15R1.84 CCc1ccccc1CCNCC(=O)[O-] 34a_100011663701_100020667443 [0,2,0,0,0,0|1,0,1]=4 15730 B15R1.84 CCc1ccccc1CNCCC(=O)N 207a_100000740010_100011219594 [0,2,0,0,0,0|2,0,0]=4 15731 B15R1.84 CCc1ccccc1COCCC(=O)C 7a_100011663872_100000053229 [0,2,0,0,0,0|2,0,0]=4 15732 B15R1.84 CCc1ccccc1COCCC(=O)N 34a_100011663872_100000731001 [0,2,0,0,0,0|2,0,0]=4 15733 B15R1.84 CCc1ccccc1COCCC(=O)N 7a_100011663872_100000744528 [0,2,0,0,0,0|2,0,0]=4 15734 B15R1.84 CCc1ccccc1NCCCC(=O)C 34a_100000212081_100000685027 [0,2,0,0,0,0|2,0,0]=4 15735 B15R1.84 CCc1ccccc1NCCCC(=O)C 7a_100000212081_100011215641 [0,2,0,0,0,0|2,0,0]=4 15736 B15R1.84 CCc1ccccc1NCCCC(=O)N 34a_100000212081_100102525003 [0,2,0,0,0,0|2,0,0]=4 15737 B15R1.84 CCc1ccccc1NCCCC(=O)N 7a_100000212081_100102525003 [0,2,0,0,0,0|2,0,0]=4 15738 B15R1.84 CCc1ccccc1OCCCC(=O)C 34a_100000210936_100000685027 [0,2,0,0,0,0|2,0,0]=4 15739 B15R1.84 CCc1ccccc1OCCCC(=O)C 7a_100000210936_100011215641 [0,2,0,0,0,0|2,0,0]=4 15740 B15R1.84 CCc1ccccc1OCCCC(=O)N 34a_100000210936_100102525003 [0,2,0,0,0,0|2,0,0]=4 15741 B15R1.84 CCc1ccccc1OCCCC(=O)N 7a_100000210936_100102525003 [0,2,0,0,0,0|2,0,0]=4 15742 B15R1.84 CCc1ccccc1SCCCC(=O)C 62a_100011215641_100011215823 [0,2,0,0,0,0|2,0,0]=4 15743 B15R1.84 CCc1ccccc1SCCCC(=O)C 62a_100011215823_100011215641 [0,2,0,0,0,0|2,0,0]=4 15744 B15R1.84 CCc1ccccc1SCCCC(=O)N 62a_100011215823_100102525003 [0,2,0,0,0,0|2,0,0]=4 15745 B15R1.84 CCc1ccccc1SCCCC(=O)N 62a_100102525003_100011215823 [0,2,0,0,0,0|2,0,0]=4 15746 B15R1.84 CNc1ccccc1OCCCC(=O)C 34a_100000033821_100000685027 [0,2,0,0,0,0|2,0,0]=4 15747 B15R1.84 CNc1ccccc1OCCCC(=O)N 34a_100000033821_100102525003 [0,2,0,0,0,0|2,0,0]=4 15748 B15R1.84 CNc1ccccc1SCCCC(=O)C 62a_100011215641_100020606079 [0,2,0,0,0,0|2,0,0]=4 15749 B15R1.84 CNc1ccccc1SCCCC(=O)C 62a_100020606079_100011215641 [0,2,0,0,0,0|2,0,0]=4 15750 B15R1.84 CNc1ccccc1SCCCC(=O)N 62a_100020606079_100102525003 [0,2,0,0,0,0|2,0,0]=4 15751 B15R1.84 CNc1ccccc1SCCCC(=O)N 62a_100102525003_100020606079 [0,2,0,0,0,0|2,0,0]=4 15752 B15R1.84 COc1ccccc1CCNCC(=O)N 2230a_100000211851_100000747473 [0,2,0,0,0,0|2,0,0]=4 15753 B15R1.84 COc1ccccc1CCNCC(=O)N 2230a_100000711301_100011713687 [0,2,0,0,0,0|2,0,0]=4 15754 B15R1.84 COc1ccccc1CCNCC(=O)N 34a_100000211851_100000187820 [0,2,0,0,0,0|2,0,0]=4 15755 B15R1.84 COc1ccccc1CCNCC(=O)O 269956a_100016091260_100011713687 [0,2,0,0,0,0|1,0,0]=3 15756 B15R1.84 COc1ccccc1CCNCC(=O)[O-] 34a_100000211851_100020667443 [0,2,0,0,0,0|1,0,1]=4 15757 B15R1.84 COc1ccccc1CCOCC(=O)C 34a_100000211253_100011713687 [0,2,0,0,0,0|2,0,0]=4 15758 B15R1.84 COc1ccccc1CCOCC(=O)N 34a_100011218620_100000187820 [0,2,0,0,0,0|2,0,0]=4 15759 B15R1.84 COc1ccccc1CCOCC(=O)N 7a_100011218620_100000187820 [0,2,0,0,0,0|2,0,0]=4 15760 B15R1.84 COc1ccccc1CCOCC(=O)[O-] 34a_100011218620_100020667443 [0,2,0,0,0,0|1,0,1]=4 15761 B15R1.84 COc1ccccc1CCSCC(=O)N 62a_100000747473_100011713687 [0,2,0,0,0,0|2,0,0]=4 15762 B15R1.84 COc1ccccc1CCSCC(=O)N 62a_100011713687_100000747473 [0,2,0,0,0,0|2,0,0]=4 15763 B15R1.84 COc1ccccc1CCSCC(=O)[O-] 62a_100011713687_100020667443 [0,2,0,0,0,0|1,0,1]=4 15764 B15R1.84 COc1ccccc1CCSCC(=O)[O-] 62a_100020667443_100011713687 [0,2,0,0,0,0|1,0,1]=4 15765 B15R1.84 COc1ccccc1CNCCC(=O)N 207a_100000740010_100000169842 [0,2,0,0,0,0|2,0,0]=4 15766 B15R1.84 COc1ccccc1CNCCC(=O)N 34a_100000188900_100000731001 [0,2,0,0,0,0|2,0,0]=4 15767 B15R1.84 COc1ccccc1CNOCC(=O)O 269956a_100000106656_100000210004 [0,2,0,0,0,0|2,0,0]=4 15768 B15R1.84 COc1ccccc1COCCC(=O)C 34a_100000759926_100000210004 [0,2,0,0,0,0|2,0,0]=4 15769 B15R1.84 COc1ccccc1COCCC(=O)C 7a_100000759926_100000210004 [0,2,0,0,0,0|2,0,0]=4 15770 B15R1.84 COc1ccccc1COCCC(=O)N 34a_100000211301_100000731001 [0,2,0,0,0,0|2,0,0]=4 15771 B15R1.84 COc1ccccc1COCCC(=O)N 34a_100000757172_100000210004 [0,2,0,0,0,0|2,0,0]=4 15772 B15R1.84 COc1ccccc1COCCC(=O)N 7a_100000757172_100000210004 [0,2,0,0,0,0|2,0,0]=4 15773 B15R1.84 COc1ccccc1CSCCC(=O)C 62a_100000053229_100000210004 [0,2,0,0,0,0|2,0,0]=4 15774 B15R1.84 COc1ccccc1CSCCC(=O)C 62a_100000210004_100000053229 [0,2,0,0,0,0|2,0,0]=4 15775 B15R1.84 COc1ccccc1CSCCC(=O)N 62a_100000210004_100000744528 [0,2,0,0,0,0|2,0,0]=4 15776 B15R1.84 COc1ccccc1CSCCC(=O)N 62a_100000744528_100000210004 [0,2,0,0,0,0|2,0,0]=4 15777 B15R1.84 COc1ccccc1NCCCC(=O)C 34a_100000210025_100000685027 [0,2,0,0,0,0|2,0,0]=4 15778 B15R1.84 COc1ccccc1NCCCC(=O)N 34a_100000210025_100102525003 [0,2,0,0,0,0|2,0,0]=4 15779 B15R1.84 COc1ccccc1OCCCC(=O)C 1458a_100000070787_100011259231 [0,2,0,0,0,0|2,0,0]=4 15780 B15R1.84 COc1ccccc1OCCCC(=O)C 34a_100000210385_100000685027 [0,2,0,0,0,0|2,0,0]=4 15781 B15R1.84 COc1ccccc1OCCCC(=O)N 34a_100000210385_100102525003 [0,2,0,0,0,0|2,0,0]=4 15782 B15R1.84 COc1ccccc1SCCCC(=O)C 62a_100000210334_100011215641 [0,2,0,0,0,0|2,0,0]=4 15783 B15R1.84 COc1ccccc1SCCCC(=O)C 62a_100011215641_100000210334 [0,2,0,0,0,0|2,0,0]=4 15784 B15R1.84 COc1ccccc1SCCCC(=O)N 62a_100000210334_100102525003 [0,2,0,0,0,0|2,0,0]=4 15785 B15R1.84 COc1ccccc1SCCCC(=O)N 62a_100102525003_100000210334 [0,2,0,0,0,0|2,0,0]=4 15786 B15R1.84 CSc1ccccc1CNCCC(=O)N 207a_100000740010_100011217347 [0,2,0,0,0,0|2,0,0]=4 15787 B15R1.84 CSc1ccccc1CNCCC(=O)N 34a_102495365025_100000731001 [0,2,0,0,0,0|2,0,0]=4 15788 B15R1.84 CSc1ccccc1CNOCC(=O)O 269956a_100000106656_100000699184 [0,2,0,0,0,0|2,0,0]=4 15789 B15R1.84 CSc1ccccc1COCCC(=O)C 34a_100000759926_100000699184 [0,2,0,0,0,0|2,0,0]=4 15790 B15R1.84 CSc1ccccc1COCCC(=O)C 7a_100000759926_100000699184 [0,2,0,0,0,0|2,0,0]=4 15791 B15R1.84 CSc1ccccc1COCCC(=O)N 34a_100000699167_100000731001 [0,2,0,0,0,0|2,0,0]=4 15792 B15R1.84 CSc1ccccc1COCCC(=O)N 34a_100000757172_100000699184 [0,2,0,0,0,0|2,0,0]=4 15793 B15R1.84 CSc1ccccc1COCCC(=O)N 7a_100000757172_100000699184 [0,2,0,0,0,0|2,0,0]=4 15794 B15R1.84 CSc1ccccc1CSCCC(=O)C 62a_100000053229_100000699184 [0,2,0,0,0,0|2,0,0]=4 15795 B15R1.84 CSc1ccccc1CSCCC(=O)C 62a_100000699184_100000053229 [0,2,0,0,0,0|2,0,0]=4 15796 B15R1.84 CSc1ccccc1CSCCC(=O)N 62a_100000699184_100000744528 [0,2,0,0,0,0|2,0,0]=4 15797 B15R1.84 CSc1ccccc1CSCCC(=O)N 62a_100000744528_100000699184 [0,2,0,0,0,0|2,0,0]=4 15798 B15R1.84 CSc1ccccc1NCCCC(=O)C 34a_100000211160_100000685027 [0,2,0,0,0,0|2,0,0]=4 15799 B15R1.84 CSc1ccccc1NCCCC(=O)N 34a_100000211160_100102525003 [0,2,0,0,0,0|2,0,0]=4 15800 B15R1.84 CSc1ccccc1OCCCC(=O)C 34a_100011216402_100000685027 [0,2,0,0,0,0|2,0,0]=4 15801 B15R1.84 CSc1ccccc1OCCCC(=O)N 34a_100011216402_100102525003 [0,2,0,0,0,0|2,0,0]=4 15802 B15R1.84 CSc1ccccc1SCCCC(=O)C 62a_100011215641_100011217816 [0,2,0,0,0,0|2,0,0]=4 15803 B15R1.84 CSc1ccccc1SCCCC(=O)C 62a_100011217816_100011215641 [0,2,0,0,0,0|2,0,0]=4 15804 B15R1.84 CSc1ccccc1SCCCC(=O)N 62a_100011217816_100102525003 [0,2,0,0,0,0|2,0,0]=4 15805 B15R1.84 CSc1ccccc1SCCCC(=O)N 62a_100102525003_100011217816 [0,2,0,0,0,0|2,0,0]=4 15806 B15R1.84 N#Cc1ccccc1CCNCC(=O)N 2230a_100000711301_200013032965 [0,2,0,0,0,0|2,0,0]=4 15807 B15R1.84 N#Cc1ccccc1CCNCC(=O)O 269956a_100016091260_200013032965 [0,2,0,0,0,0|1,0,0]=3 15808 B15R1.84 N#Cc1ccccc1CCSCC(=O)N 62a_100000747473_200013032965 [0,2,0,0,0,0|2,0,0]=4 15809 B15R1.84 N#Cc1ccccc1CCSCC(=O)[O-] 62a_100020667443_200013032965 [0,2,0,0,0,0|1,0,1]=4 15810 B15R1.84 N#Cc1ccccc1CNCCC(=O)N 34a_100016989011_100000731001 [0,2,0,0,0,0|2,0,0]=4 15811 B15R1.84 N#Cc1ccccc1CNOCC(=O)O 269956a_100000106656_100000181865 [0,2,0,0,0,0|2,0,0]=4 15812 B15R1.84 N#Cc1ccccc1COCCC(=O)N 34a_100000757172_100000181865 [0,2,0,0,0,0|2,0,0]=4 15813 B15R1.84 N#Cc1ccccc1COCCC(=O)N 34a_200011269968_100000731001 [0,2,0,0,0,0|2,0,0]=4 15814 B15R1.84 N#Cc1ccccc1COCCC(=O)N 7a_100000757172_100000181865 [0,2,0,0,0,0|2,0,0]=4 15815 B15R1.84 N#Cc1ccccc1COCCC(=O)N 7a_200011269968_100000744528 [0,2,0,0,0,0|2,0,0]=4 15816 B15R1.84 N#Cc1ccccc1CSCCC(=O)N 62a_100000186380_100000744528 [0,2,0,0,0,0|2,0,0]=4 15817 B15R1.84 N#Cc1ccccc1CSCCC(=O)N 62a_100000744528_100000181865 [0,2,0,0,0,0|2,0,0]=4 15818 B15R1.84 N#Cc1ccccc1NCCCC(=O)N 34a_100000211148_100102525003 [0,2,0,0,0,0|2,0,0]=4 15819 B15R1.84 N#Cc1ccccc1OCCCC(=O)N 34a_100000211048_100102525003 [0,2,0,0,0,0|2,0,0]=4 15820 B15R1.84 N#Cc1ccccc1OCCCC(=O)N 7a_100000211048_100102525003 [0,2,0,0,0,0|2,0,0]=4 15821 B15R1.84 N#Cc1ccccc1SCCCC(=O)N 62a_100102525003_100000188569 [0,2,0,0,0,0|2,0,0]=4 15822 B15R1.84 NC(=O)CCCNc1ccccc1CO 34a_100000212039_100102525003 [0,2,0,0,0,0|2,0,0]=4 15823 B15R1.84 NC(=O)CCCOc1ccccc1CO 34a_100011216872_100102525003 [0,2,0,0,0,0|2,0,0]=4 15824 B15R1.84 NC(=O)CCCSc1ccccc1C=O 62a_100000210073_100102525003 [0,2,0,0,0,0|2,0,0]=4 15825 B15R1.84 NC(=O)CCCSc1ccccc1C=O 62a_100102525003_100000210073 [0,2,0,0,0,0|2,0,0]=4 15826 B15R1.84 NC(=O)CCCSc1ccccc1CO 62a_100000187465_100102525003 [0,2,0,0,0,0|2,0,0]=4 15827 B15R1.84 NC(=O)CCCSc1ccccc1CO 62a_100102525003_100000187465 [0,2,0,0,0,0|2,0,0]=4 15828 B15R1.84 NC(=O)CCOCc1ccccc1C=O 34a_100000757172_200009853537 [0,2,0,0,0,0|2,0,0]=4 15829 B15R1.84 NC(=O)CCOCc1ccccc1C=O 7a_100000757172_200009853537 [0,2,0,0,0,0|2,0,0]=4 15830 B15R1.84 NC(=O)CCOCc1ccccc1CBr 34a_100009816955_100000731001 [0,2,0,0,0,0|2,0,0]=4 15831 B15R1.84 NC(=O)CCOCc1ccccc1CBr 7a_100009816955_100000744528 [0,2,0,0,0,0|2,0,0]=4 15832 B15R1.84 NC(=O)CCOCc1ccccc1CO 34a_100000757172_100009816955 [0,2,0,0,0,0|2,0,0]=4 15833 B15R1.84 NC(=O)CCOCc1ccccc1CO 7a_100000757172_100009816955 [0,2,0,0,0,0|2,0,0]=4 15834 B15R1.84 NC(=O)CCSCc1ccccc1C=O 62a_100000744528_200009853537 [0,2,0,0,0,0|2,0,0]=4 15835 B15R1.84 NC(=O)CCSCc1ccccc1C=O 62a_200009853537_100000744528 [0,2,0,0,0,0|2,0,0]=4 15836 B15R1.84 NC(=O)CCSCc1ccccc1CO 62a_100000744528_100009816955 [0,2,0,0,0,0|2,0,0]=4 15837 B15R1.84 NC(=O)CCSCc1ccccc1CO 62a_100009816955_100000744528 [0,2,0,0,0,0|2,0,0]=4 15838 B15R1.84 NC(=O)CNCCc1ccccc1C=O 2230a_100000711301_100010186698 [0,2,0,0,0,0|2,0,0]=4 15839 B15R1.84 NC(=O)CNCCc1ccccc1[Pd]Cl 2230a_106741704370_100000747473 [0,2,0,0,0,0|2,0,0]=4 15840 B15R1.84 NC(=O)CNCCc1ccccc1[Pd]Cl 34a_106741704370_100000187820 [0,2,0,0,0,0|2,0,0]=4 15841 B15R1.84 NC(=O)CNCCc1ccccc1[Pd]Cl 7a_106741704370_100000187820 [0,2,0,0,0,0|2,0,0]=4 15842 B15R1.84 NC(=O)CSCCc1ccccc1C=O 62a_100000747473_100010186698 [0,2,0,0,0,0|2,0,0]=4 15843 B15R1.84 NC(=O)CSCCc1ccccc1C=O 62a_100010186698_100000747473 [0,2,0,0,0,0|2,0,0]=4 15844 B15R1.84 NCc1ccccc1COCCC(=O)N 34a_100000743596_100000731001 [0,2,0,0,0,0|2,0,0]=4 15845 B15R1.84 NCc1ccccc1OCCCC(=O)N 34a_100000185550_100102525003 [0,2,0,0,0,0|2,0,0]=4 15846 B15R1.84 NCc1ccccc1SCCCC(=O)N 62a_100000689332_100102525003 [0,2,0,0,0,0|2,0,0]=4 15847 B15R1.84 NCc1ccccc1SCCCC(=O)N 62a_100102525003_100000689332 [0,2,0,0,0,0|2,0,0]=4 15848 B15R1.84 NNc1ccccc1SCCCC(=O)N 62a_100000241748_100102525003 [0,2,0,0,0,0|2,0,0]=4 15849 B15R1.84 NNc1ccccc1SCCCC(=O)N 62a_100102525003_100000241748 [0,2,0,0,0,0|2,0,0]=4 15850 B15R1.84 O=C(O)CONCc1ccccc1CO 269956a_100000106656_100009816955 [0,2,0,0,0,0|2,0,0]=4 15851 B15R1.84 O=C([O-])CNCCc1ccccc1[Pd]Cl 34a_106741704370_100020667443 [0,2,0,0,0,0|1,0,1]=4 15852 B15R1.84 O=Cc1ccccc1CCNCC(=O)O 269956a_100016091260_100010186698 [0,2,0,0,0,0|1,0,0]=3 15853 B15R1.84 O=Cc1ccccc1CCSCC(=O)[O-] 62a_100010186698_100020667443 [0,2,0,0,0,0|1,0,1]=4 15854 B15R1.84 O=Cc1ccccc1CCSCC(=O)[O-] 62a_100020667443_100010186698 [0,2,0,0,0,0|1,0,1]=4 15855 B15R1.84 O=Cc1ccccc1CNOCC(=O)O 269956a_100000106656_200009853537 [0,2,0,0,0,0|2,0,0]=4 15856 B15R1.130 CN(CCc1ccccc1Br)CC(=O)N 2230a_100000739694_100012161201 [0,2,0,0,0,0|2,0,0]=4 15857 B15R1.130 CN(CCc1ccccc1Br)CC(=O)O 269956a_100000746989_100012161201 [0,2,0,0,0,0|1,0,0]=3 15858 B15R1.130 CN(CCc1ccccc1Cl)CC(=O)N 2230a_100000739694_100011713703 [0,2,0,0,0,0|2,0,0]=4 15859 B15R1.130 CN(CCc1ccccc1Cl)CC(=O)N 270004a_100000739694_200011713468 [0,2,0,0,0,0|2,0,0]=4 15860 B15R1.130 CN(CCc1ccccc1Cl)CC(=O)O 269956a_100000746989_100011713703 [0,2,0,0,0,0|1,0,0]=3 15861 B15R1.130 CN(CCc1ccccc1F)CC(=O)N 2230a_100000232559_100000747473 [0,2,0,0,0,0|2,0,0]=4 15862 B15R1.130 CN(CCc1ccccc1F)CC(=O)N 2230a_100000739694_100011713696 [0,2,0,0,0,0|2,0,0]=4 15863 B15R1.130 CN(CCc1ccccc1F)CC(=O)N 269982a_100000232559_100000187820 [0,2,0,0,0,0|2,0,0]=4 15864 B15R1.130 CN(CCc1ccccc1F)CC(=O)N 34a_100000232559_100000187820 [0,2,0,0,0,0|2,0,0]=4 15865 B15R1.130 CN(CCc1ccccc1F)CC(=O)O 269956a_100000746989_100011713696 [0,2,0,0,0,0|1,0,0]=3 15866 B15R1.130 CN(CCc1ccccc1F)CC(=O)[O-] 269982a_100000232559_100020667443 [0,2,0,0,0,0|1,0,1]=4 15867 B15R1.130 CN(CCc1ccccc1F)CC(=O)[O-] 34a_100000232559_100020667443 [0,2,0,0,0,0|1,0,1]=4 15868 B15R1.130 CN(CCc1ccccc1O)CC(=O)O 269956a_100000746989_100000722297 [0,2,0,0,0,0|1,0,0]=3 15869 B15R1.130 Cc1ccccc1CCC(=O)CC(=O)N 1458a_100000748742_100000187820 [0,2,0,0,0,0|1,0,1]=4 15870 B15R1.130 Cc1ccccc1CCC(=O)CC(=O)N 1458a_100134613110_100011713688 [0,2,0,0,0,0|1,0,1]=4 15871 B15R1.130 Cc1ccccc1CCC(=O)CC(=O)[O-] 1458a_100000748742_100020667443 [0,2,0,0,0,0|0,0,2]=4 15872 B15R1.130 Cc1ccccc1CCN(C)CC(=O)N 2230a_100000739694_100011713688 [0,2,0,0,0,0|2,0,0]=4 15873 B15R1.130 Cc1ccccc1CCN(C)CC(=O)O 269956a_100000746989_100011713688 [0,2,0,0,0,0|1,0,0]=3 15874 B15R1.130 NC(=O)CC(=O)CCc1ccccc1Br 1458a_100000740810_100000187820 [0,2,0,0,0,0|1,0,1]=4 15875 B15R1.130 NC(=O)CC(=O)CCc1ccccc1Br 1458a_100134613110_100012161201 [0,2,0,0,0,0|1,0,1]=4 15876 B15R1.130 NC(=O)CC(=O)CCc1ccccc1Cl 1458a_100000184300_100000187820 [0,2,0,0,0,0|1,0,1]=4 15877 B15R1.130 NC(=O)CC(=O)CCc1ccccc1Cl 1458a_100134613110_100011713703 [0,2,0,0,0,0|1,0,1]=4 15878 B15R1.130 NC(=O)CC(=O)CCc1ccccc1F 1458a_100000189703_100000187820 [0,2,0,0,0,0|1,0,1]=4 15879 B15R1.130 NC(=O)CC(=O)CCc1ccccc1F 1458a_100134613110_100000720011 [0,2,0,0,0,0|1,0,1]=4 15880 B15R1.130 NC(=O)CC(=O)CCc1ccccc1I 1458a_100000037306_100000187820 [0,2,0,0,0,0|1,0,1]=4 15881 B15R1.130 NC(=O)CC(=O)CCc1ccccc1O 1458a_100000181328_100000187820 [0,2,0,0,0,0|1,0,1]=4 15882 B15R1.130 NC(=O)CC(=O)CCc1ccccc1O 1458a_100134613110_100000722297 [0,2,0,0,0,0|1,0,1]=4 15883 B15R1.130 O=C([O-])CC(=O)CCc1ccccc1Br 1458a_100000740810_100020667443 [0,2,0,0,0,0|0,0,2]=4 15884 B15R1.130 O=C([O-])CC(=O)CCc1ccccc1Cl 1458a_100000184300_100020667443 [0,2,0,0,0,0|0,0,2]=4 15885 B15R1.130 O=C([O-])CC(=O)CCc1ccccc1F 1458a_100000189703_100020667443 [0,2,0,0,0,0|0,0,2]=4 15886 B15R1.130 O=C([O-])CC(=O)CCc1ccccc1I 1458a_100000037306_100020667443 [0,2,0,0,0,0|0,0,2]=4 15887 B15R1.130 O=C([O-])CC(=O)CCc1ccccc1O 1458a_100000181328_100020667443 [0,2,0,0,0,0|0,0,2]=4 15888 B15R1.256 CC(=O)CCN(C)Cc1ccccc1Br 269982a_100000184654_100000053229 [0,2,0,0,0,0|2,0,0]=4 15889 B15R1.256 CC(=O)CCN(C)Cc1ccccc1C 269982a_100000184421_100000053229 [0,2,0,0,0,0|2,0,0]=4 15890 B15R1.256 CC(=O)CCN(C)Cc1ccccc1Cl 269982a_100000184507_100000053229 [0,2,0,0,0,0|2,0,0]=4 15891 B15R1.256 CC(=O)CCN(C)Cc1ccccc1F 269982a_100000742528_100000053229 [0,2,0,0,0,0|2,0,0]=4 15892 B15R1.256 CC(=O)CCN(C)Cc1ccccc1O 269982a_100015189988_100000053229 [0,2,0,0,0,0|2,0,0]=4 15893 B15R1.256 CN(CCC(=O)N)Cc1ccccc1Br 2230a_100000184654_100000744528 [0,2,0,0,0,0|2,0,0]=4 15894 B15R1.256 CN(CCC(=O)N)Cc1ccccc1Br 2230a_100000730477_100000184730 [0,2,0,0,0,0|2,0,0]=4 15895 B15R1.256 CN(CCC(=O)N)Cc1ccccc1Br 269982a_100000184654_100000744528 [0,2,0,0,0,0|2,0,0]=4 15896 B15R1.256 CN(CCC(=O)N)Cc1ccccc1Br 270004a_100000730477_100000211189 [0,2,0,0,0,0|2,0,0]=4 15897 B15R1.256 CN(CCC(=O)N)Cc1ccccc1Cl 2230a_100000184507_100000744528 [0,2,0,0,0,0|2,0,0]=4 15898 B15R1.256 CN(CCC(=O)N)Cc1ccccc1Cl 2230a_100000730477_100000187162 [0,2,0,0,0,0|2,0,0]=4 15899 B15R1.256 CN(CCC(=O)N)Cc1ccccc1Cl 269982a_100000184507_100000744528 [0,2,0,0,0,0|2,0,0]=4 15900 B15R1.256 CN(CCC(=O)N)Cc1ccccc1Cl 270004a_100000730477_100000210073 [0,2,0,0,0,0|2,0,0]=4 15901 B15R1.256 CN(CCC(=O)N)Cc1ccccc1F 2230a_100000730477_100000211605 [0,2,0,0,0,0|2,0,0]=4 15902 B15R1.256 CN(CCC(=O)N)Cc1ccccc1F 2230a_100000742528_100000744528 [0,2,0,0,0,0|2,0,0]=4 15903 B15R1.256 CN(CCC(=O)N)Cc1ccccc1F 269982a_100000742528_100000744528 [0,2,0,0,0,0|2,0,0]=4 15904 B15R1.256 CN(CCC(=O)N)Cc1ccccc1F 270004a_100000730477_100000210811 [0,2,0,0,0,0|2,0,0]=4 15905 B15R1.256 CN(CCC(=O)N)Cc1ccccc1F 34a_100000742528_100000731001 [0,2,0,0,0,0|2,0,0]=4 15906 B15R1.256 CN(CCC(=O)N)Cc1ccccc1I 2230a_100000730477_100011215278 [0,2,0,0,0,0|2,0,0]=4 15907 B15R1.256 CN(CCC(=O)N)Cc1ccccc1I 270004a_100000730477_100000010305 [0,2,0,0,0,0|2,0,0]=4 15908 B15R1.256 CN(CCC(=O)N)Cc1ccccc1O 2230a_100015189988_100000744528 [0,2,0,0,0,0|2,0,0]=4 15909 B15R1.256 CN(CCC(=O)N)Cc1ccccc1O 269982a_100015189988_100000744528 [0,2,0,0,0,0|2,0,0]=4 15910 B15R1.256 Cc1ccccc1CC(=O)CCC(=O)N 1458a_100011215257_100000211839 [0,2,0,0,0,0|1,0,1]=4 15911 B15R1.256 Cc1ccccc1CN(C)CCC(=O)N 2230a_100000184421_100000744528 [0,2,0,0,0,0|2,0,0]=4 15912 B15R1.256 Cc1ccccc1CN(C)CCC(=O)N 2230a_100000730477_100000211839 [0,2,0,0,0,0|2,0,0]=4 15913 B15R1.256 Cc1ccccc1CN(C)CCC(=O)N 269982a_100000184421_100000744528 [0,2,0,0,0,0|2,0,0]=4 15914 B15R1.256 Cc1ccccc1CN(C)CCC(=O)N 270004a_100000730477_100000211143 [0,2,0,0,0,0|2,0,0]=4 15915 B15R1.256 NC(=O)CCC(=O)Cc1ccccc1Br 1458a_100011215257_100000184730 [0,2,0,0,0,0|1,0,1]=4 15916 B15R1.256 NC(=O)CCC(=O)Cc1ccccc1Cl 1458a_100011215257_100000187162 [0,2,0,0,0,0|1,0,1]=4 15917 B15R1.256 NC(=O)CCC(=O)Cc1ccccc1F 1458a_100011215257_100000187165 [0,2,0,0,0,0|1,0,1]=4 15918 B15R1.256 NC(=O)CCC(=O)Cc1ccccc1I 1458a_100011215257_100011216222 [0,2,0,0,0,0|1,0,1]=4 15919 B15R1.257 CC(=O)C(C)COCc1ccccc1Br 34a_100000032740_100000184730 [0,2,0,0,0,0|2,0,0]=4 15920 B15R1.257 CC(=O)C(C)COCc1ccccc1Br 7a_100000032740_100000184730 [0,2,0,0,0,0|2,0,0]=4 15921 B15R1.257 CC(=O)C(C)COCc1ccccc1C 34a_100000032740_100000211839 [0,2,0,0,0,0|2,0,0]=4 15922 B15R1.257 CC(=O)C(C)COCc1ccccc1C 7a_100000032740_100000211839 [0,2,0,0,0,0|2,0,0]=4 15923 B15R1.257 CC(=O)C(C)COCc1ccccc1Cl 34a_100000032740_100000187162 [0,2,0,0,0,0|2,0,0]=4 15924 B15R1.257 CC(=O)C(C)COCc1ccccc1Cl 7a_100000032740_100000187162 [0,2,0,0,0,0|2,0,0]=4 15925 B15R1.257 CC(=O)C(C)COCc1ccccc1F 34a_100000032740_100000211605 [0,2,0,0,0,0|2,0,0]=4 15926 B15R1.257 CC(=O)C(C)COCc1ccccc1F 7a_100000032740_100000211605 [0,2,0,0,0,0|2,0,0]=4 15927 B15R1.257 CC(=O)C(C)COCc1ccccc1I 34a_100000032740_100011215278 [0,2,0,0,0,0|2,0,0]=4 15928 B15R1.257 CC(=O)C(C)COCc1ccccc1I 7a_100000032740_100011215278 [0,2,0,0,0,0|2,0,0]=4 15929 B15R1.257 CC(=O)C(C)NCCc1ccccc1Br 2230a_100000747383_100009814033 [0,2,0,0,0,0|2,0,0]=4 15930 B15R1.257 CC(=O)C(C)NCCc1ccccc1C 2230a_100000685071_100009814033 [0,2,0,0,0,0|2,0,0]=4 15931 B15R1.257 CC(=O)C(C)NCCc1ccccc1Cl 2230a_100011207228_100009814033 [0,2,0,0,0,0|2,0,0]=4 15932 B15R1.257 CC(=O)C(C)NCCc1ccccc1F 2230a_100000185272_100009814033 [0,2,0,0,0,0|2,0,0]=4 15933 B15R1.257 CC(=O)C(C)OCCc1ccccc1Br 34a_100000212229_100012161201 [0,2,0,0,0,0|2,0,0]=4 15934 B15R1.257 CC(=O)C(C)OCCc1ccccc1Br 7a_100000731337_100000179758 [0,2,0,0,0,0|2,0,0]=4 15935 B15R1.257 CC(=O)C(C)OCCc1ccccc1C 34a_100000212229_100011713688 [0,2,0,0,0,0|2,0,0]=4 15936 B15R1.257 CC(=O)C(C)OCCc1ccccc1C 7a_100011220023_100000179758 [0,2,0,0,0,0|2,0,0]=4 15937 B15R1.257 CC(=O)C(C)OCCc1ccccc1Cl 34a_100000212229_100011713703 [0,2,0,0,0,0|2,0,0]=4 15938 B15R1.257 CC(=O)C(C)OCCc1ccccc1Cl 7a_100011215284_100000179758 [0,2,0,0,0,0|2,0,0]=4 15939 B15R1.257 CC(=O)C(C)OCCc1ccccc1F 34a_100000212229_100000720011 [0,2,0,0,0,0|2,0,0]=4 15940 B15R1.257 CC(=O)C(C)OCCc1ccccc1F 7a_100000753711_100000179758 [0,2,0,0,0,0|2,0,0]=4 15941 B15R1.257 CC(=O)C(C)OCCc1ccccc1I 7a_100010255290_100000179758 [0,2,0,0,0,0|2,0,0]=4 15942 B15R1.257 CC(=O)C(C)OCCc1ccccc1O 34a_100000212229_100000722297 [0,2,0,0,0,0|2,0,0]=4 15943 B15R1.257 CC(=O)C(C)SCCc1ccccc1Br 62a_100009814033_100012161201 [0,2,0,0,0,0|2,0,0]=4 15944 B15R1.257 CC(=O)C(C)SCCc1ccccc1Br 62a_100012161201_100009814033 [0,2,0,0,0,0|2,0,0]=4 15945 B15R1.257 CC(=O)C(C)SCCc1ccccc1C 62a_100009814033_100011713688 [0,2,0,0,0,0|2,0,0]=4 15946 B15R1.257 CC(=O)C(C)SCCc1ccccc1C 62a_100011713688_100009814033 [0,2,0,0,0,0|2,0,0]=4 15947 B15R1.257 CC(=O)C(C)SCCc1ccccc1Cl 62a_100009814033_100011713703 [0,2,0,0,0,0|2,0,0]=4 15948 B15R1.257 CC(=O)C(C)SCCc1ccccc1Cl 62a_100011713703_100009814033 [0,2,0,0,0,0|2,0,0]=4 15949 B15R1.257 CC(=O)C(C)SCCc1ccccc1F 62a_100009814033_100011713696 [0,2,0,0,0,0|2,0,0]=4 15950 B15R1.257 CC(=O)C(C)SCCc1ccccc1F 62a_100011713696_100009814033 [0,2,0,0,0,0|2,0,0]=4 15951 B15R1.257 CC(=O)C(C)SCCc1ccccc1O 62a_100000722297_100009814033 [0,2,0,0,0,0|2,0,0]=4 15952 B15R1.257 CC(=O)C(C)SCCc1ccccc1O 62a_100009814033_100000722297 [0,2,0,0,0,0|2,0,0]=4 15953 B15R1.257 CC(CNCc1ccccc1Br)C(=O)O 269956a_100000749485_100000184730 [0,2,0,0,0,0|1,0,0]=3 15954 B15R1.257 CC(CNCc1ccccc1Cl)C(=O)O 269956a_100000749485_100000187162 [0,2,0,0,0,0|1,0,0]=3 15955 B15R1.257 CC(CNCc1ccccc1F)C(=O)O 269956a_100000749485_100000187165 [0,2,0,0,0,0|1,0,0]=3 15956 B15R1.257 CC(CNCc1ccccc1I)C(=O)O 269956a_100000749485_100011216222 [0,2,0,0,0,0|1,0,0]=3 15957 B15R1.257 CC(CNCc1cccnc1Br)C(=O)O 269956a_100000749485_100010140945 [0,2,0,0,0,0|2,0,0]=4 15958 B15R1.257 CC(CNCc1cccnc1Cl)C(=O)O 269956a_100000749485_100000045678 [0,2,0,0,0,0|2,0,0]=4 15959 B15R1.257 CC(CNCc1cccnc1F)C(=O)O 269956a_100000749485_100000099810 [0,2,0,0,0,0|2,0,0]=4 15960 B15R1.257 CC(CNCc1ccncc1Cl)C(=O)O 269956a_100000749485_100000763264 [0,2,0,0,0,0|2,0,0]=4 15961 B15R1.257 CC(CNCc1ncccc1Br)C(=O)O 269956a_100000749485_100025702911 [0,2,0,0,0,0|2,0,0]=4 15962 B15R1.257 CC(CNCc1ncccc1Cl)C(=O)O 269956a_100000749485_100000099807 [0,2,0,0,0,0|2,0,0]=4 15963 B15R1.257 CC(CNCc1ncccc1F)C(=O)O 269956a_100000749485_100000104219 [0,2,0,0,0,0|2,0,0]=4 15964 B15R1.257 CC(CNCc1ncccc1O)C(=O)O 269956a_100000749485_200020655725 [0,2,0,0,0,0|2,0,0]=4 15965 B15R1.257 CC(NCCc1ccccc1Br)C(=O)N 2230a_100000747383_100000702099 [0,2,0,0,0,0|2,0,0]=4 15966 B15R1.257 CC(NCCc1ccccc1Br)C(=O)N 34a_100000747383_100000702099 [0,2,0,0,0,0|2,0,0]=4 15967 B15R1.257 CC(NCCc1ccccc1Cl)C(=O)N 2230a_100011207228_100000702099 [0,2,0,0,0,0|2,0,0]=4 15968 B15R1.257 CC(NCCc1ccccc1Cl)C(=O)N 34a_100011207228_100000702099 [0,2,0,0,0,0|2,0,0]=4 15969 B15R1.257 CC(NCCc1ccccc1F)C(=O)N 2230a_100000185272_100000702099 [0,2,0,0,0,0|2,0,0]=4 15970 B15R1.257 CC(NCCc1ccccc1F)C(=O)N 34a_100000185272_100000702099 [0,2,0,0,0,0|2,0,0]=4 15971 B15R1.257 CC(NCCc1ccccc1O)C(=O)N 34a_100011207237_100000702099 [0,2,0,0,0,0|2,0,0]=4 15972 B15R1.257 CC(OCCc1ccccc1Br)C(=O)N 34a_100000731337_100000702099 [0,2,0,0,0,0|2,0,0]=4 15973 B15R1.257 CC(OCCc1ccccc1Br)C(=O)N 7a_100000731337_100000702099 [0,2,0,0,0,0|2,0,0]=4 15974 B15R1.257 CC(OCCc1ccccc1Cl)C(=O)N 34a_100011215284_100000702099 [0,2,0,0,0,0|2,0,0]=4 15975 B15R1.257 CC(OCCc1ccccc1Cl)C(=O)N 7a_100011215284_100000702099 [0,2,0,0,0,0|2,0,0]=4 15976 B15R1.257 CC(OCCc1ccccc1F)C(=O)N 34a_100000753711_100000702099 [0,2,0,0,0,0|2,0,0]=4 15977 B15R1.257 CC(OCCc1ccccc1F)C(=O)N 7a_100000753711_100000702099 [0,2,0,0,0,0|2,0,0]=4 15978 B15R1.257 CC(OCCc1ccccc1I)C(=O)N 34a_100010255290_100000702099 [0,2,0,0,0,0|2,0,0]=4 15979 B15R1.257 CC(OCCc1ccccc1I)C(=O)N 7a_100010255290_100000702099 [0,2,0,0,0,0|2,0,0]=4 15980 B15R1.257 CC(OCCc1ccccc1N)C(=O)N 34a_100011215289_100000702099 [0,2,0,0,0,0|2,0,0]=4 15981 B15R1.257 CC(SCCc1ccccc1Br)C(=O)N 62a_100000702099_100012161201 [0,2,0,0,0,0|2,0,0]=4 15982 B15R1.257 CC(SCCc1ccccc1Br)C(=O)N 62a_100012161201_100000702099 [0,2,0,0,0,0|2,0,0]=4 15983 B15R1.257 CC(SCCc1ccccc1Cl)C(=O)N 62a_100000702099_100011713703 [0,2,0,0,0,0|2,0,0]=4 15984 B15R1.257 CC(SCCc1ccccc1Cl)C(=O)N 62a_100011713703_100000702099 [0,2,0,0,0,0|2,0,0]=4 15985 B15R1.257 CC(SCCc1ccccc1F)C(=O)N 62a_100000702099_100011713696 [0,2,0,0,0,0|2,0,0]=4 15986 B15R1.257 CC(SCCc1ccccc1F)C(=O)N 62a_100011713696_100000702099 [0,2,0,0,0,0|2,0,0]=4 15987 B15R1.257 CC(SCCc1ccccc1O)C(=O)N 62a_100000702099_100000722297 [0,2,0,0,0,0|2,0,0]=4 15988 B15R1.257 CC(SCCc1ccccc1O)C(=O)N 62a_100000722297_100000702099 [0,2,0,0,0,0|2,0,0]=4 15989 B15R1.257 C[C@@H](NCCc1ccccc1Br)C(=O)N 2230a_100000119354_100012161201 [0,2,0,0,0,0|2,0,0]=4 15990 B15R1.257 C[C@@H](NCCc1ccccc1Br)C(=O)N 34a_100000119354_100012161201 [0,2,0,0,0,0|2,0,0]=4 15991 B15R1.257 C[C@@H](NCCc1ccccc1Cl)C(=O)N 2230a_100000119354_100011713703 [0,2,0,0,0,0|2,0,0]=4 15992 B15R1.257 C[C@@H](NCCc1ccccc1Cl)C(=O)N 270004a_100000119354_200011713468 [0,2,0,0,0,0|2,0,0]=4 15993 B15R1.257 C[C@@H](NCCc1ccccc1Cl)C(=O)N 34a_100000119354_100011713703 [0,2,0,0,0,0|2,0,0]=4 15994 B15R1.257 C[C@@H](NCCc1ccccc1F)C(=O)N 2230a_100000119354_100011713696 [0,2,0,0,0,0|2,0,0]=4 15995 B15R1.257 C[C@@H](NCCc1ccccc1F)C(=O)N 34a_100000119354_100000720011 [0,2,0,0,0,0|2,0,0]=4 15996 B15R1.257 C[C@@H](NCCc1ccccc1O)C(=O)N 34a_100000119354_100000722297 [0,2,0,0,0,0|2,0,0]=4 15997 B15R1.257 C[C@@H](OCCc1ccccc1Br)C(=O)N 34a_100000731257_100012161201 [0,2,0,0,0,0|2,0,0]=4 15998 B15R1.257 C[C@@H](OCCc1ccccc1Br)C(=O)N 7a_100000731257_100012161201 [0,2,0,0,0,0|2,0,0]=4 15999 B15R1.257 C[C@@H](OCCc1ccccc1Cl)C(=O)N 34a_100000731257_100011713703 [0,2,0,0,0,0|2,0,0]=4 16000 B15R1.257 C[C@@H](OCCc1ccccc1Cl)C(=O)N 7a_100000731257_100011713703 [0,2,0,0,0,0|2,0,0]=4 16001 B15R1.257 C[C@@H](OCCc1ccccc1F)C(=O)N 34a_100000731257_100000720011 [0,2,0,0,0,0|2,0,0]=4 16002 B15R1.257 C[C@@H](OCCc1ccccc1F)C(=O)N 7a_100000731257_100000720011 [0,2,0,0,0,0|2,0,0]=4 16003 B15R1.257 C[C@@H](OCCc1ccccc1O)C(=O)N 34a_100000731257_100000722297 [0,2,0,0,0,0|2,0,0]=4 16004 B15R1.257 C[C@@H](OCCc1ccccc1O)C(=O)N 7a_100000731257_100000722297 [0,2,0,0,0,0|2,0,0]=4 16005 B15R1.257 C[C@H](NCCc1ccccc1Br)C(=O)O 269956a_100000743915_100012161201 [0,2,0,0,0,0|1,0,0]=3 16006 B15R1.257 C[C@H](NCCc1ccccc1Cl)C(=O)O 269956a_100000743915_100011713703 [0,2,0,0,0,0|1,0,0]=3 16007 B15R1.257 C[C@H](NCCc1ccccc1F)C(=O)O 269956a_100000743915_100011713696 [0,2,0,0,0,0|1,0,0]=3 16008 B15R1.257 C[C@H](NCCc1ccccc1O)C(=O)O 269956a_100000743915_100000722297 [0,2,0,0,0,0|1,0,0]=3 16009 B15R1.257 C[C@H](OCCc1ccccc1Br)C(=O)[O-] 7a_217856618621_100012161201 [0,2,0,0,0,0|1,0,1]=4 16010 B15R1.257 C[C@H](OCCc1ccccc1Cl)C(=O)[O-] 7a_217856618621_100011713703 [0,2,0,0,0,0|1,0,1]=4 16011 B15R1.257 C[C@H](OCCc1ccccc1F)C(=O)[O-] 7a_217856618621_100000720011 [0,2,0,0,0,0|1,0,1]=4 16012 B15R1.257 C[C@H](OCCc1ccccc1O)C(=O)[O-] 7a_217856618621_100000722297 [0,2,0,0,0,0|1,0,1]=4 16013 B15R1.257 Cc1ccccc1CCNC(C)C(=O)N 2230a_100000685071_100000702099 [0,2,0,0,0,0|2,0,0]=4 16014 B15R1.257 Cc1ccccc1CCNC(C)C(=O)N 34a_100000685071_100000702099 [0,2,0,0,0,0|2,0,0]=4 16015 B15R1.257 Cc1ccccc1CCNC(F)C(=O)N 2230a_100000685071_100009813875 [0,2,0,0,0,0|2,0,0]=4 16016 B15R1.257 Cc1ccccc1CCNC(F)C(=O)N 34a_100000685071_100009813875 [0,2,0,0,0,0|2,0,0]=4 16017 B15R1.257 Cc1ccccc1CCNC(F)C(=O)[O-] 34a_100000685071_100020610796 [0,2,0,0,0,0|1,0,1]=4 16018 B15R1.257 Cc1ccccc1CCN[C@@H](C)C(=O)O 269956a_100000743915_100011713688 [0,2,0,0,0,0|1,0,0]=3 16019 B15R1.257 Cc1ccccc1CCN[C@H](C)C(=O)N 2230a_100000119354_100011713688 [0,2,0,0,0,0|2,0,0]=4 16020 B15R1.257 Cc1ccccc1CCN[C@H](C)C(=O)N 34a_100000119354_100011713688 [0,2,0,0,0,0|2,0,0]=4 16021 B15R1.257 Cc1ccccc1CCOC(C)C(=O)N 34a_100011220023_100000702099 [0,2,0,0,0,0|2,0,0]=4 16022 B15R1.257 Cc1ccccc1CCOC(C)C(=O)N 7a_100011220023_100000702099 [0,2,0,0,0,0|2,0,0]=4 16023 B15R1.257 Cc1ccccc1CCOC(F)C(=O)N 34a_100011220023_100009813875 [0,2,0,0,0,0|2,0,0]=4 16024 B15R1.257 Cc1ccccc1CCOC(F)C(=O)N 7a_100011220023_100009813875 [0,2,0,0,0,0|2,0,0]=4 16025 B15R1.257 Cc1ccccc1CCOC(F)C(=O)[O-] 34a_100011220023_100020610796 [0,2,0,0,0,0|1,0,1]=4 16026 B15R1.257 Cc1ccccc1CCO[C@@H](C)C(=O)[O-] 7a_217856618621_100011713688 [0,2,0,0,0,0|1,0,1]=4 16027 B15R1.257 Cc1ccccc1CCO[C@H](C)C(=O)N 34a_100000731257_100011713688 [0,2,0,0,0,0|2,0,0]=4 16028 B15R1.257 Cc1ccccc1CCO[C@H](C)C(=O)N 7a_100000731257_100011713688 [0,2,0,0,0,0|2,0,0]=4 16029 B15R1.257 Cc1ccccc1CCSC(C)C(=O)N 62a_100000702099_100011713688 [0,2,0,0,0,0|2,0,0]=4 16030 B15R1.257 Cc1ccccc1CCSC(C)C(=O)N 62a_100011713688_100000702099 [0,2,0,0,0,0|2,0,0]=4 16031 B15R1.257 Cc1ccccc1CCSC(F)C(=O)N 62a_100009813875_100011713688 [0,2,0,0,0,0|2,0,0]=4 16032 B15R1.257 Cc1ccccc1CCSC(F)C(=O)N 62a_100011713688_100009813875 [0,2,0,0,0,0|2,0,0]=4 16033 B15R1.257 Cc1ccccc1CCSC(F)C(=O)[O-] 62a_100011713688_100020610796 [0,2,0,0,0,0|1,0,1]=4 16034 B15R1.257 Cc1ccccc1CCSC(F)C(=O)[O-] 62a_100020610796_100011713688 [0,2,0,0,0,0|1,0,1]=4 16035 B15R1.257 Cc1ccccc1CNCC(C)C(=O)O 269956a_100000749485_100000211750 [0,2,0,0,0,0|1,0,0]=3 16036 B15R1.257 Cc1ccccc1CNCC(F)C(=O)O 269956a_100000084737_100000211750 [0,2,0,0,0,0|1,0,0]=3 16037 B15R1.257 Cc1ccccc1COC[C@H](N)C(=O)N 34a_100000729942_100000211839 [0,2,0,0,0,0|2,0,0]=4 16038 B15R1.257 Cc1cccnc1CNCC(C)C(=O)O 269956a_100000749485_100000696600 [0,2,0,0,0,0|2,0,0]=4 16039 B15R1.257 Cc1cccnc1CNCC(F)C(=O)O 269956a_100000084737_100000696600 [0,2,0,0,0,0|2,0,0]=4 16040 B15R1.257 Cc1ccncc1CNCC(C)C(=O)O 269956a_100000749485_100000690890 [0,2,0,0,0,0|2,0,0]=4 16041 B15R1.257 Cc1ccncc1CNCC(F)C(=O)O 269956a_100000084737_100000690890 [0,2,0,0,0,0|2,0,0]=4 16042 B15R1.257 Cc1cnccc1CNCC(C)C(=O)O 269956a_100000749485_100020672808 [0,2,0,0,0,0|2,0,0]=4 16043 B15R1.257 Cc1cnccc1CNCC(F)C(=O)O 269956a_100000084737_100020672808 [0,2,0,0,0,0|2,0,0]=4 16044 B15R1.257 Cc1ncccc1CNCC(C)C(=O)O 269956a_100000749485_100000732876 [0,2,0,0,0,0|2,0,0]=4 16045 B15R1.257 Cc1ncccc1CNCC(F)C(=O)O 269956a_100000084737_100000732876 [0,2,0,0,0,0|2,0,0]=4 16046 B15R1.257 NC(=O)C(F)NCCc1ccccc1Br 2230a_100000747383_100009813875 [0,2,0,0,0,0|2,0,0]=4 16047 B15R1.257 NC(=O)C(F)NCCc1ccccc1Br 34a_100000747383_100009813875 [0,2,0,0,0,0|2,0,0]=4 16048 B15R1.257 NC(=O)C(F)NCCc1ccccc1Cl 2230a_100011207228_100009813875 [0,2,0,0,0,0|2,0,0]=4 16049 B15R1.257 NC(=O)C(F)NCCc1ccccc1Cl 34a_100011207228_100009813875 [0,2,0,0,0,0|2,0,0]=4 16050 B15R1.257 NC(=O)C(F)NCCc1ccccc1F 2230a_100000185272_100009813875 [0,2,0,0,0,0|2,0,0]=4 16051 B15R1.257 NC(=O)C(F)NCCc1ccccc1F 34a_100000185272_100009813875 [0,2,0,0,0,0|2,0,0]=4 16052 B15R1.257 NC(=O)C(F)NCCc1ccccc1O 34a_100011207237_100009813875 [0,2,0,0,0,0|2,0,0]=4 16053 B15R1.257 NC(=O)C(F)OCCc1ccccc1Br 34a_100000731337_100009813875 [0,2,0,0,0,0|2,0,0]=4 16054 B15R1.257 NC(=O)C(F)OCCc1ccccc1Br 7a_100000731337_100009813875 [0,2,0,0,0,0|2,0,0]=4 16055 B15R1.257 NC(=O)C(F)OCCc1ccccc1Cl 34a_100011215284_100009813875 [0,2,0,0,0,0|2,0,0]=4 16056 B15R1.257 NC(=O)C(F)OCCc1ccccc1Cl 7a_100011215284_100009813875 [0,2,0,0,0,0|2,0,0]=4 16057 B15R1.257 NC(=O)C(F)OCCc1ccccc1F 34a_100000753711_100009813875 [0,2,0,0,0,0|2,0,0]=4 16058 B15R1.257 NC(=O)C(F)OCCc1ccccc1F 7a_100000753711_100009813875 [0,2,0,0,0,0|2,0,0]=4 16059 B15R1.257 NC(=O)C(F)OCCc1ccccc1I 34a_100010255290_100009813875 [0,2,0,0,0,0|2,0,0]=4 16060 B15R1.257 NC(=O)C(F)OCCc1ccccc1I 7a_100010255290_100009813875 [0,2,0,0,0,0|2,0,0]=4 16061 B15R1.257 NC(=O)C(F)OCCc1ccccc1N 34a_100011215289_100009813875 [0,2,0,0,0,0|2,0,0]=4 16062 B15R1.257 NC(=O)C(F)SCCc1ccccc1Br 62a_100009813875_100012161201 [0,2,0,0,0,0|2,0,0]=4 16063 B15R1.257 NC(=O)C(F)SCCc1ccccc1Br 62a_100012161201_100009813875 [0,2,0,0,0,0|2,0,0]=4 16064 B15R1.257 NC(=O)C(F)SCCc1ccccc1Cl 62a_100009813875_100011713703 [0,2,0,0,0,0|2,0,0]=4 16065 B15R1.257 NC(=O)C(F)SCCc1ccccc1Cl 62a_100011713703_100009813875 [0,2,0,0,0,0|2,0,0]=4 16066 B15R1.257 NC(=O)C(F)SCCc1ccccc1F 62a_100009813875_100011713696 [0,2,0,0,0,0|2,0,0]=4 16067 B15R1.257 NC(=O)C(F)SCCc1ccccc1F 62a_100011713696_100009813875 [0,2,0,0,0,0|2,0,0]=4 16068 B15R1.257 NC(=O)C(F)SCCc1ccccc1O 62a_100000722297_100009813875 [0,2,0,0,0,0|2,0,0]=4 16069 B15R1.257 NC(=O)C(F)SCCc1ccccc1O 62a_100009813875_100000722297 [0,2,0,0,0,0|2,0,0]=4 16070 B15R1.257 NC(=O)[C@@H](N)COCc1ccccc1Br 34a_100000729942_100000184730 [0,2,0,0,0,0|2,0,0]=4 16071 B15R1.257 NC(=O)[C@@H](N)COCc1ccccc1Cl 34a_100000729942_100000187162 [0,2,0,0,0,0|2,0,0]=4 16072 B15R1.257 NC(=O)[C@@H](N)COCc1ccccc1F 34a_100000729942_100000211605 [0,2,0,0,0,0|2,0,0]=4 16073 B15R1.257 NC(=O)[C@@H](N)COCc1ccccc1I 34a_100000729942_100011215278 [0,2,0,0,0,0|2,0,0]=4 16074 B15R1.257 Nc1ccccc1CCOC(F)C(=O)[O-] 34a_100011215289_100020610796 [0,2,0,0,0,0|1,0,1]=4 16075 B15R1.257 O=C(O)C(F)CNCc1ccccc1Br 269956a_100000084737_100000184730 [0,2,0,0,0,0|1,0,0]=3 16076 B15R1.257 O=C(O)C(F)CNCc1ccccc1Cl 269956a_100000084737_100000187162 [0,2,0,0,0,0|1,0,0]=3 16077 B15R1.257 O=C(O)C(F)CNCc1ccccc1F 269956a_100000084737_100000187165 [0,2,0,0,0,0|1,0,0]=3 16078 B15R1.257 O=C(O)C(F)CNCc1ccccc1I 269956a_100000084737_100011216222 [0,2,0,0,0,0|1,0,0]=3 16079 B15R1.257 O=C(O)C(F)CNCc1cccnc1Br 269956a_100000084737_100010140945 [0,2,0,0,0,0|2,0,0]=4 16080 B15R1.257 O=C(O)C(F)CNCc1cccnc1Cl 269956a_100000084737_100000045678 [0,2,0,0,0,0|2,0,0]=4 16081 B15R1.257 O=C(O)C(F)CNCc1cccnc1F 269956a_100000084737_100000099810 [0,2,0,0,0,0|2,0,0]=4 16082 B15R1.257 O=C(O)C(F)CNCc1ccncc1Cl 269956a_100000084737_100000763264 [0,2,0,0,0,0|2,0,0]=4 16083 B15R1.257 O=C(O)C(F)CNCc1ncccc1Br 269956a_100000084737_100025702911 [0,2,0,0,0,0|2,0,0]=4 16084 B15R1.257 O=C(O)C(F)CNCc1ncccc1Cl 269956a_100000084737_100000099807 [0,2,0,0,0,0|2,0,0]=4 16085 B15R1.257 O=C(O)C(F)CNCc1ncccc1F 269956a_100000084737_100000104219 [0,2,0,0,0,0|2,0,0]=4 16086 B15R1.257 O=C(O)C(F)CNCc1ncccc1O 269956a_100000084737_200020655725 [0,2,0,0,0,0|2,0,0]=4 16087 B15R1.257 O=C([O-])C(F)NCCc1ccccc1Br 34a_100000747383_100020610796 [0,2,0,0,0,0|1,0,1]=4 16088 B15R1.257 O=C([O-])C(F)NCCc1ccccc1Cl 34a_100011207228_100020610796 [0,2,0,0,0,0|1,0,1]=4 16089 B15R1.257 O=C([O-])C(F)NCCc1ccccc1F 34a_100000185272_100020610796 [0,2,0,0,0,0|1,0,1]=4 16090 B15R1.257 O=C([O-])C(F)NCCc1ccccc1O 34a_100011207237_100020610796 [0,2,0,0,0,0|1,0,1]=4 16091 B15R1.257 O=C([O-])C(F)OCCc1ccccc1Br 34a_100000731337_100020610796 [0,2,0,0,0,0|1,0,1]=4 16092 B15R1.257 O=C([O-])C(F)OCCc1ccccc1Cl 34a_100011215284_100020610796 [0,2,0,0,0,0|1,0,1]=4 16093 B15R1.257 O=C([O-])C(F)OCCc1ccccc1F 34a_100000753711_100020610796 [0,2,0,0,0,0|1,0,1]=4 16094 B15R1.257 O=C([O-])C(F)OCCc1ccccc1I 34a_100010255290_100020610796 [0,2,0,0,0,0|1,0,1]=4 16095 B15R1.257 O=C([O-])C(F)SCCc1ccccc1Br 62a_100012161201_100020610796 [0,2,0,0,0,0|1,0,1]=4 16096 B15R1.257 O=C([O-])C(F)SCCc1ccccc1Br 62a_100020610796_100012161201 [0,2,0,0,0,0|1,0,1]=4 16097 B15R1.257 O=C([O-])C(F)SCCc1ccccc1Cl 62a_100011713703_100020610796 [0,2,0,0,0,0|1,0,1]=4 16098 B15R1.257 O=C([O-])C(F)SCCc1ccccc1Cl 62a_100020610796_100011713703 [0,2,0,0,0,0|1,0,1]=4 16099 B15R1.257 O=C([O-])C(F)SCCc1ccccc1F 62a_100011713696_100020610796 [0,2,0,0,0,0|1,0,1]=4 16100 B15R1.257 O=C([O-])C(F)SCCc1ccccc1F 62a_100020610796_100011713696 [0,2,0,0,0,0|1,0,1]=4 16101 B15R1.257 O=C([O-])C(F)SCCc1ccccc1O 62a_100000722297_100020610796 [0,2,0,0,0,0|1,0,1]=4 16102 B15R1.257 O=C([O-])C(F)SCCc1ccccc1O 62a_100020610796_100000722297 [0,2,0,0,0,0|1,0,1]=4 16103 B15R1.1091 C#CC(=O)CCCOc1ccccc1Br 1458a_100000211873_200011259276 [0,2,0,0,0,0|2,0,0]=4 16104 B15R1.1091 C#CC(=O)CCCOc1ccccc1C 1458a_100000211873_100000742659 [0,2,0,0,0,0|2,0,0]=4 16105 B15R1.1091 C#CC(=O)CCCOc1ccccc1F 1458a_100000211873_100011203253 [0,2,0,0,0,0|2,0,0]=4 16106 B15R1.1091 C#CC(=O)CCCSc1ccccc1Cl 1458a_100000211873_100000750589 [0,2,0,0,0,0|2,0,0]=4 16107 B15R1.1091 C=CC(=O)CCCOc1ccccc1Br 1458a_100000185746_200011259276 [0,2,0,0,0,0|2,0,0]=4 16108 B15R1.1091 C=CC(=O)CCCOc1ccccc1C 1458a_100000185746_100000742659 [0,2,0,0,0,0|2,0,0]=4 16109 B15R1.1091 C=CC(=O)CCCOc1ccccc1F 1458a_100000185746_100011203253 [0,2,0,0,0,0|2,0,0]=4 16110 B15R1.1091 C=CC(=O)CCCSc1ccccc1Cl 1458a_100000185746_100000750589 [0,2,0,0,0,0|2,0,0]=4 16111 B15R1.1091 C=CC(=O)NCCCc1ccccc1F 1626a_100000724733_100000185746 [0,2,0,0,0,0|2,0,0]=4 16112 B15R1.1091 C=CC(=O)NCCCc1ccccc1F 240690a_100000724733_200121576911 [0,2,0,0,0,0|2,0,0]=4 16113 B15R1.1091 CCC(=O)CCCOc1ccccc1Br 1458a_100000210414_200011259276 [0,2,0,0,0,0|2,0,0]=4 16114 B15R1.1091 CCC(=O)CCCOc1ccccc1C 1458a_100000210414_100000742659 [0,2,0,0,0,0|2,0,0]=4 16115 B15R1.1091 CCC(=O)CCCOc1ccccc1C 1458a_100000735866_100000210202 [0,2,0,0,0,0|2,0,0]=4 16116 B15R1.1091 CCC(=O)CCCOc1ccccc1Cl 1458a_100000747900_100000210202 [0,2,0,0,0,0|2,0,0]=4 16117 B15R1.1091 CCC(=O)CCCOc1ccccc1F 1458a_100000210414_100011203253 [0,2,0,0,0,0|2,0,0]=4 16118 B15R1.1091 CCC(=O)CCCSc1ccccc1Cl 1458a_100000210414_100000750589 [0,2,0,0,0,0|2,0,0]=4 16119 B15R1.1091 CCC(=O)COCCc1ccccc1Br 34a_100000725409_100012161201 [0,2,0,0,0,0|2,0,0]=4 16120 B15R1.1091 CCC(=O)COCCc1ccccc1Br 7a_100000731337_100000747405 [0,2,0,0,0,0|2,0,0]=4 16121 B15R1.1091 CCC(=O)COCCc1ccccc1C 34a_100000725409_100011713688 [0,2,0,0,0,0|2,0,0]=4 16122 B15R1.1091 CCC(=O)COCCc1ccccc1C 7a_100011220023_100000747405 [0,2,0,0,0,0|2,0,0]=4 16123 B15R1.1091 CCC(=O)COCCc1ccccc1Cl 34a_100000725409_100011713703 [0,2,0,0,0,0|2,0,0]=4 16124 B15R1.1091 CCC(=O)COCCc1ccccc1Cl 7a_100011215284_100000747405 [0,2,0,0,0,0|2,0,0]=4 16125 B15R1.1091 CCC(=O)COCCc1ccccc1F 34a_100000725409_100000720011 [0,2,0,0,0,0|2,0,0]=4 16126 B15R1.1091 CCC(=O)COCCc1ccccc1F 7a_100000753711_100000747405 [0,2,0,0,0,0|2,0,0]=4 16127 B15R1.1091 CCC(=O)COCCc1ccccc1I 7a_100010255290_100000747405 [0,2,0,0,0,0|2,0,0]=4 16128 B15R1.1091 CCC(=O)COCCc1ccccc1O 34a_100000725409_100000722297 [0,2,0,0,0,0|2,0,0]=4 16129 B15R1.1091 CCC(=O)CSCCc1ccccc1Br 62a_100000747405_100012161201 [0,2,0,0,0,0|2,0,0]=4 16130 B15R1.1091 CCC(=O)CSCCc1ccccc1Br 62a_100012161201_100000747405 [0,2,0,0,0,0|2,0,0]=4 16131 B15R1.1091 CCC(=O)CSCCc1ccccc1C 62a_100000747405_100011713688 [0,2,0,0,0,0|2,0,0]=4 16132 B15R1.1091 CCC(=O)CSCCc1ccccc1C 62a_100011713688_100000747405 [0,2,0,0,0,0|2,0,0]=4 16133 B15R1.1091 CCC(=O)CSCCc1ccccc1Cl 62a_100000747405_100011713703 [0,2,0,0,0,0|2,0,0]=4 16134 B15R1.1091 CCC(=O)CSCCc1ccccc1Cl 62a_100011713703_100000747405 [0,2,0,0,0,0|2,0,0]=4 16135 B15R1.1091 CCC(=O)CSCCc1ccccc1F 62a_100000747405_100011713696 [0,2,0,0,0,0|2,0,0]=4 16136 B15R1.1091 CCC(=O)CSCCc1ccccc1F 62a_100011713696_100000747405 [0,2,0,0,0,0|2,0,0]=4 16137 B15R1.1091 CCC(=O)CSCCc1ccccc1O 62a_100000722297_100000747405 [0,2,0,0,0,0|2,0,0]=4 16138 B15R1.1091 CCC(=O)CSCCc1ccccc1O 62a_100000747405_100000722297 [0,2,0,0,0,0|2,0,0]=4 16139 B15R1.1091 CCC(=O)NCCCc1ccccc1F 11a_100000724733_100000210414 [0,2,0,0,0,0|2,0,0]=4 16140 B15R1.1091 CCC(=O)NCCCc1ccccc1F 1626a_100000724733_100000210414 [0,2,0,0,0,0|2,0,0]=4 16141 B15R1.1091 CCC(=O)NCCCc1ccccc1F 240690a_100000724733_100000210414 [0,2,0,0,0,0|2,0,0]=4 16142 B15R1.1091 CCC(=O)NCCCc1ccccc1F 527a_100000724733_100000210414 [0,2,0,0,0,0|2,0,0]=4 16143 B15R1.1091 CNC(=O)CCCNc1ccccc1Br 34a_100000210017_100000741757 [0,2,0,0,0,0|2,0,0]=4 16144 B15R1.1091 CNC(=O)CCCNc1ccccc1C 34a_100015192222_100000741757 [0,2,0,0,0,0|2,0,0]=4 16145 B15R1.1091 CNC(=O)CCCNc1ccccc1Cl 34a_100000185783_100000741757 [0,2,0,0,0,0|2,0,0]=4 16146 B15R1.1091 CNC(=O)CCCNc1ccccc1F 34a_100000210422_100000741757 [0,2,0,0,0,0|2,0,0]=4 16147 B15R1.1091 CNC(=O)CCCNc1ccccc1I 34a_100000210053_100000741757 [0,2,0,0,0,0|2,0,0]=4 16148 B15R1.1091 CNC(=O)CCCNc1ccccc1O 34a_100000185747_100000741757 [0,2,0,0,0,0|2,0,0]=4 16149 B15R1.1091 CNC(=O)CCCOc1ccccc1Br 34a_100000181306_100000741757 [0,2,0,0,0,0|2,0,0]=4 16150 B15R1.1091 CNC(=O)CCCOc1ccccc1Br 7a_100000181306_100000741757 [0,2,0,0,0,0|2,0,0]=4 16151 B15R1.1091 CNC(=O)CCCOc1ccccc1C 11a_106832991635_100000735866 [0,2,0,0,0,0|2,0,0]=4 16152 B15R1.1091 CNC(=O)CCCOc1ccccc1C 1626a_100102657272_100000735866 [0,2,0,0,0,0|2,0,0]=4 16153 B15R1.1091 CNC(=O)CCCOc1ccccc1C 240690a_100102657272_100000735866 [0,2,0,0,0,0|2,0,0]=4 16154 B15R1.1091 CNC(=O)CCCOc1ccccc1C 34a_100000210338_100000741757 [0,2,0,0,0,0|2,0,0]=4 16155 B15R1.1091 CNC(=O)CCCOc1ccccc1C 527a_100102657272_100000735866 [0,2,0,0,0,0|2,0,0]=4 16156 B15R1.1091 CNC(=O)CCCOc1ccccc1C 7a_100000210338_100000741757 [0,2,0,0,0,0|2,0,0]=4 16157 B15R1.1091 CNC(=O)CCCOc1ccccc1Cl 11a_106832991635_100000747900 [0,2,0,0,0,0|2,0,0]=4 16158 B15R1.1091 CNC(=O)CCCOc1ccccc1Cl 1626a_100102657272_100000747900 [0,2,0,0,0,0|2,0,0]=4 16159 B15R1.1091 CNC(=O)CCCOc1ccccc1Cl 240690a_100102657272_100000747900 [0,2,0,0,0,0|2,0,0]=4 16160 B15R1.1091 CNC(=O)CCCOc1ccccc1Cl 34a_100000210172_100000741757 [0,2,0,0,0,0|2,0,0]=4 16161 B15R1.1091 CNC(=O)CCCOc1ccccc1Cl 527a_100102657272_100000747900 [0,2,0,0,0,0|2,0,0]=4 16162 B15R1.1091 CNC(=O)CCCOc1ccccc1Cl 7a_100000210172_100000741757 [0,2,0,0,0,0|2,0,0]=4 16163 B15R1.1091 CNC(=O)CCCOc1ccccc1F 34a_100000210171_100000741757 [0,2,0,0,0,0|2,0,0]=4 16164 B15R1.1091 CNC(=O)CCCOc1ccccc1F 7a_100000210171_100000741757 [0,2,0,0,0,0|2,0,0]=4 16165 B15R1.1091 CNC(=O)CCCOc1ccccc1I 34a_100000739446_100000741757 [0,2,0,0,0,0|2,0,0]=4 16166 B15R1.1091 CNC(=O)CCCOc1ccccc1I 7a_100000739446_100000741757 [0,2,0,0,0,0|2,0,0]=4 16167 B15R1.1091 CNC(=O)CCCOc1ccccc1N 34a_100000185747_100000741757 [0,2,0,0,0,0|2,0,0]=4 16168 B15R1.1091 CNC(=O)CCCOc1ccccc1N 7a_100000185747_100000741757 [0,2,0,0,0,0|2,0,0]=4 16169 B15R1.1091 CNC(=O)CCCSc1ccccc1Br 62a_100000695589_100000741757 [0,2,0,0,0,0|2,0,0]=4 16170 B15R1.1091 CNC(=O)CCCSc1ccccc1Br 62a_100000741757_100000695589 [0,2,0,0,0,0|2,0,0]=4 16171 B15R1.1091 CNC(=O)CCCSc1ccccc1C 62a_100000210755_100000741757 [0,2,0,0,0,0|2,0,0]=4 16172 B15R1.1091 CNC(=O)CCCSc1ccccc1C 62a_100000741757_100000210755 [0,2,0,0,0,0|2,0,0]=4 16173 B15R1.1091 CNC(=O)CCCSc1ccccc1Cl 62a_100000741757_100000764095 [0,2,0,0,0,0|2,0,0]=4 16174 B15R1.1091 CNC(=O)CCCSc1ccccc1Cl 62a_100000764095_100000741757 [0,2,0,0,0,0|2,0,0]=4 16175 B15R1.1091 CNC(=O)CCCSc1ccccc1F 62a_100000741757_100011215700 [0,2,0,0,0,0|2,0,0]=4 16176 B15R1.1091 CNC(=O)CCCSc1ccccc1F 62a_100011215700_100000741757 [0,2,0,0,0,0|2,0,0]=4 16177 B15R1.1091 CNC(=O)CCCSc1ccccc1N 62a_100000210017_100000741757 [0,2,0,0,0,0|2,0,0]=4 16178 B15R1.1091 CNC(=O)CCCSc1ccccc1N 62a_100000741757_100000210017 [0,2,0,0,0,0|2,0,0]=4 16179 B15R1.1091 CNC(=O)CCCSc1ccccc1O 62a_100000739446_100000741757 [0,2,0,0,0,0|2,0,0]=4 16180 B15R1.1091 CNC(=O)CCCSc1ccccc1O 62a_100000741757_100000739446 [0,2,0,0,0,0|2,0,0]=4 16181 B15R1.1091 CNC(=O)CCNCc1ccccc1Br 207a_100000738227_100000211189 [0,2,0,0,0,0|2,0,0]=4 16182 B15R1.1091 CNC(=O)CCNCc1ccccc1Br 2230a_100000689332_100000737683 [0,2,0,0,0,0|2,0,0]=4 16183 B15R1.1091 CNC(=O)CCNCc1ccccc1Br 2230a_100000738227_100000184730 [0,2,0,0,0,0|2,0,0]=4 16184 B15R1.1091 CNC(=O)CCNCc1ccccc1Br 270004a_100000738227_100000211189 [0,2,0,0,0,0|2,0,0]=4 16185 B15R1.1091 CNC(=O)CCNCc1ccccc1Br 34a_100000689332_100012179268 [0,2,0,0,0,0|2,0,0]=4 16186 B15R1.1091 CNC(=O)CCNCc1ccccc1Br 34a_100000738227_100000184730 [0,2,0,0,0,0|2,0,0]=4 16187 B15R1.1091 CNC(=O)CCNCc1ccccc1C 207a_100000738227_100000211143 [0,2,0,0,0,0|2,0,0]=4 16188 B15R1.1091 CNC(=O)CCNCc1ccccc1C 2230a_100000738227_100000211839 [0,2,0,0,0,0|2,0,0]=4 16189 B15R1.1091 CNC(=O)CCNCc1ccccc1C 270004a_100000738227_100000211143 [0,2,0,0,0,0|2,0,0]=4 16190 B15R1.1091 CNC(=O)CCNCc1ccccc1C 34a_100000174972_100012179268 [0,2,0,0,0,0|2,0,0]=4 16191 B15R1.1091 CNC(=O)CCNCc1ccccc1C 34a_100000738227_100000211839 [0,2,0,0,0,0|2,0,0]=4 16192 B15R1.1091 CNC(=O)CCNCc1ccccc1Cl 207a_100000738227_100000210073 [0,2,0,0,0,0|2,0,0]=4 16193 B15R1.1091 CNC(=O)CCNCc1ccccc1Cl 2230a_100000174879_100000737683 [0,2,0,0,0,0|2,0,0]=4 16194 B15R1.1091 CNC(=O)CCNCc1ccccc1Cl 2230a_100000738227_100000187162 [0,2,0,0,0,0|2,0,0]=4 16195 B15R1.1091 CNC(=O)CCNCc1ccccc1Cl 270004a_100000738227_100000210073 [0,2,0,0,0,0|2,0,0]=4 16196 B15R1.1091 CNC(=O)CCNCc1ccccc1Cl 34a_100000174879_100012179268 [0,2,0,0,0,0|2,0,0]=4 16197 B15R1.1091 CNC(=O)CCNCc1ccccc1Cl 34a_100000738227_100000187162 [0,2,0,0,0,0|2,0,0]=4 16198 B15R1.1091 CNC(=O)CCNCc1ccccc1F 207a_100000738227_100000210811 [0,2,0,0,0,0|2,0,0]=4 16199 B15R1.1091 CNC(=O)CCNCc1ccccc1F 2230a_100000738227_100000211605 [0,2,0,0,0,0|2,0,0]=4 16200 B15R1.1091 CNC(=O)CCNCc1ccccc1F 270004a_100000738227_100000210811 [0,2,0,0,0,0|2,0,0]=4 16201 B15R1.1091 CNC(=O)CCNCc1ccccc1F 34a_100000174869_100012179268 [0,2,0,0,0,0|2,0,0]=4 16202 B15R1.1091 CNC(=O)CCNCc1ccccc1F 34a_100000738227_100000211605 [0,2,0,0,0,0|2,0,0]=4 16203 B15R1.1091 CNC(=O)CCNCc1ccccc1I 207a_100000738227_100000010305 [0,2,0,0,0,0|2,0,0]=4 16204 B15R1.1091 CNC(=O)CCNCc1ccccc1I 2230a_100000738227_100011215278 [0,2,0,0,0,0|2,0,0]=4 16205 B15R1.1091 CNC(=O)CCNCc1ccccc1I 270004a_100000738227_100000010305 [0,2,0,0,0,0|2,0,0]=4 16206 B15R1.1091 CNC(=O)CCNCc1ccccc1I 34a_100000738227_100011215278 [0,2,0,0,0,0|2,0,0]=4 16207 B15R1.1091 CNC(=O)CCNCc1ccccc1O 34a_100000185550_100012179268 [0,2,0,0,0,0|2,0,0]=4 16208 B15R1.1091 CNC(=O)CCOCc1ccccc1Br 34a_100000754576_100000184730 [0,2,0,0,0,0|2,0,0]=4 16209 B15R1.1091 CNC(=O)CCOCc1ccccc1Br 34a_100000756307_100012179268 [0,2,0,0,0,0|2,0,0]=4 16210 B15R1.1091 CNC(=O)CCOCc1ccccc1Br 7a_100000756307_100000737683 [0,2,0,0,0,0|2,0,0]=4 16211 B15R1.1091 CNC(=O)CCOCc1ccccc1C 34a_100000698903_100012179268 [0,2,0,0,0,0|2,0,0]=4 16212 B15R1.1091 CNC(=O)CCOCc1ccccc1C 34a_100000754576_100000211839 [0,2,0,0,0,0|2,0,0]=4 16213 B15R1.1091 CNC(=O)CCOCc1ccccc1C 7a_100000698903_100000737683 [0,2,0,0,0,0|2,0,0]=4 16214 B15R1.1091 CNC(=O)CCOCc1ccccc1Cl 34a_100000210847_100012179268 [0,2,0,0,0,0|2,0,0]=4 16215 B15R1.1091 CNC(=O)CCOCc1ccccc1Cl 34a_100000754576_100000187162 [0,2,0,0,0,0|2,0,0]=4 16216 B15R1.1091 CNC(=O)CCOCc1ccccc1Cl 7a_100000210847_100000737683 [0,2,0,0,0,0|2,0,0]=4 16217 B15R1.1091 CNC(=O)CCOCc1ccccc1F 34a_100000211962_100012179268 [0,2,0,0,0,0|2,0,0]=4 16218 B15R1.1091 CNC(=O)CCOCc1ccccc1F 34a_100000754576_100000211605 [0,2,0,0,0,0|2,0,0]=4 16219 B15R1.1091 CNC(=O)CCOCc1ccccc1F 7a_100000211962_100000737683 [0,2,0,0,0,0|2,0,0]=4 16220 B15R1.1091 CNC(=O)CCOCc1ccccc1I 34a_100000187465_100012179268 [0,2,0,0,0,0|2,0,0]=4 16221 B15R1.1091 CNC(=O)CCOCc1ccccc1I 34a_100000754576_100011215278 [0,2,0,0,0,0|2,0,0]=4 16222 B15R1.1091 CNC(=O)CCOCc1ccccc1I 7a_100000187465_100000737683 [0,2,0,0,0,0|2,0,0]=4 16223 B15R1.1091 CNC(=O)CCOCc1ccccc1N 34a_100000212039_100012179268 [0,2,0,0,0,0|2,0,0]=4 16224 B15R1.1091 CNC(=O)CCSCc1ccccc1Br 62a_100000184730_100000737683 [0,2,0,0,0,0|2,0,0]=4 16225 B15R1.1091 CNC(=O)CCSCc1ccccc1Br 62a_100000737683_100000184730 [0,2,0,0,0,0|2,0,0]=4 16226 B15R1.1091 CNC(=O)CCSCc1ccccc1C 62a_100000211839_100000737683 [0,2,0,0,0,0|2,0,0]=4 16227 B15R1.1091 CNC(=O)CCSCc1ccccc1C 62a_100000737683_100000211839 [0,2,0,0,0,0|2,0,0]=4 16228 B15R1.1091 CNC(=O)CCSCc1ccccc1Cl 62a_100000187162_100000737683 [0,2,0,0,0,0|2,0,0]=4 16229 B15R1.1091 CNC(=O)CCSCc1ccccc1Cl 62a_100000737683_100000187162 [0,2,0,0,0,0|2,0,0]=4 16230 B15R1.1091 CNC(=O)CCSCc1ccccc1F 62a_100000211605_100000737683 [0,2,0,0,0,0|2,0,0]=4 16231 B15R1.1091 CNC(=O)CCSCc1ccccc1F 62a_100000737683_100000211605 [0,2,0,0,0,0|2,0,0]=4 16232 B15R1.1091 CNC(=O)CCSCc1ccccc1I 62a_100000737683_100011216222 [0,2,0,0,0,0|2,0,0]=4 16233 B15R1.1091 CNC(=O)CCSCc1ccccc1I 62a_100011216222_100000737683 [0,2,0,0,0,0|2,0,0]=4 16234 B15R1.1091 CNC(=O)CNCCc1ccccc1Br 2230a_100000693194_100012161201 [0,2,0,0,0,0|2,0,0]=4 16235 B15R1.1091 CNC(=O)CNCCc1ccccc1Br 2230a_100000747383_100000183359 [0,2,0,0,0,0|2,0,0]=4 16236 B15R1.1091 CNC(=O)CNCCc1ccccc1Br 34a_100000747383_100000183359 [0,2,0,0,0,0|2,0,0]=4 16237 B15R1.1091 CNC(=O)CNCCc1ccccc1C 2230a_100000685071_100000183359 [0,2,0,0,0,0|2,0,0]=4 16238 B15R1.1091 CNC(=O)CNCCc1ccccc1C 2230a_100000693194_100011713688 [0,2,0,0,0,0|2,0,0]=4 16239 B15R1.1091 CNC(=O)CNCCc1ccccc1C 34a_100000685071_100000183359 [0,2,0,0,0,0|2,0,0]=4 16240 B15R1.1091 CNC(=O)CNCCc1ccccc1Cl 2230a_100000693194_100011713703 [0,2,0,0,0,0|2,0,0]=4 16241 B15R1.1091 CNC(=O)CNCCc1ccccc1Cl 2230a_100011207228_100000183359 [0,2,0,0,0,0|2,0,0]=4 16242 B15R1.1091 CNC(=O)CNCCc1ccccc1Cl 270004a_100000693194_200011713468 [0,2,0,0,0,0|2,0,0]=4 16243 B15R1.1091 CNC(=O)CNCCc1ccccc1Cl 34a_100011207228_100000183359 [0,2,0,0,0,0|2,0,0]=4 16244 B15R1.1091 CNC(=O)CNCCc1ccccc1F 2230a_100000185272_100000183359 [0,2,0,0,0,0|2,0,0]=4 16245 B15R1.1091 CNC(=O)CNCCc1ccccc1F 2230a_100000693194_100011713696 [0,2,0,0,0,0|2,0,0]=4 16246 B15R1.1091 CNC(=O)CNCCc1ccccc1F 34a_100000185272_100000183359 [0,2,0,0,0,0|2,0,0]=4 16247 B15R1.1091 CNC(=O)CNCCc1ccccc1O 34a_100011207237_100000183359 [0,2,0,0,0,0|2,0,0]=4 16248 B15R1.1091 CNC(=O)COCCc1ccccc1Br 34a_100000731337_100000183359 [0,2,0,0,0,0|2,0,0]=4 16249 B15R1.1091 CNC(=O)COCCc1ccccc1Br 34a_100000750040_100012161201 [0,2,0,0,0,0|2,0,0]=4 16250 B15R1.1091 CNC(=O)COCCc1ccccc1Br 7a_100000731337_100000183359 [0,2,0,0,0,0|2,0,0]=4 16251 B15R1.1091 CNC(=O)COCCc1ccccc1C 34a_100000750040_100011713688 [0,2,0,0,0,0|2,0,0]=4 16252 B15R1.1091 CNC(=O)COCCc1ccccc1C 34a_100011220023_100000183359 [0,2,0,0,0,0|2,0,0]=4 16253 B15R1.1091 CNC(=O)COCCc1ccccc1C 7a_100011220023_100000183359 [0,2,0,0,0,0|2,0,0]=4 16254 B15R1.1091 CNC(=O)COCCc1ccccc1Cl 34a_100000750040_100011713703 [0,2,0,0,0,0|2,0,0]=4 16255 B15R1.1091 CNC(=O)COCCc1ccccc1Cl 34a_100011215284_100000183359 [0,2,0,0,0,0|2,0,0]=4 16256 B15R1.1091 CNC(=O)COCCc1ccccc1Cl 7a_100011215284_100000183359 [0,2,0,0,0,0|2,0,0]=4 16257 B15R1.1091 CNC(=O)COCCc1ccccc1F 34a_100000750040_100000720011 [0,2,0,0,0,0|2,0,0]=4 16258 B15R1.1091 CNC(=O)COCCc1ccccc1F 34a_100000753711_100000183359 [0,2,0,0,0,0|2,0,0]=4 16259 B15R1.1091 CNC(=O)COCCc1ccccc1F 7a_100000753711_100000183359 [0,2,0,0,0,0|2,0,0]=4 16260 B15R1.1091 CNC(=O)COCCc1ccccc1I 34a_100010255290_100000183359 [0,2,0,0,0,0|2,0,0]=4 16261 B15R1.1091 CNC(=O)COCCc1ccccc1I 7a_100010255290_100000183359 [0,2,0,0,0,0|2,0,0]=4 16262 B15R1.1091 CNC(=O)COCCc1ccccc1N 34a_100011215289_100000183359 [0,2,0,0,0,0|2,0,0]=4 16263 B15R1.1091 CNC(=O)COCCc1ccccc1O 34a_100000750040_100000722297 [0,2,0,0,0,0|2,0,0]=4 16264 B15R1.1091 CNC(=O)CSCCc1ccccc1Br 62a_100000183359_100012161201 [0,2,0,0,0,0|2,0,0]=4 16265 B15R1.1091 CNC(=O)CSCCc1ccccc1Br 62a_100012161201_100000183359 [0,2,0,0,0,0|2,0,0]=4 16266 B15R1.1091 CNC(=O)CSCCc1ccccc1C 62a_100000183359_100011713688 [0,2,0,0,0,0|2,0,0]=4 16267 B15R1.1091 CNC(=O)CSCCc1ccccc1C 62a_100011713688_100000183359 [0,2,0,0,0,0|2,0,0]=4 16268 B15R1.1091 CNC(=O)CSCCc1ccccc1Cl 62a_100000183359_100011713703 [0,2,0,0,0,0|2,0,0]=4 16269 B15R1.1091 CNC(=O)CSCCc1ccccc1Cl 62a_100011713703_100000183359 [0,2,0,0,0,0|2,0,0]=4 16270 B15R1.1091 CNC(=O)CSCCc1ccccc1F 62a_100000183359_100011713696 [0,2,0,0,0,0|2,0,0]=4 16271 B15R1.1091 CNC(=O)CSCCc1ccccc1F 62a_100011713696_100000183359 [0,2,0,0,0,0|2,0,0]=4 16272 B15R1.1091 CNC(=O)CSCCc1ccccc1O 62a_100000183359_100000722297 [0,2,0,0,0,0|2,0,0]=4 16273 B15R1.1091 CNC(=O)CSCCc1ccccc1O 62a_100000722297_100000183359 [0,2,0,0,0,0|2,0,0]=4 16274 B15R1.1091 CNC(=O)NCCCc1ccccc1F 2708a_100000724733_106832991635 [0,2,0,0,0,0|2,0,0]=4 16275 B15R1.1091 CNC(=O)NCCCc1ccccc1F 2708a_100102657272_100000724733 [0,2,0,0,0,0|2,0,0]=4 16276 B15R1.1091 CNC(=O)NCCCc1ccccc1F 273464a_100000724733_100102657272 [0,2,0,0,0,0|2,0,0]=4 16277 B15R1.1091 CNC(=O)NCCCc1ccccc1F 273464a_100102657272_100000724733 [0,2,0,0,0,0|2,0,0]=4 16278 B15R1.1091 CNC(=O)NCCCc1ccccc1F 512a_100000724733_100102657272 [0,2,0,0,0,0|2,0,0]=4 16279 B15R1.1091 CNC(=O)NCCCc1ccccc1F 512a_106832991638_100000724733 [0,2,0,0,0,0|2,0,0]=4 16280 B15R1.1091 COC(=O)CCCNc1ccccc1Br 34a_100000210017_100000742333 [0,2,0,0,0,0|1,0,0]=3 16281 B15R1.1091 COC(=O)CCCNc1ccccc1C 34a_100015192222_100000742333 [0,2,0,0,0,0|1,0,0]=3 16282 B15R1.1091 COC(=O)CCCNc1ccccc1Cl 34a_100000185783_100000742333 [0,2,0,0,0,0|1,0,0]=3 16283 B15R1.1091 COC(=O)CCCNc1ccccc1F 34a_100000210422_100000742333 [0,2,0,0,0,0|1,0,0]=3 16284 B15R1.1091 COC(=O)CCCNc1ccccc1I 34a_100000210053_100000742333 [0,2,0,0,0,0|1,0,0]=3 16285 B15R1.1091 COC(=O)CCCNc1ccccc1O 34a_100000185747_100000742333 [0,2,0,0,0,0|1,0,0]=3 16286 B15R1.1091 COC(=O)CCCOc1cccc[n+]1[O-] 7a_100000211761_100011218270 [0,2,0,0,0,0|2,0,0]=4 16287 B15R1.1091 COC(=O)CCCOc1ccccc1Br 34a_100000181306_100000742333 [0,2,0,0,0,0|1,0,0]=3 16288 B15R1.1091 COC(=O)CCCOc1ccccc1Br 7a_100000181306_100011218270 [0,2,0,0,0,0|1,0,0]=3 16289 B15R1.1091 COC(=O)CCCOc1ccccc1C 34a_100000210338_100000742333 [0,2,0,0,0,0|1,0,0]=3 16290 B15R1.1091 COC(=O)CCCOc1ccccc1C 7a_100000210338_100011218270 [0,2,0,0,0,0|1,0,0]=3 16291 B15R1.1091 COC(=O)CCCOc1ccccc1Cl 34a_100000210172_100000742333 [0,2,0,0,0,0|1,0,0]=3 16292 B15R1.1091 COC(=O)CCCOc1ccccc1Cl 7a_100000210172_100011218270 [0,2,0,0,0,0|1,0,0]=3 16293 B15R1.1091 COC(=O)CCCOc1ccccc1F 34a_100000210171_100000742333 [0,2,0,0,0,0|1,0,0]=3 16294 B15R1.1091 COC(=O)CCCOc1ccccc1F 7a_100000210171_100011218270 [0,2,0,0,0,0|1,0,0]=3 16295 B15R1.1091 COC(=O)CCCOc1ccccc1I 34a_100000739446_100000742333 [0,2,0,0,0,0|1,0,0]=3 16296 B15R1.1091 COC(=O)CCCOc1ccccc1I 7a_100000739446_100011218270 [0,2,0,0,0,0|1,0,0]=3 16297 B15R1.1091 COC(=O)CCCOc1ccccc1N 34a_100000185747_100000742333 [0,2,0,0,0,0|1,0,0]=3 16298 B15R1.1091 COC(=O)CCCOc1ccccc1N 7a_100000185747_100011218270 [0,2,0,0,0,0|1,0,0]=3 16299 B15R1.1091 COC(=O)CCCOc1cccnc1Br 34a_100000744436_100000742333 [0,2,0,0,0,0|2,0,0]=4 16300 B15R1.1091 COC(=O)CCCOc1cccnc1Br 7a_100000744436_100011218270 [0,2,0,0,0,0|2,0,0]=4 16301 B15R1.1091 COC(=O)CCCOc1cccnc1C 34a_100000745507_100000742333 [0,2,0,0,0,0|2,0,0]=4 16302 B15R1.1091 COC(=O)CCCOc1cccnc1C 7a_100000745507_100011218270 [0,2,0,0,0,0|2,0,0]=4 16303 B15R1.1091 COC(=O)CCCOc1cccnc1Cl 34a_100000757616_100000742333 [0,2,0,0,0,0|2,0,0]=4 16304 B15R1.1091 COC(=O)CCCOc1cccnc1Cl 7a_100000757616_100011218270 [0,2,0,0,0,0|2,0,0]=4 16305 B15R1.1091 COC(=O)CCCOc1cccnc1F 34a_100000061740_100000742333 [0,2,0,0,0,0|2,0,0]=4 16306 B15R1.1091 COC(=O)CCCOc1cccnc1F 7a_100000061740_100011218270 [0,2,0,0,0,0|2,0,0]=4 16307 B15R1.1091 COC(=O)CCCOc1cccnc1I 34a_100000034122_100000742333 [0,2,0,0,0,0|2,0,0]=4 16308 B15R1.1091 COC(=O)CCCOc1cccnc1I 7a_100000034122_100011218270 [0,2,0,0,0,0|2,0,0]=4 16309 B15R1.1091 COC(=O)CCCOc1cccnc1N 34a_100000211975_100000742333 [0,2,0,0,0,0|2,0,0]=4 16310 B15R1.1091 COC(=O)CCCOc1cccnc1N 7a_100000211975_100011218270 [0,2,0,0,0,0|2,0,0]=4 16311 B15R1.1091 COC(=O)CCCOc1cccoc1=O 34a_100000077404_100000742333 [0,2,0,0,0,0|2,0,0]=4 16312 B15R1.1091 COC(=O)CCCOc1cccoc1=O 7a_100000077404_100011218270 [0,2,0,0,0,0|2,0,0]=4 16313 B15R1.1091 COC(=O)CCCOc1ccncc1Br 34a_100011996408_100000742333 [0,2,0,0,0,0|2,0,0]=4 16314 B15R1.1091 COC(=O)CCCOc1ccncc1C 34a_100000694293_100000742333 [0,2,0,0,0,0|2,0,0]=4 16315 B15R1.1091 COC(=O)CCCOc1ccncc1Cl 34a_100011997054_100000742333 [0,2,0,0,0,0|2,0,0]=4 16316 B15R1.1091 COC(=O)CCCOc1ccncc1F 34a_200000081243_100000742333 [0,2,0,0,0,0|2,0,0]=4 16317 B15R1.1091 COC(=O)CCCOc1cnccc1C 34a_100011997053_100000742333 [0,2,0,0,0,0|2,0,0]=4 16318 B15R1.1091 COC(=O)CCCOc1cnccc1C 7a_100011997053_100011218270 [0,2,0,0,0,0|2,0,0]=4 16319 B15R1.1091 COC(=O)CCCOc1cnccc1Cl 34a_100011996695_100000742333 [0,2,0,0,0,0|2,0,0]=4 16320 B15R1.1091 COC(=O)CCCOc1cnccc1I 34a_100000050107_100000742333 [0,2,0,0,0,0|2,0,0]=4 16321 B15R1.1091 COC(=O)CCCOc1cnccc1N 34a_100000753702_100000742333 [0,2,0,0,0,0|2,0,0]=4 16322 B15R1.1091 COC(=O)CCCOc1coccc1=O 34a_100000060831_100000742333 [0,2,0,0,0,0|2,0,0]=4 16323 B15R1.1091 COC(=O)CCCOc1ncccc1Cl 34a_100011290957_100000742333 [0,2,0,0,0,0|2,0,0]=4 16324 B15R1.1091 COC(=O)CCCOc1ncccc1F 34a_100011219419_100000742333 [0,2,0,0,0,0|2,0,0]=4 16325 B15R1.1091 COC(=O)CCCOc1ncccc1N 34a_100000746358_100000742333 [0,2,0,0,0,0|2,0,0]=4 16326 B15R1.1091 COC(=O)CCCSc1c[nH]ccc1=O 62a_100009998708_100011218270 [0,2,0,0,0,0|2,0,0]=4 16327 B15R1.1091 COC(=O)CCCSc1c[nH]ccc1=O 62a_100011218270_100009998708 [0,2,0,0,0,0|2,0,0]=4 16328 B15R1.1091 COC(=O)CCCSc1c[nH]ccc1=S 62a_100011218270_200012280681 [0,2,0,0,0,0|2,0,0]=4 16329 B15R1.1091 COC(=O)CCCSc1c[nH]ccc1=S 62a_200012280681_100011218270 [0,2,0,0,0,0|2,0,0]=4 16330 B15R1.1091 COC(=O)CCCSc1cccc[n+]1C 62a_100011218270_100000212160 [0,2,0,0,0,0|2,0,0]=4 16331 B15R1.1091 COC(=O)CCCSc1cccc[n+]1[O-] 62a_100011218270_200000042595 [0,2,0,0,0,0|2,0,0]=4 16332 B15R1.1091 COC(=O)CCCSc1ccccc1Br 62a_100000695589_100011218270 [0,2,0,0,0,0|1,0,0]=3 16333 B15R1.1091 COC(=O)CCCSc1ccccc1Br 62a_100011218270_100000695589 [0,2,0,0,0,0|1,0,0]=3 16334 B15R1.1091 COC(=O)CCCSc1ccccc1C 62a_100000210755_100011218270 [0,2,0,0,0,0|1,0,0]=3 16335 B15R1.1091 COC(=O)CCCSc1ccccc1C 62a_100011218270_100000210755 [0,2,0,0,0,0|1,0,0]=3 16336 B15R1.1091 COC(=O)CCCSc1ccccc1Cl 62a_100000764095_100011218270 [0,2,0,0,0,0|1,0,0]=3 16337 B15R1.1091 COC(=O)CCCSc1ccccc1Cl 62a_100011218270_100000764095 [0,2,0,0,0,0|1,0,0]=3 16338 B15R1.1091 COC(=O)CCCSc1ccccc1F 62a_100011215700_100011218270 [0,2,0,0,0,0|1,0,0]=3 16339 B15R1.1091 COC(=O)CCCSc1ccccc1F 62a_100011218270_100011215700 [0,2,0,0,0,0|1,0,0]=3 16340 B15R1.1091 COC(=O)CCCSc1ccccc1N 62a_100000210017_100011218270 [0,2,0,0,0,0|1,0,0]=3 16341 B15R1.1091 COC(=O)CCCSc1ccccc1N 62a_100011218270_100000210017 [0,2,0,0,0,0|1,0,0]=3 16342 B15R1.1091 COC(=O)CCCSc1ccccc1O 62a_100000739446_100011218270 [0,2,0,0,0,0|1,0,0]=3 16343 B15R1.1091 COC(=O)CCCSc1ccccc1O 62a_100011218270_100000739446 [0,2,0,0,0,0|1,0,0]=3 16344 B15R1.1091 COC(=O)CCCSc1cccnc1Br 62a_100010202626_100011218270 [0,2,0,0,0,0|2,0,0]=4 16345 B15R1.1091 COC(=O)CCCSc1cccnc1Br 62a_100011218270_100010202626 [0,2,0,0,0,0|2,0,0]=4 16346 B15R1.1091 COC(=O)CCCSc1cccnc1C 62a_100000751574_100011218270 [0,2,0,0,0,0|2,0,0]=4 16347 B15R1.1091 COC(=O)CCCSc1cccnc1C 62a_100011218270_100000751574 [0,2,0,0,0,0|2,0,0]=4 16348 B15R1.1091 COC(=O)CCCSc1cccnc1Cl 62a_100000036424_100011218270 [0,2,0,0,0,0|2,0,0]=4 16349 B15R1.1091 COC(=O)CCCSc1cccnc1Cl 62a_100011218270_100000036424 [0,2,0,0,0,0|2,0,0]=4 16350 B15R1.1091 COC(=O)CCCSc1cccnc1F 62a_100009816115_100011218270 [0,2,0,0,0,0|2,0,0]=4 16351 B15R1.1091 COC(=O)CCCSc1cccnc1F 62a_100011218270_100009816115 [0,2,0,0,0,0|2,0,0]=4 16352 B15R1.1091 COC(=O)CCCSc1cccnc1N 62a_100000045569_100011218270 [0,2,0,0,0,0|2,0,0]=4 16353 B15R1.1091 COC(=O)CCCSc1cccnc1N 62a_100011218270_100000045569 [0,2,0,0,0,0|2,0,0]=4 16354 B15R1.1091 COC(=O)CCCSc1cccnc1O 62a_100000760158_100011218270 [0,2,0,0,0,0|2,0,0]=4 16355 B15R1.1091 COC(=O)CCCSc1cccnc1O 62a_100011218270_100000760158 [0,2,0,0,0,0|2,0,0]=4 16356 B15R1.1091 COC(=O)CCCSc1ccncc1Br 62a_100000726257_100011218270 [0,2,0,0,0,0|2,0,0]=4 16357 B15R1.1091 COC(=O)CCCSc1ccncc1Br 62a_100011218270_100000726257 [0,2,0,0,0,0|2,0,0]=4 16358 B15R1.1091 COC(=O)CCCSc1ccncc1C 62a_100000765111_100011218270 [0,2,0,0,0,0|2,0,0]=4 16359 B15R1.1091 COC(=O)CCCSc1ccncc1C 62a_100011218270_100000765111 [0,2,0,0,0,0|2,0,0]=4 16360 B15R1.1091 COC(=O)CCCSc1ccncc1Cl 62a_100000708259_100011218270 [0,2,0,0,0,0|2,0,0]=4 16361 B15R1.1091 COC(=O)CCCSc1ccncc1Cl 62a_100011218270_100000708259 [0,2,0,0,0,0|2,0,0]=4 16362 B15R1.1091 COC(=O)CCCSc1ccncc1F 62a_100000047030_100011218270 [0,2,0,0,0,0|2,0,0]=4 16363 B15R1.1091 COC(=O)CCCSc1ccncc1F 62a_100011218270_100000047030 [0,2,0,0,0,0|2,0,0]=4 16364 B15R1.1091 COC(=O)CCCSc1ccncc1N 62a_100000756074_100011218270 [0,2,0,0,0,0|2,0,0]=4 16365 B15R1.1091 COC(=O)CCCSc1ccncc1N 62a_100011218270_100000756074 [0,2,0,0,0,0|2,0,0]=4 16366 B15R1.1091 COC(=O)CCCSc1ccncc1O 62a_100009817591_100011218270 [0,2,0,0,0,0|2,0,0]=4 16367 B15R1.1091 COC(=O)CCCSc1ccncc1O 62a_100011218270_100009817591 [0,2,0,0,0,0|2,0,0]=4 16368 B15R1.1091 COC(=O)CCCSc1cnccc1Br 62a_100010138639_100011218270 [0,2,0,0,0,0|2,0,0]=4 16369 B15R1.1091 COC(=O)CCCSc1cnccc1Br 62a_100011218270_100010138639 [0,2,0,0,0,0|2,0,0]=4 16370 B15R1.1091 COC(=O)CCCSc1cnccc1C 62a_100000761580_100011218270 [0,2,0,0,0,0|2,0,0]=4 16371 B15R1.1091 COC(=O)CCCSc1cnccc1C 62a_100011218270_100000761580 [0,2,0,0,0,0|2,0,0]=4 16372 B15R1.1091 COC(=O)CCCSc1cnccc1Cl 62a_100009995489_100011218270 [0,2,0,0,0,0|2,0,0]=4 16373 B15R1.1091 COC(=O)CCCSc1cnccc1Cl 62a_100011218270_100009995489 [0,2,0,0,0,0|2,0,0]=4 16374 B15R1.1091 COC(=O)CCCSc1cnccc1F 62a_100009820683_100011218270 [0,2,0,0,0,0|2,0,0]=4 16375 B15R1.1091 COC(=O)CCCSc1cnccc1F 62a_100011218270_100009820683 [0,2,0,0,0,0|2,0,0]=4 16376 B15R1.1091 COC(=O)CCCSc1cnccc1N 62a_100000047001_100011218270 [0,2,0,0,0,0|2,0,0]=4 16377 B15R1.1091 COC(=O)CCCSc1cnccc1N 62a_100011218270_100000047001 [0,2,0,0,0,0|2,0,0]=4 16378 B15R1.1091 COC(=O)CCCSc1ncccc1Br 62a_100000696092_100011218270 [0,2,0,0,0,0|2,0,0]=4 16379 B15R1.1091 COC(=O)CCCSc1ncccc1Br 62a_100011218270_100000696092 [0,2,0,0,0,0|2,0,0]=4 16380 B15R1.1091 COC(=O)CCCSc1ncccc1C 62a_100000751373_100011218270 [0,2,0,0,0,0|2,0,0]=4 16381 B15R1.1091 COC(=O)CCCSc1ncccc1C 62a_100011218270_100000751373 [0,2,0,0,0,0|2,0,0]=4 16382 B15R1.1091 COC(=O)CCCSc1ncccc1Cl 62a_100011218270_100011356963 [0,2,0,0,0,0|2,0,0]=4 16383 B15R1.1091 COC(=O)CCCSc1ncccc1Cl 62a_100011356963_100011218270 [0,2,0,0,0,0|2,0,0]=4 16384 B15R1.1091 COC(=O)CCCSc1ncccc1F 62a_100000685392_100011218270 [0,2,0,0,0,0|2,0,0]=4 16385 B15R1.1091 COC(=O)CCCSc1ncccc1F 62a_100011218270_100000685392 [0,2,0,0,0,0|2,0,0]=4 16386 B15R1.1091 COC(=O)CCCSc1ncccc1N 62a_100000688686_100011218270 [0,2,0,0,0,0|2,0,0]=4 16387 B15R1.1091 COC(=O)CCCSc1ncccc1N 62a_100011218270_100000688686 [0,2,0,0,0,0|2,0,0]=4 16388 B15R1.1091 COC(=O)CCCSc1ncccc1O 62a_100000034122_100011218270 [0,2,0,0,0,0|2,0,0]=4 16389 B15R1.1091 COC(=O)CCCSc1ncccc1O 62a_100011218270_100000034122 [0,2,0,0,0,0|2,0,0]=4 16390 B15R1.1091 COC(=O)CCNCc1ccccc1Br 2230a_100000689332_100000204255 [0,2,0,0,0,0|1,0,0]=3 16391 B15R1.1091 COC(=O)CCNCc1ccccc1Br 34a_100000689332_100000742370 [0,2,0,0,0,0|1,0,0]=3 16392 B15R1.1091 COC(=O)CCNCc1ccccc1C 34a_100000174972_100000742370 [0,2,0,0,0,0|1,0,0]=3 16393 B15R1.1091 COC(=O)CCNCc1ccccc1Cl 2230a_100000174879_100000204255 [0,2,0,0,0,0|1,0,0]=3 16394 B15R1.1091 COC(=O)CCNCc1ccccc1Cl 34a_100000174879_100000742370 [0,2,0,0,0,0|1,0,0]=3 16395 B15R1.1091 COC(=O)CCNCc1ccccc1F 34a_100000174869_100000742370 [0,2,0,0,0,0|1,0,0]=3 16396 B15R1.1091 COC(=O)CCNCc1ccccc1O 34a_100000185550_100000742370 [0,2,0,0,0,0|1,0,0]=3 16397 B15R1.1091 COC(=O)CCNCc1cccnc1Br 2230a_100009818023_100000204255 [0,2,0,0,0,0|2,0,0]=4 16398 B15R1.1091 COC(=O)CCNCc1cccnc1Br 34a_100009818023_100000742370 [0,2,0,0,0,0|2,0,0]=4 16399 B15R1.1091 COC(=O)CCNCc1cccnc1Cl 2230a_100015189234_100000204255 [0,2,0,0,0,0|2,0,0]=4 16400 B15R1.1091 COC(=O)CCNCc1cccnc1Cl 34a_100015189234_100000742370 [0,2,0,0,0,0|2,0,0]=4 16401 B15R1.1091 COC(=O)CCNCc1cccnc1F 34a_100000724633_100000742370 [0,2,0,0,0,0|2,0,0]=4 16402 B15R1.1091 COC(=O)CCNCc1ccncc1F 34a_100011935246_100000742370 [0,2,0,0,0,0|2,0,0]=4 16403 B15R1.1091 COC(=O)CCNCc1ncccc1C 34a_100011223789_100000742370 [0,2,0,0,0,0|2,0,0]=4 16404 B15R1.1091 COC(=O)CCNCc1ncccc1Cl 2230a_100015189233_100000204255 [0,2,0,0,0,0|2,0,0]=4 16405 B15R1.1091 COC(=O)CCNCc1ncccc1F 34a_100000690088_100000742370 [0,2,0,0,0,0|2,0,0]=4 16406 B15R1.1091 COC(=O)CCOCc1ccccc1Br 34a_100000756307_100000742370 [0,2,0,0,0,0|1,0,0]=3 16407 B15R1.1091 COC(=O)CCOCc1ccccc1Br 7a_100000756307_100000204255 [0,2,0,0,0,0|1,0,0]=3 16408 B15R1.1091 COC(=O)CCOCc1ccccc1C 34a_100000698903_100000742370 [0,2,0,0,0,0|1,0,0]=3 16409 B15R1.1091 COC(=O)CCOCc1ccccc1C 7a_100000698903_100000204255 [0,2,0,0,0,0|1,0,0]=3 16410 B15R1.1091 COC(=O)CCOCc1ccccc1Cl 34a_100000210847_100000742370 [0,2,0,0,0,0|1,0,0]=3 16411 B15R1.1091 COC(=O)CCOCc1ccccc1Cl 7a_100000210847_100000204255 [0,2,0,0,0,0|1,0,0]=3 16412 B15R1.1091 COC(=O)CCOCc1ccccc1F 34a_100000211962_100000742370 [0,2,0,0,0,0|1,0,0]=3 16413 B15R1.1091 COC(=O)CCOCc1ccccc1F 7a_100000211962_100000204255 [0,2,0,0,0,0|1,0,0]=3 16414 B15R1.1091 COC(=O)CCOCc1ccccc1I 34a_100000187465_100000742370 [0,2,0,0,0,0|1,0,0]=3 16415 B15R1.1091 COC(=O)CCOCc1ccccc1I 7a_100000187465_100000204255 [0,2,0,0,0,0|1,0,0]=3 16416 B15R1.1091 COC(=O)CCOCc1ccccc1N 34a_100000212039_100000742370 [0,2,0,0,0,0|1,0,0]=3 16417 B15R1.1091 COC(=O)CCOCc1cccnc1Br 34a_100000719692_100000742370 [0,2,0,0,0,0|2,0,0]=4 16418 B15R1.1091 COC(=O)CCOCc1cccnc1Br 7a_100000719692_100000204255 [0,2,0,0,0,0|2,0,0]=4 16419 B15R1.1091 COC(=O)CCOCc1cccnc1C 34a_100000729262_100000742370 [0,2,0,0,0,0|2,0,0]=4 16420 B15R1.1091 COC(=O)CCOCc1cccnc1C 7a_100000729262_100000204255 [0,2,0,0,0,0|2,0,0]=4 16421 B15R1.1091 COC(=O)CCOCc1cccnc1Cl 34a_100000748726_100000742370 [0,2,0,0,0,0|2,0,0]=4 16422 B15R1.1091 COC(=O)CCOCc1cccnc1Cl 7a_100000748726_100000204255 [0,2,0,0,0,0|2,0,0]=4 16423 B15R1.1091 COC(=O)CCOCc1cccnc1F 34a_100000079888_100000742370 [0,2,0,0,0,0|2,0,0]=4 16424 B15R1.1091 COC(=O)CCOCc1cccnc1F 7a_100000079888_100000204255 [0,2,0,0,0,0|2,0,0]=4 16425 B15R1.1091 COC(=O)CCOCc1ccncc1C 34a_100011997032_100000742370 [0,2,0,0,0,0|2,0,0]=4 16426 B15R1.1091 COC(=O)CCOCc1ccncc1F 34a_100012172863_100000742370 [0,2,0,0,0,0|2,0,0]=4 16427 B15R1.1091 COC(=O)CCOCc1cnccc1C 34a_100011996381_100000742370 [0,2,0,0,0,0|2,0,0]=4 16428 B15R1.1091 COC(=O)CCOCc1cnccc1Cl 34a_100000117392_100000742370 [0,2,0,0,0,0|2,0,0]=4 16429 B15R1.1091 COC(=O)CCOCc1ncccc1Br 34a_100011996772_100000742370 [0,2,0,0,0,0|2,0,0]=4 16430 B15R1.1091 COC(=O)CCOCc1ncccc1C 34a_100000698912_100000742370 [0,2,0,0,0,0|2,0,0]=4 16431 B15R1.1091 COC(=O)CCOCc1ncccc1Cl 34a_100012002383_100000742370 [0,2,0,0,0,0|2,0,0]=4 16432 B15R1.1091 COC(=O)CCOCc1ncccc1F 34a_100011934865_100000742370 [0,2,0,0,0,0|2,0,0]=4 16433 B15R1.1091 COC(=O)CCOCc1ncccc1N 34a_114873767017_100000742370 [0,2,0,0,0,0|2,0,0]=4 16434 B15R1.1091 COC(=O)CCSCc1ccccc1Br 62a_100000184730_100000204255 [0,2,0,0,0,0|1,0,0]=3 16435 B15R1.1091 COC(=O)CCSCc1ccccc1Br 62a_100000204255_100000184730 [0,2,0,0,0,0|1,0,0]=3 16436 B15R1.1091 COC(=O)CCSCc1ccccc1C 62a_100000204255_100000211839 [0,2,0,0,0,0|1,0,0]=3 16437 B15R1.1091 COC(=O)CCSCc1ccccc1C 62a_100000211839_100000204255 [0,2,0,0,0,0|1,0,0]=3 16438 B15R1.1091 COC(=O)CCSCc1ccccc1Cl 62a_100000187162_100000204255 [0,2,0,0,0,0|1,0,0]=3 16439 B15R1.1091 COC(=O)CCSCc1ccccc1Cl 62a_100000204255_100000187162 [0,2,0,0,0,0|1,0,0]=3 16440 B15R1.1091 COC(=O)CCSCc1ccccc1F 62a_100000204255_100000211605 [0,2,0,0,0,0|1,0,0]=3 16441 B15R1.1091 COC(=O)CCSCc1ccccc1F 62a_100000211605_100000204255 [0,2,0,0,0,0|1,0,0]=3 16442 B15R1.1091 COC(=O)CCSCc1ccccc1I 62a_100000204255_100011216222 [0,2,0,0,0,0|1,0,0]=3 16443 B15R1.1091 COC(=O)CCSCc1ccccc1I 62a_100011216222_100000204255 [0,2,0,0,0,0|1,0,0]=3 16444 B15R1.1091 COC(=O)CCSCc1cccnc1Br 62a_100000204255_100010140945 [0,2,0,0,0,0|2,0,0]=4 16445 B15R1.1091 COC(=O)CCSCc1cccnc1Br 62a_100010140945_100000204255 [0,2,0,0,0,0|2,0,0]=4 16446 B15R1.1091 COC(=O)CCSCc1cccnc1C 62a_100000204255_100000732876 [0,2,0,0,0,0|2,0,0]=4 16447 B15R1.1091 COC(=O)CCSCc1cccnc1C 62a_100000732876_100000204255 [0,2,0,0,0,0|2,0,0]=4 16448 B15R1.1091 COC(=O)CCSCc1cccnc1Cl 62a_100000045678_100000204255 [0,2,0,0,0,0|2,0,0]=4 16449 B15R1.1091 COC(=O)CCSCc1cccnc1Cl 62a_100000204255_100000045678 [0,2,0,0,0,0|2,0,0]=4 16450 B15R1.1091 COC(=O)CCSCc1cccnc1F 62a_100000099810_100000204255 [0,2,0,0,0,0|2,0,0]=4 16451 B15R1.1091 COC(=O)CCSCc1cccnc1F 62a_100000204255_100000099810 [0,2,0,0,0,0|2,0,0]=4 16452 B15R1.1091 COC(=O)CCSCc1ccncc1C 62a_100000204255_100020672808 [0,2,0,0,0,0|2,0,0]=4 16453 B15R1.1091 COC(=O)CCSCc1ccncc1C 62a_100020672808_100000204255 [0,2,0,0,0,0|2,0,0]=4 16454 B15R1.1091 COC(=O)CCSCc1ccncc1Cl 62a_100000204255_100000763264 [0,2,0,0,0,0|2,0,0]=4 16455 B15R1.1091 COC(=O)CCSCc1ccncc1Cl 62a_100000763264_100000204255 [0,2,0,0,0,0|2,0,0]=4 16456 B15R1.1091 COC(=O)CCSCc1cnccc1C 62a_100000204255_100000690890 [0,2,0,0,0,0|2,0,0]=4 16457 B15R1.1091 COC(=O)CCSCc1cnccc1C 62a_100000690890_100000204255 [0,2,0,0,0,0|2,0,0]=4 16458 B15R1.1091 COC(=O)CCSCc1ncccc1Br 62a_100000204255_100025702911 [0,2,0,0,0,0|2,0,0]=4 16459 B15R1.1091 COC(=O)CCSCc1ncccc1Br 62a_100025702911_100000204255 [0,2,0,0,0,0|2,0,0]=4 16460 B15R1.1091 COC(=O)CCSCc1ncccc1C 62a_100000204255_100000696600 [0,2,0,0,0,0|2,0,0]=4 16461 B15R1.1091 COC(=O)CCSCc1ncccc1C 62a_100000696600_100000204255 [0,2,0,0,0,0|2,0,0]=4 16462 B15R1.1091 COC(=O)CCSCc1ncccc1Cl 62a_100000099807_100000204255 [0,2,0,0,0,0|2,0,0]=4 16463 B15R1.1091 COC(=O)CCSCc1ncccc1Cl 62a_100000204255_100000099807 [0,2,0,0,0,0|2,0,0]=4 16464 B15R1.1091 COC(=O)CCSCc1ncccc1F 62a_100000104219_100000204255 [0,2,0,0,0,0|2,0,0]=4 16465 B15R1.1091 COC(=O)CCSCc1ncccc1F 62a_100000204255_100000104219 [0,2,0,0,0,0|2,0,0]=4 16466 B15R1.1091 COC(=O)CCSCc1ncccc1O 62a_100000204255_200020655725 [0,2,0,0,0,0|2,0,0]=4 16467 B15R1.1091 COC(=O)CCSCc1ncccc1O 62a_200020655725_100000204255 [0,2,0,0,0,0|2,0,0]=4 16468 B15R1.1091 COC(=O)CNCCc1ccccc1Br 2230a_100000747383_100000747449 [0,2,0,0,0,0|1,0,0]=3 16469 B15R1.1091 COC(=O)CNCCc1ccccc1Br 34a_100000747383_100000747449 [0,2,0,0,0,0|1,0,0]=3 16470 B15R1.1091 COC(=O)CNCCc1ccccc1C 2230a_100000685071_100000747449 [0,2,0,0,0,0|1,0,0]=3 16471 B15R1.1091 COC(=O)CNCCc1ccccc1C 34a_100000685071_100000747449 [0,2,0,0,0,0|1,0,0]=3 16472 B15R1.1091 COC(=O)CNCCc1ccccc1Cl 2230a_100011207228_100000747449 [0,2,0,0,0,0|1,0,0]=3 16473 B15R1.1091 COC(=O)CNCCc1ccccc1Cl 34a_100011207228_100000747449 [0,2,0,0,0,0|1,0,0]=3 16474 B15R1.1091 COC(=O)CNCCc1ccccc1F 2230a_100000185272_100000747449 [0,2,0,0,0,0|1,0,0]=3 16475 B15R1.1091 COC(=O)CNCCc1ccccc1F 34a_100000185272_100000747449 [0,2,0,0,0,0|1,0,0]=3 16476 B15R1.1091 COC(=O)CNCCc1ccccc1O 34a_100011207237_100000747449 [0,2,0,0,0,0|1,0,0]=3 16477 B15R1.1091 COC(=O)CNCCn1ccccc1=O 2230a_100000687133_100000747449 [0,2,0,0,0,0|2,0,0]=4 16478 B15R1.1091 COC(=O)COCCc1ccccc1Br 34a_100000731337_100000747449 [0,2,0,0,0,0|1,0,0]=3 16479 B15R1.1091 COC(=O)COCCc1ccccc1Br 7a_100000731337_100000747449 [0,2,0,0,0,0|1,0,0]=3 16480 B15R1.1091 COC(=O)COCCc1ccccc1C 34a_100011220023_100000747449 [0,2,0,0,0,0|1,0,0]=3 16481 B15R1.1091 COC(=O)COCCc1ccccc1C 7a_100011220023_100000747449 [0,2,0,0,0,0|1,0,0]=3 16482 B15R1.1091 COC(=O)COCCc1ccccc1Cl 34a_100011215284_100000747449 [0,2,0,0,0,0|1,0,0]=3 16483 B15R1.1091 COC(=O)COCCc1ccccc1Cl 7a_100011215284_100000747449 [0,2,0,0,0,0|1,0,0]=3 16484 B15R1.1091 COC(=O)COCCc1ccccc1F 34a_100000753711_100000747449 [0,2,0,0,0,0|1,0,0]=3 16485 B15R1.1091 COC(=O)COCCc1ccccc1F 7a_100000753711_100000747449 [0,2,0,0,0,0|1,0,0]=3 16486 B15R1.1091 COC(=O)COCCc1ccccc1I 34a_100010255290_100000747449 [0,2,0,0,0,0|1,0,0]=3 16487 B15R1.1091 COC(=O)COCCc1ccccc1I 7a_100010255290_100000747449 [0,2,0,0,0,0|1,0,0]=3 16488 B15R1.1091 COC(=O)COCCc1ccccc1N 34a_100011215289_100000747449 [0,2,0,0,0,0|1,0,0]=3 16489 B15R1.1091 COC(=O)COCCc1ncccc1C 34a_100011997706_100000747449 [0,2,0,0,0,0|2,0,0]=4 16490 B15R1.1091 COC(=O)COCCc1ncccc1C 7a_100011997706_100000747449 [0,2,0,0,0,0|2,0,0]=4 16491 B15R1.1091 COC(=O)CSCCc1ccccc1Br 62a_100000747449_100012161201 [0,2,0,0,0,0|1,0,0]=3 16492 B15R1.1091 COC(=O)CSCCc1ccccc1Br 62a_100012161201_100000747449 [0,2,0,0,0,0|1,0,0]=3 16493 B15R1.1091 COC(=O)CSCCc1ccccc1C 62a_100000747449_100011713688 [0,2,0,0,0,0|1,0,0]=3 16494 B15R1.1091 COC(=O)CSCCc1ccccc1C 62a_100011713688_100000747449 [0,2,0,0,0,0|1,0,0]=3 16495 B15R1.1091 COC(=O)CSCCc1ccccc1Cl 62a_100000747449_100011713703 [0,2,0,0,0,0|1,0,0]=3 16496 B15R1.1091 COC(=O)CSCCc1ccccc1Cl 62a_100011713703_100000747449 [0,2,0,0,0,0|1,0,0]=3 16497 B15R1.1091 COC(=O)CSCCc1ccccc1F 62a_100000747449_100011713696 [0,2,0,0,0,0|1,0,0]=3 16498 B15R1.1091 COC(=O)CSCCc1ccccc1F 62a_100011713696_100000747449 [0,2,0,0,0,0|1,0,0]=3 16499 B15R1.1091 COC(=O)CSCCc1ccccc1O 62a_100000722297_100000747449 [0,2,0,0,0,0|1,0,0]=3 16500 B15R1.1091 COC(=O)CSCCc1ccccc1O 62a_100000747449_100000722297 [0,2,0,0,0,0|1,0,0]=3 16501 B15R1.1091 COC(=O)OCSCc1ccccc1Br 62a_100000184730_100000139417 [0,2,0,0,0,0|2,0,0]=4 16502 B15R1.1091 COC(=O)OCSCc1ccccc1C 62a_100000211839_100000139417 [0,2,0,0,0,0|2,0,0]=4 16503 B15R1.1091 COC(=O)OCSCc1ccccc1Cl 62a_100000187162_100000139417 [0,2,0,0,0,0|2,0,0]=4 16504 B15R1.1091 COC(=O)OCSCc1ccccc1F 62a_100000211605_100000139417 [0,2,0,0,0,0|2,0,0]=4 16505 B15R1.1091 COC(=O)OCSCc1ccccc1I 62a_100011216222_100000139417 [0,2,0,0,0,0|2,0,0]=4 16506 B15R1.1091 Cc1ccccc1COCCC(=NO)N 34a_100000749954_100000211839 [0,2,0,0,0,0|2,0,0]=4 16507 B15R1.1091 Cc1ccccc1OCCCC(=O)CF 1458a_100000735866_100015361967 [0,2,0,0,0,0|2,0,0]=4 16508 B15R1.1091 Cc1ccccc1OCCCC(=O)CO 1458a_100000210174_100000742659 [0,2,0,0,0,0|1,0,0]=3 16509 B15R1.1091 Cc1ccccc1OCCNC(=O)CO 240690a_100000743344_100000210174 [0,2,0,0,0,0|2,0,0]=4 16510 B15R1.1091 Cc1ccccc1OCCNC(=O)CO 527a_100000743344_100000210174 [0,2,0,0,0,0|2,0,0]=4 16511 B15R1.1091 NC(=NO)CCOCc1ccccc1Br 34a_100000749954_100000184730 [0,2,0,0,0,0|2,0,0]=4 16512 B15R1.1091 NC(=NO)CCOCc1ccccc1Cl 34a_100000749954_100000187162 [0,2,0,0,0,0|2,0,0]=4 16513 B15R1.1091 NC(=NO)CCOCc1ccccc1F 34a_100000749954_100000211605 [0,2,0,0,0,0|2,0,0]=4 16514 B15R1.1091 NC(=NO)CCOCc1ccccc1I 34a_100000749954_100011215278 [0,2,0,0,0,0|2,0,0]=4 16515 B15R1.1091 O=C(CF)CCCOc1ccccc1Cl 1458a_100000747900_100015361967 [0,2,0,0,0,0|2,0,0]=4 16516 B15R1.1091 O=C(CO)CCCOc1ccccc1Br 1458a_100000210174_200011259276 [0,2,0,0,0,0|1,0,0]=3 16517 B15R1.1091 O=C(CO)CCCOc1ccccc1F 1458a_100000210174_100011203253 [0,2,0,0,0,0|1,0,0]=3 16518 B15R1.1091 O=C(CO)CCCSc1ccccc1Cl 1458a_100000210174_100000750589 [0,2,0,0,0,0|1,0,0]=3 16519 B15R1.1091 O=C(CO)NCCCc1ccccc1F 240690a_100000724733_100000210174 [0,2,0,0,0,0|1,0,0]=3 16520 B15R1.1091 O=C(CO)NCCCc1ccccc1F 527a_100000724733_100000210174 [0,2,0,0,0,0|1,0,0]=3 16521 B15R1.1091 O=C(CO)NCCOc1ccccc1Br 240690a_100000744007_100000210174 [0,2,0,0,0,0|2,0,0]=4 16522 B15R1.1091 O=C(CO)NCCOc1ccccc1Br 527a_100000744007_100000210174 [0,2,0,0,0,0|2,0,0]=4 16523 B15R1.1091 O=C(CO)NCCOc1ccccc1Cl 240690a_100000174932_100000210174 [0,2,0,0,0,0|2,0,0]=4 16524 B15R1.1091 O=C(CO)NCCOc1ccccc1Cl 527a_100000174932_100000210174 [0,2,0,0,0,0|2,0,0]=4 16525 B15R1.1091 O=C(CO)NCCOc1ccccc1F 240690a_100000683764_100000210174 [0,2,0,0,0,0|2,0,0]=4 16526 B15R1.1091 O=C(CO)NCCOc1ccccc1F 527a_100000683764_100000210174 [0,2,0,0,0,0|2,0,0]=4 16527 B15R1.5821 CC(=O)CCCNc1ccc(cc1Br)Br 34a_100000211012_100000685027 [0,2,0,0,0,0|2,0,0]=4 16528 B15R1.5821 CC(=O)CCCNc1ccc(cc1Br)C 34a_100000210942_100000685027 [0,2,0,0,0,0|2,0,0]=4 16529 B15R1.5821 CC(=O)CCCNc1ccc(cc1Br)Cl 34a_100000752454_100000685027 [0,2,0,0,0,0|2,0,0]=4 16530 B15R1.5821 CC(=O)CCCNc1ccc(cc1Br)F 34a_100000738039_100000685027 [0,2,0,0,0,0|2,0,0]=4 16531 B15R1.5821 CC(=O)CCCNc1ccc(cc1Br)O 34a_100012001276_100000685027 [0,2,0,0,0,0|2,0,0]=4 16532 B15R1.5821 CC(=O)CCCNc1ccc(cc1C)Br 34a_100000211769_100000685027 [0,2,0,0,0,0|2,0,0]=4 16533 B15R1.5821 CC(=O)CCCNc1ccc(cc1C)Br 7a_100000211769_100011215641 [0,2,0,0,0,0|2,0,0]=4 16534 B15R1.5821 CC(=O)CCCNc1ccc(cc1C)C 34a_100000736561_100000685027 [0,2,0,0,0,0|2,0,0]=4 16535 B15R1.5821 CC(=O)CCCNc1ccc(cc1C)C 7a_100000736561_100011215641 [0,2,0,0,0,0|2,0,0]=4 16536 B15R1.5821 CC(=O)CCCNc1ccc(cc1C)Cl 34a_100000210418_100000685027 [0,2,0,0,0,0|2,0,0]=4 16537 B15R1.5821 CC(=O)CCCNc1ccc(cc1C)Cl 7a_100000210418_100011215641 [0,2,0,0,0,0|2,0,0]=4 16538 B15R1.5821 CC(=O)CCCNc1ccc(cc1C)F 34a_100000211637_100000685027 [0,2,0,0,0,0|2,0,0]=4 16539 B15R1.5821 CC(=O)CCCNc1ccc(cc1C)F 7a_100000211637_100011215641 [0,2,0,0,0,0|2,0,0]=4 16540 B15R1.5821 CC(=O)CCCNc1ccc(cc1C)I 34a_100000184554_100000685027 [0,2,0,0,0,0|2,0,0]=4 16541 B15R1.5821 CC(=O)CCCNc1ccc(cc1C)I 7a_100000184554_100011215641 [0,2,0,0,0,0|2,0,0]=4 16542 B15R1.5821 CC(=O)CCCNc1ccc(cc1C)O 34a_100000756630_100000685027 [0,2,0,0,0,0|2,0,0]=4 16543 B15R1.5821 CC(=O)CCCNc1ccc(cc1Cl)Br 34a_100000211467_100000685027 [0,2,0,0,0,0|2,0,0]=4 16544 B15R1.5821 CC(=O)CCCNc1ccc(cc1Cl)C 34a_100000210522_100000685027 [0,2,0,0,0,0|2,0,0]=4 16545 B15R1.5821 CC(=O)CCCNc1ccc(cc1Cl)Cl 34a_100000185861_100000685027 [0,2,0,0,0,0|2,0,0]=4 16546 B15R1.5821 CC(=O)CCCNc1ccc(cc1Cl)F 34a_100000212003_100000685027 [0,2,0,0,0,0|2,0,0]=4 16547 B15R1.5821 CC(=O)CCCNc1ccc(cc1Cl)I 34a_100011218065_100000685027 [0,2,0,0,0,0|2,0,0]=4 16548 B15R1.5821 CC(=O)CCCNc1ccc(cc1Cl)O 34a_100011215599_100000685027 [0,2,0,0,0,0|2,0,0]=4 16549 B15R1.5821 CC(=O)CCCNc1ccc(cc1F)Br 34a_100000210722_100000685027 [0,2,0,0,0,0|2,0,0]=4 16550 B15R1.5821 CC(=O)CCCNc1ccc(cc1F)C 34a_100000211023_100000685027 [0,2,0,0,0,0|2,0,0]=4 16551 B15R1.5821 CC(=O)CCCNc1ccc(cc1F)Cl 34a_100000211020_100000685027 [0,2,0,0,0,0|2,0,0]=4 16552 B15R1.5821 CC(=O)CCCNc1ccc(cc1F)F 34a_100000210720_100000685027 [0,2,0,0,0,0|2,0,0]=4 16553 B15R1.5821 CC(=O)CCCNc1ccc(cc1F)I 34a_100011215594_100000685027 [0,2,0,0,0,0|2,0,0]=4 16554 B15R1.5821 CC(=O)CCCNc1ccc(cc1F)O 34a_100000759473_100000685027 [0,2,0,0,0,0|2,0,0]=4 16555 B15R1.5821 CC(=O)CCCNc1ccc(cc1I)Br 34a_100000187925_100000685027 [0,2,0,0,0,0|2,0,0]=4 16556 B15R1.5821 CC(=O)CCCNc1ccc(cc1I)C 34a_100011356834_100000685027 [0,2,0,0,0,0|2,0,0]=4 16557 B15R1.5821 CC(=O)CCCNc1ccc(cc1I)Cl 34a_100000761889_100000685027 [0,2,0,0,0,0|2,0,0]=4 16558 B15R1.5821 CC(=O)CCCNc1ccc(cc1I)F 34a_100000760547_100000685027 [0,2,0,0,0,0|2,0,0]=4 16559 B15R1.5821 CC(=O)CCCNc1ccc(cc1I)O 34a_100010084370_100000685027 [0,2,0,0,0,0|2,0,0]=4 16560 B15R1.5821 CC(=O)CCCNc1ccc(cc1O)Br 34a_100000739049_100000685027 [0,2,0,0,0,0|2,0,0]=4 16561 B15R1.5821 CC(=O)CCCNc1ccc(cc1O)C 34a_100000211527_100000685027 [0,2,0,0,0,0|2,0,0]=4 16562 B15R1.5821 CC(=O)CCCNc1ccc(cc1O)Cl 34a_100000185728_100000685027 [0,2,0,0,0,0|2,0,0]=4 16563 B15R1.5821 CC(=O)CCCNc1ccc(cc1O)F 34a_100000753323_100000685027 [0,2,0,0,0,0|2,0,0]=4 16564 B15R1.5821 CC(=O)CCCNc1ccc(cc1O)O 34a_100000106777_100000685027 [0,2,0,0,0,0|2,0,0]=4 16565 B15R1.5821 CC(=O)CCCOc1ccc(cc1Br)Br 34a_100000188717_100000685027 [0,2,0,0,0,0|2,0,0]=4 16566 B15R1.5821 CC(=O)CCCOc1ccc(cc1Br)Br 7a_100000188717_100011215641 [0,2,0,0,0,0|2,0,0]=4 16567 B15R1.5821 CC(=O)CCCOc1ccc(cc1Br)C 34a_100000210800_100000685027 [0,2,0,0,0,0|2,0,0]=4 16568 B15R1.5821 CC(=O)CCCOc1ccc(cc1Br)C 7a_100000210800_100011215641 [0,2,0,0,0,0|2,0,0]=4 16569 B15R1.5821 CC(=O)CCCOc1ccc(cc1Br)Cl 34a_100000211998_100000685027 [0,2,0,0,0,0|2,0,0]=4 16570 B15R1.5821 CC(=O)CCCOc1ccc(cc1Br)Cl 7a_100000211998_100011215641 [0,2,0,0,0,0|2,0,0]=4 16571 B15R1.5821 CC(=O)CCCOc1ccc(cc1Br)F 34a_100000211999_100000685027 [0,2,0,0,0,0|2,0,0]=4 16572 B15R1.5821 CC(=O)CCCOc1ccc(cc1Br)F 7a_100000211999_100011215641 [0,2,0,0,0,0|2,0,0]=4 16573 B15R1.5821 CC(=O)CCCOc1ccc(cc1Br)I 34a_100012361655_100000685027 [0,2,0,0,0,0|2,0,0]=4 16574 B15R1.5821 CC(=O)CCCOc1ccc(cc1Br)I 7a_100012361655_100011215641 [0,2,0,0,0,0|2,0,0]=4 16575 B15R1.5821 CC(=O)CCCOc1ccc(cc1Br)N 34a_100011534360_100000685027 [0,2,0,0,0,0|2,0,0]=4 16576 B15R1.5821 CC(=O)CCCOc1ccc(cc1Br)N 7a_100011534360_100011215641 [0,2,0,0,0,0|2,0,0]=4 16577 B15R1.5821 CC(=O)CCCOc1ccc(cc1C)Br 34a_100000186361_100000685027 [0,2,0,0,0,0|2,0,0]=4 16578 B15R1.5821 CC(=O)CCCOc1ccc(cc1C)Br 7a_100000186361_100011215641 [0,2,0,0,0,0|2,0,0]=4 16579 B15R1.5821 CC(=O)CCCOc1ccc(cc1C)C 34a_100000211776_100000685027 [0,2,0,0,0,0|2,0,0]=4 16580 B15R1.5821 CC(=O)CCCOc1ccc(cc1C)C 7a_100000211776_100011215641 [0,2,0,0,0,0|2,0,0]=4 16581 B15R1.5821 CC(=O)CCCOc1ccc(cc1C)Cl 34a_100000211091_100000685027 [0,2,0,0,0,0|2,0,0]=4 16582 B15R1.5821 CC(=O)CCCOc1ccc(cc1C)Cl 7a_100000211091_100011215641 [0,2,0,0,0,0|2,0,0]=4 16583 B15R1.5821 CC(=O)CCCOc1ccc(cc1C)F 34a_100000764316_100000685027 [0,2,0,0,0,0|2,0,0]=4 16584 B15R1.5821 CC(=O)CCCOc1ccc(cc1C)F 7a_100000764316_100011215641 [0,2,0,0,0,0|2,0,0]=4 16585 B15R1.5821 CC(=O)CCCOc1ccc(cc1C)I 34a_100011218673_100000685027 [0,2,0,0,0,0|2,0,0]=4 16586 B15R1.5821 CC(=O)CCCOc1ccc(cc1C)I 7a_100011218673_100011215641 [0,2,0,0,0,0|2,0,0]=4 16587 B15R1.5821 CC(=O)CCCOc1ccc(cc1C)N 34a_100011218179_100000685027 [0,2,0,0,0,0|2,0,0]=4 16588 B15R1.5821 CC(=O)CCCOc1ccc(cc1C)N 7a_100011218179_100011215641 [0,2,0,0,0,0|2,0,0]=4 16589 B15R1.5821 CC(=O)CCCOc1ccc(cc1Cl)Br 34a_100000186472_100000685027 [0,2,0,0,0,0|2,0,0]=4 16590 B15R1.5821 CC(=O)CCCOc1ccc(cc1Cl)Br 7a_100000186472_100011215641 [0,2,0,0,0,0|2,0,0]=4 16591 B15R1.5821 CC(=O)CCCOc1ccc(cc1Cl)C 34a_100000749699_100000685027 [0,2,0,0,0,0|2,0,0]=4 16592 B15R1.5821 CC(=O)CCCOc1ccc(cc1Cl)C 7a_100000749699_100011215641 [0,2,0,0,0,0|2,0,0]=4 16593 B15R1.5821 CC(=O)CCCOc1ccc(cc1Cl)Cl 1458a_100000186546_200000210301 [0,2,0,0,0,0|2,0,0]=4 16594 B15R1.5821 CC(=O)CCCOc1ccc(cc1Cl)Cl 34a_100015191787_100000685027 [0,2,0,0,0,0|2,0,0]=4 16595 B15R1.5821 CC(=O)CCCOc1ccc(cc1Cl)Cl 7a_100015191787_100011215641 [0,2,0,0,0,0|2,0,0]=4 16596 B15R1.5821 CC(=O)CCCOc1ccc(cc1Cl)F 34a_100000212004_100000685027 [0,2,0,0,0,0|2,0,0]=4 16597 B15R1.5821 CC(=O)CCCOc1ccc(cc1Cl)F 7a_100000212004_100011215641 [0,2,0,0,0,0|2,0,0]=4 16598 B15R1.5821 CC(=O)CCCOc1ccc(cc1Cl)I 34a_100012360047_100000685027 [0,2,0,0,0,0|2,0,0]=4 16599 B15R1.5821 CC(=O)CCCOc1ccc(cc1Cl)I 7a_100012360047_100011215641 [0,2,0,0,0,0|2,0,0]=4 16600 B15R1.5821 CC(=O)CCCOc1ccc(cc1Cl)N 34a_100000744943_100000685027 [0,2,0,0,0,0|2,0,0]=4 16601 B15R1.5821 CC(=O)CCCOc1ccc(cc1Cl)N 7a_100000744943_100011215641 [0,2,0,0,0,0|2,0,0]=4 16602 B15R1.5821 CC(=O)CCCOc1ccc(cc1F)Br 34a_100000185481_100000685027 [0,2,0,0,0,0|2,0,0]=4 16603 B15R1.5821 CC(=O)CCCOc1ccc(cc1F)Br 7a_100000185481_100011215641 [0,2,0,0,0,0|2,0,0]=4 16604 B15R1.5821 CC(=O)CCCOc1ccc(cc1F)C 34a_100011216688_100000685027 [0,2,0,0,0,0|2,0,0]=4 16605 B15R1.5821 CC(=O)CCCOc1ccc(cc1F)C 7a_100011216688_100011215641 [0,2,0,0,0,0|2,0,0]=4 16606 B15R1.5821 CC(=O)CCCOc1ccc(cc1F)Cl 34a_100000230166_100000685027 [0,2,0,0,0,0|2,0,0]=4 16607 B15R1.5821 CC(=O)CCCOc1ccc(cc1F)Cl 7a_100000230166_100011215641 [0,2,0,0,0,0|2,0,0]=4 16608 B15R1.5821 CC(=O)CCCOc1ccc(cc1F)F 1458a_100000746133_200000210301 [0,2,0,0,0,0|2,0,0]=4 16609 B15R1.5821 CC(=O)CCCOc1ccc(cc1F)F 34a_100000230127_100000685027 [0,2,0,0,0,0|2,0,0]=4 16610 B15R1.5821 CC(=O)CCCOc1ccc(cc1F)F 7a_100000230127_100011215641 [0,2,0,0,0,0|2,0,0]=4 16611 B15R1.5821 CC(=O)CCCOc1ccc(cc1F)I 34a_100011356965_100000685027 [0,2,0,0,0,0|2,0,0]=4 16612 B15R1.5821 CC(=O)CCCOc1ccc(cc1F)I 7a_100011356965_100011215641 [0,2,0,0,0,0|2,0,0]=4 16613 B15R1.5821 CC(=O)CCCOc1ccc(cc1F)N 34a_100011220035_100000685027 [0,2,0,0,0,0|2,0,0]=4 16614 B15R1.5821 CC(=O)CCCOc1ccc(cc1F)N 7a_100011220035_100011215641 [0,2,0,0,0,0|2,0,0]=4 16615 B15R1.5821 CC(=O)CCCOc1ccc(cc1I)Br 34a_100012355227_100000685027 [0,2,0,0,0,0|2,0,0]=4 16616 B15R1.5821 CC(=O)CCCOc1ccc(cc1I)Br 7a_100012355227_100011215641 [0,2,0,0,0,0|2,0,0]=4 16617 B15R1.5821 CC(=O)CCCOc1ccc(cc1I)C 34a_100000765521_100000685027 [0,2,0,0,0,0|2,0,0]=4 16618 B15R1.5821 CC(=O)CCCOc1ccc(cc1I)C 7a_100000765521_100011215641 [0,2,0,0,0,0|2,0,0]=4 16619 B15R1.5821 CC(=O)CCCOc1ccc(cc1I)Cl 34a_100011356953_100000685027 [0,2,0,0,0,0|2,0,0]=4 16620 B15R1.5821 CC(=O)CCCOc1ccc(cc1I)Cl 7a_100011356953_100011215641 [0,2,0,0,0,0|2,0,0]=4 16621 B15R1.5821 CC(=O)CCCOc1ccc(cc1I)F 34a_100012355409_100000685027 [0,2,0,0,0,0|2,0,0]=4 16622 B15R1.5821 CC(=O)CCCOc1ccc(cc1I)F 7a_100012355409_100011215641 [0,2,0,0,0,0|2,0,0]=4 16623 B15R1.5821 CC(=O)CCCOc1ccc(cc1I)I 7a_100010001573_100011215641 [0,2,0,0,0,0|2,0,0]=4 16624 B15R1.5821 CC(=O)CCCOc1ccc(cc1N)Br 34a_100000752626_100000685027 [0,2,0,0,0,0|2,0,0]=4 16625 B15R1.5821 CC(=O)CCCOc1ccc(cc1N)Br 7a_100000752626_100011215641 [0,2,0,0,0,0|2,0,0]=4 16626 B15R1.5821 CC(=O)CCCOc1ccc(cc1N)C 34a_100011215204_100000685027 [0,2,0,0,0,0|2,0,0]=4 16627 B15R1.5821 CC(=O)CCCOc1ccc(cc1N)C 7a_100011215204_100011215641 [0,2,0,0,0,0|2,0,0]=4 16628 B15R1.5821 CC(=O)CCCOc1ccc(cc1N)Cl 34a_100000210500_100000685027 [0,2,0,0,0,0|2,0,0]=4 16629 B15R1.5821 CC(=O)CCCOc1ccc(cc1N)Cl 7a_100000210500_100011215641 [0,2,0,0,0,0|2,0,0]=4 16630 B15R1.5821 CC(=O)CCCOc1ccc(cc1N)F 34a_100000759472_100000685027 [0,2,0,0,0,0|2,0,0]=4 16631 B15R1.5821 CC(=O)CCCOc1ccc(cc1N)F 7a_100000759472_100011215641 [0,2,0,0,0,0|2,0,0]=4 16632 B15R1.5821 CC(=O)CCCOc1ccc(cc1N)I 34a_100000753495_100000685027 [0,2,0,0,0,0|2,0,0]=4 16633 B15R1.5821 CC(=O)CCCOc1ccc(cc1N)I 7a_100000753495_100011215641 [0,2,0,0,0,0|2,0,0]=4 16634 B15R1.5821 CC(=O)CCCOc1ccc(cc1N)N 34a_100000725306_100000685027 [0,2,0,0,0,0|2,0,0]=4 16635 B15R1.5821 CC(=O)CCCSc1ccc(cc1Br)Br 62a_100011215641_100011484698 [0,2,0,0,0,0|2,0,0]=4 16636 B15R1.5821 CC(=O)CCCSc1ccc(cc1Br)Br 62a_100011484698_100011215641 [0,2,0,0,0,0|2,0,0]=4 16637 B15R1.5821 CC(=O)CCCSc1ccc(cc1Br)C 62a_100009813563_100011215641 [0,2,0,0,0,0|2,0,0]=4 16638 B15R1.5821 CC(=O)CCCSc1ccc(cc1Br)C 62a_100011215641_100009813563 [0,2,0,0,0,0|2,0,0]=4 16639 B15R1.5821 CC(=O)CCCSc1ccc(cc1Br)Cl 62a_100011215641_100011219703 [0,2,0,0,0,0|2,0,0]=4 16640 B15R1.5821 CC(=O)CCCSc1ccc(cc1Br)Cl 62a_100011219703_100011215641 [0,2,0,0,0,0|2,0,0]=4 16641 B15R1.5821 CC(=O)CCCSc1ccc(cc1Br)F 62a_100011215641_100011217111 [0,2,0,0,0,0|2,0,0]=4 16642 B15R1.5821 CC(=O)CCCSc1ccc(cc1Br)F 62a_100011217111_100011215641 [0,2,0,0,0,0|2,0,0]=4 16643 B15R1.5821 CC(=O)CCCSc1ccc(cc1Br)N 62a_100000750458_100011215641 [0,2,0,0,0,0|2,0,0]=4 16644 B15R1.5821 CC(=O)CCCSc1ccc(cc1Br)N 62a_100011215641_100000750458 [0,2,0,0,0,0|2,0,0]=4 16645 B15R1.5821 CC(=O)CCCSc1ccc(cc1Br)O 62a_100000701344_100011215641 [0,2,0,0,0,0|2,0,0]=4 16646 B15R1.5821 CC(=O)CCCSc1ccc(cc1Br)O 62a_100011215641_100000701344 [0,2,0,0,0,0|2,0,0]=4 16647 B15R1.5821 CC(=O)CCCSc1ccc(cc1C)Br 62a_100000701812_100011215641 [0,2,0,0,0,0|2,0,0]=4 16648 B15R1.5821 CC(=O)CCCSc1ccc(cc1C)Br 62a_100011215641_100000701812 [0,2,0,0,0,0|2,0,0]=4 16649 B15R1.5821 CC(=O)CCCSc1ccc(cc1C)C 62a_100011215641_100011217332 [0,2,0,0,0,0|2,0,0]=4 16650 B15R1.5821 CC(=O)CCCSc1ccc(cc1C)C 62a_100011217332_100011215641 [0,2,0,0,0,0|2,0,0]=4 16651 B15R1.5821 CC(=O)CCCSc1ccc(cc1C)Cl 62a_100011215641_100011219607 [0,2,0,0,0,0|2,0,0]=4 16652 B15R1.5821 CC(=O)CCCSc1ccc(cc1C)Cl 62a_100011219607_100011215641 [0,2,0,0,0,0|2,0,0]=4 16653 B15R1.5821 CC(=O)CCCSc1ccc(cc1C)F 62a_100011205405_100011215641 [0,2,0,0,0,0|2,0,0]=4 16654 B15R1.5821 CC(=O)CCCSc1ccc(cc1C)F 62a_100011215641_100011205405 [0,2,0,0,0,0|2,0,0]=4 16655 B15R1.5821 CC(=O)CCCSc1ccc(cc1C)N 62a_100000210723_100011215641 [0,2,0,0,0,0|2,0,0]=4 16656 B15R1.5821 CC(=O)CCCSc1ccc(cc1C)N 62a_100011215641_100000210723 [0,2,0,0,0,0|2,0,0]=4 16657 B15R1.5821 CC(=O)CCCSc1ccc(cc1C)O 62a_100011215641_100000690111 [0,2,0,0,0,0|2,0,0]=4 16658 B15R1.5821 CC(=O)CCCSc1ccc(cc1Cl)Br 62a_100011215641_100011216062 [0,2,0,0,0,0|2,0,0]=4 16659 B15R1.5821 CC(=O)CCCSc1ccc(cc1Cl)Br 62a_100011216062_100011215641 [0,2,0,0,0,0|2,0,0]=4 16660 B15R1.5821 CC(=O)CCCSc1ccc(cc1Cl)C 62a_100011215641_100011263221 [0,2,0,0,0,0|2,0,0]=4 16661 B15R1.5821 CC(=O)CCCSc1ccc(cc1Cl)C 62a_100011263221_100011215641 [0,2,0,0,0,0|2,0,0]=4 16662 B15R1.5821 CC(=O)CCCSc1ccc(cc1Cl)Cl 62a_100000699841_100011215641 [0,2,0,0,0,0|2,0,0]=4 16663 B15R1.5821 CC(=O)CCCSc1ccc(cc1Cl)Cl 62a_100011215641_100000699841 [0,2,0,0,0,0|2,0,0]=4 16664 B15R1.5821 CC(=O)CCCSc1ccc(cc1Cl)F 62a_100000733362_100011215641 [0,2,0,0,0,0|2,0,0]=4 16665 B15R1.5821 CC(=O)CCCSc1ccc(cc1Cl)F 62a_100011215641_100000733362 [0,2,0,0,0,0|2,0,0]=4 16666 B15R1.5821 CC(=O)CCCSc1ccc(cc1Cl)N 62a_100000761885_100011215641 [0,2,0,0,0,0|2,0,0]=4 16667 B15R1.5821 CC(=O)CCCSc1ccc(cc1Cl)N 62a_100011215641_100000761885 [0,2,0,0,0,0|2,0,0]=4 16668 B15R1.5821 CC(=O)CCCSc1ccc(cc1Cl)O 62a_100000047559_100011215641 [0,2,0,0,0,0|2,0,0]=4 16669 B15R1.5821 CC(=O)CCCSc1ccc(cc1Cl)O 62a_100011215641_100000047559 [0,2,0,0,0,0|2,0,0]=4 16670 B15R1.5821 CC(=O)CCCSc1ccc(cc1F)Br 62a_100009814013_100011215641 [0,2,0,0,0,0|2,0,0]=4 16671 B15R1.5821 CC(=O)CCCSc1ccc(cc1F)Br 62a_100011215641_100009814013 [0,2,0,0,0,0|2,0,0]=4 16672 B15R1.5821 CC(=O)CCCSc1ccc(cc1F)C 62a_100011215641_100011216119 [0,2,0,0,0,0|2,0,0]=4 16673 B15R1.5821 CC(=O)CCCSc1ccc(cc1F)C 62a_100011216119_100011215641 [0,2,0,0,0,0|2,0,0]=4 16674 B15R1.5821 CC(=O)CCCSc1ccc(cc1F)Cl 62a_100011215641_100011216042 [0,2,0,0,0,0|2,0,0]=4 16675 B15R1.5821 CC(=O)CCCSc1ccc(cc1F)Cl 62a_100011216042_100011215641 [0,2,0,0,0,0|2,0,0]=4 16676 B15R1.5821 CC(=O)CCCSc1ccc(cc1F)F 62a_100000750030_100011215641 [0,2,0,0,0,0|2,0,0]=4 16677 B15R1.5821 CC(=O)CCCSc1ccc(cc1F)F 62a_100011215641_100000750030 [0,2,0,0,0,0|2,0,0]=4 16678 B15R1.5821 CC(=O)CCCSc1ccc(cc1F)N 62a_100011215641_100011356925 [0,2,0,0,0,0|2,0,0]=4 16679 B15R1.5821 CC(=O)CCCSc1ccc(cc1F)N 62a_100011356925_100011215641 [0,2,0,0,0,0|2,0,0]=4 16680 B15R1.5821 CC(=O)CCCSc1ccc(cc1F)O 62a_100000755031_100011215641 [0,2,0,0,0,0|2,0,0]=4 16681 B15R1.5821 CC(=O)CCCSc1ccc(cc1F)O 62a_100011215641_100000755031 [0,2,0,0,0,0|2,0,0]=4 16682 B15R1.5821 CC(=O)CCCSc1ccc(cc1N)Br 62a_100000743836_100011215641 [0,2,0,0,0,0|2,0,0]=4 16683 B15R1.5821 CC(=O)CCCSc1ccc(cc1N)Br 62a_100011215641_100000743836 [0,2,0,0,0,0|2,0,0]=4 16684 B15R1.5821 CC(=O)CCCSc1ccc(cc1N)C 62a_100011215641_100011216686 [0,2,0,0,0,0|2,0,0]=4 16685 B15R1.5821 CC(=O)CCCSc1ccc(cc1N)C 62a_100011216686_100011215641 [0,2,0,0,0,0|2,0,0]=4 16686 B15R1.5821 CC(=O)CCCSc1ccc(cc1N)Cl 62a_100000761886_100011215641 [0,2,0,0,0,0|2,0,0]=4 16687 B15R1.5821 CC(=O)CCCSc1ccc(cc1N)Cl 62a_100011215641_100000761886 [0,2,0,0,0,0|2,0,0]=4 16688 B15R1.5821 CC(=O)CCCSc1ccc(cc1N)F 62a_100000687223_100011215641 [0,2,0,0,0,0|2,0,0]=4 16689 B15R1.5821 CC(=O)CCCSc1ccc(cc1N)F 62a_100011215641_100000687223 [0,2,0,0,0,0|2,0,0]=4 16690 B15R1.5821 CC(=O)CCCSc1ccc(cc1N)N 62a_100011215641_200012175722 [0,2,0,0,0,0|2,0,0]=4 16691 B15R1.5821 CC(=O)CCCSc1ccc(cc1N)N 62a_200012175722_100011215641 [0,2,0,0,0,0|2,0,0]=4 16692 B15R1.5821 CC(=O)CCCSc1ccc(cc1N)O 62a_100011215641_100011999798 [0,2,0,0,0,0|2,0,0]=4 16693 B15R1.5821 CC(=O)CCCSc1ccc(cc1N)O 62a_100011999798_100011215641 [0,2,0,0,0,0|2,0,0]=4 16694 B15R1.5821 CC(=O)CCCSc1ccc(cc1O)Br 62a_100011215641_100012344904 [0,2,0,0,0,0|2,0,0]=4 16695 B15R1.5821 CC(=O)CCCSc1ccc(cc1O)Br 62a_100012344904_100011215641 [0,2,0,0,0,0|2,0,0]=4 16696 B15R1.5821 CC(=O)CCCSc1ccc(cc1O)C 62a_100011215641_100012002257 [0,2,0,0,0,0|2,0,0]=4 16697 B15R1.5821 CC(=O)CCCSc1ccc(cc1O)C 62a_100012002257_100011215641 [0,2,0,0,0,0|2,0,0]=4 16698 B15R1.5821 CC(=O)CCCSc1ccc(cc1O)Cl 62a_100000050036_100011215641 [0,2,0,0,0,0|2,0,0]=4 16699 B15R1.5821 CC(=O)CCCSc1ccc(cc1O)Cl 62a_100011215641_100000050036 [0,2,0,0,0,0|2,0,0]=4 16700 B15R1.5821 CC(=O)CCCSc1ccc(cc1O)F 62a_100000690578_100011215641 [0,2,0,0,0,0|2,0,0]=4 16701 B15R1.5821 CC(=O)CCCSc1ccc(cc1O)F 62a_100011215641_100000690578 [0,2,0,0,0,0|2,0,0]=4 16702 B15R1.5821 CC(=O)CCCSc1ccc(cc1O)O 62a_100011215641_100009813921 [0,2,0,0,0,0|2,0,0]=4 16703 B15R1.5821 CC(=O)CCOCc1ccc(cc1Br)Br 34a_100000759926_200012351560 [0,2,0,0,0,0|2,0,0]=4 16704 B15R1.5821 CC(=O)CCOCc1ccc(cc1Br)Br 7a_100000759926_200012351560 [0,2,0,0,0,0|2,0,0]=4 16705 B15R1.5821 CC(=O)CCOCc1ccc(cc1Br)Br 7a_100012357508_100000053229 [0,2,0,0,0,0|2,0,0]=4 16706 B15R1.5821 CC(=O)CCOCc1ccc(cc1Br)Cl 34a_100000759926_100000755608 [0,2,0,0,0,0|2,0,0]=4 16707 B15R1.5821 CC(=O)CCOCc1ccc(cc1Br)Cl 7a_100000707881_100000053229 [0,2,0,0,0,0|2,0,0]=4 16708 B15R1.5821 CC(=O)CCOCc1ccc(cc1Br)Cl 7a_100000759926_100000755608 [0,2,0,0,0,0|2,0,0]=4 16709 B15R1.5821 CC(=O)CCOCc1ccc(cc1Br)F 34a_100000759926_100000243222 [0,2,0,0,0,0|2,0,0]=4 16710 B15R1.5821 CC(=O)CCOCc1ccc(cc1Br)F 7a_100000744086_100000053229 [0,2,0,0,0,0|2,0,0]=4 16711 B15R1.5821 CC(=O)CCOCc1ccc(cc1Br)F 7a_100000759926_100000243222 [0,2,0,0,0,0|2,0,0]=4 16712 B15R1.5821 CC(=O)CCOCc1ccc(cc1Br)I 34a_100000759926_100010146610 [0,2,0,0,0,0|2,0,0]=4 16713 B15R1.5821 CC(=O)CCOCc1ccc(cc1Br)I 7a_100000759926_100010146610 [0,2,0,0,0,0|2,0,0]=4 16714 B15R1.5821 CC(=O)CCOCc1ccc(cc1Br)I 7a_100010240206_100000053229 [0,2,0,0,0,0|2,0,0]=4 16715 B15R1.5821 CC(=O)CCOCc1ccc(cc1C)Br 34a_100000759926_100000708836 [0,2,0,0,0,0|2,0,0]=4 16716 B15R1.5821 CC(=O)CCOCc1ccc(cc1C)Br 7a_100000748258_100000053229 [0,2,0,0,0,0|2,0,0]=4 16717 B15R1.5821 CC(=O)CCOCc1ccc(cc1C)Br 7a_100000759926_100000708836 [0,2,0,0,0,0|2,0,0]=4 16718 B15R1.5821 CC(=O)CCOCc1ccc(cc1C)C 34a_100000759926_100011219618 [0,2,0,0,0,0|2,0,0]=4 16719 B15R1.5821 CC(=O)CCOCc1ccc(cc1C)C 7a_100000759926_100011219618 [0,2,0,0,0,0|2,0,0]=4 16720 B15R1.5821 CC(=O)CCOCc1ccc(cc1C)C 7a_100011215341_100000053229 [0,2,0,0,0,0|2,0,0]=4 16721 B15R1.5821 CC(=O)CCOCc1ccc(cc1C)Cl 34a_100000759926_100012361307 [0,2,0,0,0,0|2,0,0]=4 16722 B15R1.5821 CC(=O)CCOCc1ccc(cc1C)Cl 7a_100000702939_100000053229 [0,2,0,0,0,0|2,0,0]=4 16723 B15R1.5821 CC(=O)CCOCc1ccc(cc1C)Cl 7a_100000759926_100012361307 [0,2,0,0,0,0|2,0,0]=4 16724 B15R1.5821 CC(=O)CCOCc1ccc(cc1C)F 34a_100000759926_100000700533 [0,2,0,0,0,0|2,0,0]=4 16725 B15R1.5821 CC(=O)CCOCc1ccc(cc1C)F 7a_100000700136_100000053229 [0,2,0,0,0,0|2,0,0]=4 16726 B15R1.5821 CC(=O)CCOCc1ccc(cc1C)F 7a_100000759926_100000700533 [0,2,0,0,0,0|2,0,0]=4 16727 B15R1.5821 CC(=O)CCOCc1ccc(cc1C)N 7a_100000102464_100000053229 [0,2,0,0,0,0|2,0,0]=4 16728 B15R1.5821 CC(=O)CCOCc1ccc(cc1Cl)Br 34a_100000759926_100011740631 [0,2,0,0,0,0|2,0,0]=4 16729 B15R1.5821 CC(=O)CCOCc1ccc(cc1Cl)Br 7a_100000756401_100000053229 [0,2,0,0,0,0|2,0,0]=4 16730 B15R1.5821 CC(=O)CCOCc1ccc(cc1Cl)Br 7a_100000759926_100011740631 [0,2,0,0,0,0|2,0,0]=4 16731 B15R1.5821 CC(=O)CCOCc1ccc(cc1Cl)C 34a_100000759926_100012349684 [0,2,0,0,0,0|2,0,0]=4 16732 B15R1.5821 CC(=O)CCOCc1ccc(cc1Cl)C 7a_100000720314_100000053229 [0,2,0,0,0,0|2,0,0]=4 16733 B15R1.5821 CC(=O)CCOCc1ccc(cc1Cl)C 7a_100000759926_100012349684 [0,2,0,0,0,0|2,0,0]=4 16734 B15R1.5821 CC(=O)CCOCc1ccc(cc1Cl)Cl 34a_100000759926_100000188473 [0,2,0,0,0,0|2,0,0]=4 16735 B15R1.5821 CC(=O)CCOCc1ccc(cc1Cl)Cl 7a_100000215721_100000053229 [0,2,0,0,0,0|2,0,0]=4 16736 B15R1.5821 CC(=O)CCOCc1ccc(cc1Cl)Cl 7a_100000759926_100000188473 [0,2,0,0,0,0|2,0,0]=4 16737 B15R1.5821 CC(=O)CCOCc1ccc(cc1Cl)F 34a_100000759926_100011216360 [0,2,0,0,0,0|2,0,0]=4 16738 B15R1.5821 CC(=O)CCOCc1ccc(cc1Cl)F 7a_100000759926_100011216360 [0,2,0,0,0,0|2,0,0]=4 16739 B15R1.5821 CC(=O)CCOCc1ccc(cc1Cl)F 7a_100011219954_100000053229 [0,2,0,0,0,0|2,0,0]=4 16740 B15R1.5821 CC(=O)CCOCc1ccc(cc1F)Br 34a_100000759926_100000211606 [0,2,0,0,0,0|2,0,0]=4 16741 B15R1.5821 CC(=O)CCOCc1ccc(cc1F)Br 7a_100000759926_100000211606 [0,2,0,0,0,0|2,0,0]=4 16742 B15R1.5821 CC(=O)CCOCc1ccc(cc1F)Br 7a_100011191541_100000053229 [0,2,0,0,0,0|2,0,0]=4 16743 B15R1.5821 CC(=O)CCOCc1ccc(cc1F)C 34a_100000759926_100012002367 [0,2,0,0,0,0|2,0,0]=4 16744 B15R1.5821 CC(=O)CCOCc1ccc(cc1F)C 7a_100000759926_100012002367 [0,2,0,0,0,0|2,0,0]=4 16745 B15R1.5821 CC(=O)CCOCc1ccc(cc1F)C 7a_100011216587_100000053229 [0,2,0,0,0,0|2,0,0]=4 16746 B15R1.5821 CC(=O)CCOCc1ccc(cc1F)Cl 34a_100000759926_100000709361 [0,2,0,0,0,0|2,0,0]=4 16747 B15R1.5821 CC(=O)CCOCc1ccc(cc1F)Cl 7a_100000759926_100000709361 [0,2,0,0,0,0|2,0,0]=4 16748 B15R1.5821 CC(=O)CCOCc1ccc(cc1F)Cl 7a_100011217562_100000053229 [0,2,0,0,0,0|2,0,0]=4 16749 B15R1.5821 CC(=O)CCOCc1ccc(cc1F)F 34a_100000759926_100000748237 [0,2,0,0,0,0|2,0,0]=4 16750 B15R1.5821 CC(=O)CCOCc1ccc(cc1F)F 7a_100000759926_100000748237 [0,2,0,0,0,0|2,0,0]=4 16751 B15R1.5821 CC(=O)CCOCc1ccc(cc1F)F 7a_100011215441_100000053229 [0,2,0,0,0,0|2,0,0]=4 16752 B15R1.5821 CC(=O)CCOCc1ccc(cc1F)I 34a_100000759926_100010244991 [0,2,0,0,0,0|2,0,0]=4 16753 B15R1.5821 CC(=O)CCOCc1ccc(cc1F)I 7a_100000759926_100010244991 [0,2,0,0,0,0|2,0,0]=4 16754 B15R1.5821 CC(=O)CCOCc1ccc(cc1F)I 7a_200010202041_100000053229 [0,2,0,0,0,0|2,0,0]=4 16755 B15R1.5821 CC(=O)CCOCc1ccc(cc1I)Br 34a_100000759926_100010146615 [0,2,0,0,0,0|2,0,0]=4 16756 B15R1.5821 CC(=O)CCOCc1ccc(cc1I)Br 7a_100000759926_100010146615 [0,2,0,0,0,0|2,0,0]=4 16757 B15R1.5821 CC(=O)CCOCc1ccc(cc1I)Br 7a_100010146605_100000053229 [0,2,0,0,0,0|2,0,0]=4 16758 B15R1.5821 CC(=O)CCOCc1ccc(cc1I)Cl 34a_100000759926_100010254388 [0,2,0,0,0,0|2,0,0]=4 16759 B15R1.5821 CC(=O)CCOCc1ccc(cc1I)Cl 7a_100000722340_100000053229 [0,2,0,0,0,0|2,0,0]=4 16760 B15R1.5821 CC(=O)CCOCc1ccc(cc1I)Cl 7a_100000759926_100010254388 [0,2,0,0,0,0|2,0,0]=4 16761 B15R1.5821 CC(=O)CCOCc1ccc(cc1I)F 34a_100000759926_100012354799 [0,2,0,0,0,0|2,0,0]=4 16762 B15R1.5821 CC(=O)CCOCc1ccc(cc1I)F 7a_100000759926_100012354799 [0,2,0,0,0,0|2,0,0]=4 16763 B15R1.5821 CC(=O)CCOCc1ccc(cc1I)F 7a_100011356828_100000053229 [0,2,0,0,0,0|2,0,0]=4 16764 B15R1.5821 CC(=O)CCOCc1ccc(cc1N)Br 7a_100000718831_100000053229 [0,2,0,0,0,0|2,0,0]=4 16765 B15R1.5821 CC(=O)CCOCc1ccc(cc1N)C 7a_100000087799_100000053229 [0,2,0,0,0,0|2,0,0]=4 16766 B15R1.5821 CC(=O)CCOCc1ccc(cc1N)Cl 7a_100000238622_100000053229 [0,2,0,0,0,0|2,0,0]=4 16767 B15R1.5821 CC(=O)CCSCc1ccc(cc1Br)Br 62a_100000053229_200012351560 [0,2,0,0,0,0|2,0,0]=4 16768 B15R1.5821 CC(=O)CCSCc1ccc(cc1Br)Br 62a_200012351560_100000053229 [0,2,0,0,0,0|2,0,0]=4 16769 B15R1.5821 CC(=O)CCSCc1ccc(cc1Br)Cl 62a_100000053229_100000755608 [0,2,0,0,0,0|2,0,0]=4 16770 B15R1.5821 CC(=O)CCSCc1ccc(cc1Br)Cl 62a_100000755608_100000053229 [0,2,0,0,0,0|2,0,0]=4 16771 B15R1.5821 CC(=O)CCSCc1ccc(cc1Br)F 62a_100000053229_100000243222 [0,2,0,0,0,0|2,0,0]=4 16772 B15R1.5821 CC(=O)CCSCc1ccc(cc1Br)F 62a_100000243222_100000053229 [0,2,0,0,0,0|2,0,0]=4 16773 B15R1.5821 CC(=O)CCSCc1ccc(cc1Br)I 62a_100000053229_100010146610 [0,2,0,0,0,0|2,0,0]=4 16774 B15R1.5821 CC(=O)CCSCc1ccc(cc1Br)I 62a_100010146610_100000053229 [0,2,0,0,0,0|2,0,0]=4 16775 B15R1.5821 CC(=O)CCSCc1ccc(cc1C)Br 62a_100000053229_100000708836 [0,2,0,0,0,0|2,0,0]=4 16776 B15R1.5821 CC(=O)CCSCc1ccc(cc1C)Br 62a_100000708836_100000053229 [0,2,0,0,0,0|2,0,0]=4 16777 B15R1.5821 CC(=O)CCSCc1ccc(cc1C)C 62a_100000053229_100011219618 [0,2,0,0,0,0|2,0,0]=4 16778 B15R1.5821 CC(=O)CCSCc1ccc(cc1C)C 62a_100011219618_100000053229 [0,2,0,0,0,0|2,0,0]=4 16779 B15R1.5821 CC(=O)CCSCc1ccc(cc1C)Cl 62a_100000053229_100012361307 [0,2,0,0,0,0|2,0,0]=4 16780 B15R1.5821 CC(=O)CCSCc1ccc(cc1C)Cl 62a_100012361307_100000053229 [0,2,0,0,0,0|2,0,0]=4 16781 B15R1.5821 CC(=O)CCSCc1ccc(cc1C)F 62a_100000053229_100000700533 [0,2,0,0,0,0|2,0,0]=4 16782 B15R1.5821 CC(=O)CCSCc1ccc(cc1C)F 62a_100000700533_100000053229 [0,2,0,0,0,0|2,0,0]=4 16783 B15R1.5821 CC(=O)CCSCc1ccc(cc1Cl)Br 62a_100000053229_100011740631 [0,2,0,0,0,0|2,0,0]=4 16784 B15R1.5821 CC(=O)CCSCc1ccc(cc1Cl)Br 62a_100011740631_100000053229 [0,2,0,0,0,0|2,0,0]=4 16785 B15R1.5821 CC(=O)CCSCc1ccc(cc1Cl)C 62a_100000053229_100012349684 [0,2,0,0,0,0|2,0,0]=4 16786 B15R1.5821 CC(=O)CCSCc1ccc(cc1Cl)C 62a_100012349684_100000053229 [0,2,0,0,0,0|2,0,0]=4 16787 B15R1.5821 CC(=O)CCSCc1ccc(cc1Cl)Cl 62a_100000053229_100000188473 [0,2,0,0,0,0|2,0,0]=4 16788 B15R1.5821 CC(=O)CCSCc1ccc(cc1Cl)Cl 62a_100000188473_100000053229 [0,2,0,0,0,0|2,0,0]=4 16789 B15R1.5821 CC(=O)CCSCc1ccc(cc1Cl)F 62a_100000053229_100000187853 [0,2,0,0,0,0|2,0,0]=4 16790 B15R1.5821 CC(=O)CCSCc1ccc(cc1Cl)F 62a_100000187853_100000053229 [0,2,0,0,0,0|2,0,0]=4 16791 B15R1.5821 CC(=O)CCSCc1ccc(cc1F)Br 62a_100000053229_100000211606 [0,2,0,0,0,0|2,0,0]=4 16792 B15R1.5821 CC(=O)CCSCc1ccc(cc1F)Br 62a_100000211606_100000053229 [0,2,0,0,0,0|2,0,0]=4 16793 B15R1.5821 CC(=O)CCSCc1ccc(cc1F)C 62a_100000053229_100011217900 [0,2,0,0,0,0|2,0,0]=4 16794 B15R1.5821 CC(=O)CCSCc1ccc(cc1F)C 62a_100011217900_100000053229 [0,2,0,0,0,0|2,0,0]=4 16795 B15R1.5821 CC(=O)CCSCc1ccc(cc1F)Cl 62a_100000053229_100000709361 [0,2,0,0,0,0|2,0,0]=4 16796 B15R1.5821 CC(=O)CCSCc1ccc(cc1F)Cl 62a_100000709361_100000053229 [0,2,0,0,0,0|2,0,0]=4 16797 B15R1.5821 CC(=O)CCSCc1ccc(cc1F)F 62a_100000053229_100000748237 [0,2,0,0,0,0|2,0,0]=4 16798 B15R1.5821 CC(=O)CCSCc1ccc(cc1F)F 62a_100000748237_100000053229 [0,2,0,0,0,0|2,0,0]=4 16799 B15R1.5821 CC(=O)CCSCc1ccc(cc1F)I 62a_100000053229_100010244991 [0,2,0,0,0,0|2,0,0]=4 16800 B15R1.5821 CC(=O)CCSCc1ccc(cc1F)I 62a_100010244991_100000053229 [0,2,0,0,0,0|2,0,0]=4 16801 B15R1.5821 CC(=O)CCSCc1ccc(cc1I)Br 62a_100000053229_100010146615 [0,2,0,0,0,0|2,0,0]=4 16802 B15R1.5821 CC(=O)CCSCc1ccc(cc1I)Br 62a_100010146615_100000053229 [0,2,0,0,0,0|2,0,0]=4 16803 B15R1.5821 CC(=O)CCSCc1ccc(cc1I)Cl 62a_100000053229_100010254388 [0,2,0,0,0,0|2,0,0]=4 16804 B15R1.5821 CC(=O)CCSCc1ccc(cc1I)Cl 62a_100010254388_100000053229 [0,2,0,0,0,0|2,0,0]=4 16805 B15R1.5821 CC(=O)CCSCc1ccc(cc1I)F 62a_100000053229_100012354799 [0,2,0,0,0,0|2,0,0]=4 16806 B15R1.5821 CC(=O)CCSCc1ccc(cc1I)F 62a_100012354799_100000053229 [0,2,0,0,0,0|2,0,0]=4 16807 B15R1.5821 CC(=O)COCCc1ccc(cc1Br)Cl 34a_100000211253_200012945151 [0,2,0,0,0,0|2,0,0]=4 16808 B15R1.5821 CC(=O)COCCc1ccc(cc1Cl)Cl 34a_100000211253_200012161198 [0,2,0,0,0,0|2,0,0]=4 16809 B15R1.5821 Cc1cc(ccc1CNCCC(=O)N)Br 207a_100000740010_100000687586 [0,2,0,0,0,0|2,0,0]=4 16810 B15R1.5821 Cc1cc(ccc1CNCCC(=O)N)Br 34a_100000753881_100000731001 [0,2,0,0,0,0|2,0,0]=4 16811 B15R1.5821 Cc1cc(ccc1CNCCC(=O)N)Cl 207a_100000740010_100000766358 [0,2,0,0,0,0|2,0,0]=4 16812 B15R1.5821 Cc1cc(ccc1CNCCC(=O)N)Cl 34a_103436540063_100000731001 [0,2,0,0,0,0|2,0,0]=4 16813 B15R1.5821 Cc1cc(ccc1CNCCC(=O)N)F 207a_100000740010_100000745986 [0,2,0,0,0,0|2,0,0]=4 16814 B15R1.5821 Cc1cc(ccc1CNCCC(=O)N)F 34a_100137329023_100000731001 [0,2,0,0,0,0|2,0,0]=4 16815 B15R1.5821 Cc1cc(ccc1CNOCC(=O)O)Br 269956a_100000106656_100000708836 [0,2,0,0,0,0|2,0,0]=4 16816 B15R1.5821 Cc1cc(ccc1CNOCC(=O)O)Cl 269956a_100000106656_100012361307 [0,2,0,0,0,0|2,0,0]=4 16817 B15R1.5821 Cc1cc(ccc1CNOCC(=O)O)F 269956a_100000106656_100000700533 [0,2,0,0,0,0|2,0,0]=4 16818 B15R1.5821 Cc1cc(ccc1COCCC(=O)N)Br 34a_100000748258_100000731001 [0,2,0,0,0,0|2,0,0]=4 16819 B15R1.5821 Cc1cc(ccc1COCCC(=O)N)Br 34a_100000757172_100000708836 [0,2,0,0,0,0|2,0,0]=4 16820 B15R1.5821 Cc1cc(ccc1COCCC(=O)N)Br 7a_100000748258_100000744528 [0,2,0,0,0,0|2,0,0]=4 16821 B15R1.5821 Cc1cc(ccc1COCCC(=O)N)Br 7a_100000757172_100000708836 [0,2,0,0,0,0|2,0,0]=4 16822 B15R1.5821 Cc1cc(ccc1COCCC(=O)N)Cl 34a_100000702939_100000731001 [0,2,0,0,0,0|2,0,0]=4 16823 B15R1.5821 Cc1cc(ccc1COCCC(=O)N)Cl 34a_100000757172_100012361307 [0,2,0,0,0,0|2,0,0]=4 16824 B15R1.5821 Cc1cc(ccc1COCCC(=O)N)Cl 7a_100000702939_100000744528 [0,2,0,0,0,0|2,0,0]=4 16825 B15R1.5821 Cc1cc(ccc1COCCC(=O)N)Cl 7a_100000757172_100012361307 [0,2,0,0,0,0|2,0,0]=4 16826 B15R1.5821 Cc1cc(ccc1COCCC(=O)N)F 34a_100000700136_100000731001 [0,2,0,0,0,0|2,0,0]=4 16827 B15R1.5821 Cc1cc(ccc1COCCC(=O)N)F 34a_100000757172_100000700533 [0,2,0,0,0,0|2,0,0]=4 16828 B15R1.5821 Cc1cc(ccc1COCCC(=O)N)F 7a_100000700136_100000744528 [0,2,0,0,0,0|2,0,0]=4 16829 B15R1.5821 Cc1cc(ccc1COCCC(=O)N)F 7a_100000757172_100000700533 [0,2,0,0,0,0|2,0,0]=4 16830 B15R1.5821 Cc1cc(ccc1COCCC(=O)N)N 34a_100000102464_100000731001 [0,2,0,0,0,0|2,0,0]=4 16831 B15R1.5821 Cc1cc(ccc1COCCC(=O)N)N 7a_100000102464_100000744528 [0,2,0,0,0,0|2,0,0]=4 16832 B15R1.5821 Cc1cc(ccc1CSCCC(=O)N)Br 62a_100000708836_100000744528 [0,2,0,0,0,0|2,0,0]=4 16833 B15R1.5821 Cc1cc(ccc1CSCCC(=O)N)Br 62a_100000744528_100000708836 [0,2,0,0,0,0|2,0,0]=4 16834 B15R1.5821 Cc1cc(ccc1CSCCC(=O)N)Cl 62a_100000744528_100012361307 [0,2,0,0,0,0|2,0,0]=4 16835 B15R1.5821 Cc1cc(ccc1CSCCC(=O)N)Cl 62a_100012361307_100000744528 [0,2,0,0,0,0|2,0,0]=4 16836 B15R1.5821 Cc1cc(ccc1CSCCC(=O)N)F 62a_100000700533_100000744528 [0,2,0,0,0,0|2,0,0]=4 16837 B15R1.5821 Cc1cc(ccc1CSCCC(=O)N)F 62a_100000744528_100000700533 [0,2,0,0,0,0|2,0,0]=4 16838 B15R1.5821 Cc1cc(ccc1NCCCC(=O)N)Br 34a_100000211769_100102525003 [0,2,0,0,0,0|2,0,0]=4 16839 B15R1.5821 Cc1cc(ccc1NCCCC(=O)N)Br 7a_100000211769_100102525003 [0,2,0,0,0,0|2,0,0]=4 16840 B15R1.5821 Cc1cc(ccc1NCCCC(=O)N)Cl 34a_100000210418_100102525003 [0,2,0,0,0,0|2,0,0]=4 16841 B15R1.5821 Cc1cc(ccc1NCCCC(=O)N)Cl 7a_100000210418_100102525003 [0,2,0,0,0,0|2,0,0]=4 16842 B15R1.5821 Cc1cc(ccc1NCCCC(=O)N)F 34a_100000211637_100102525003 [0,2,0,0,0,0|2,0,0]=4 16843 B15R1.5821 Cc1cc(ccc1NCCCC(=O)N)F 7a_100000211637_100102525003 [0,2,0,0,0,0|2,0,0]=4 16844 B15R1.5821 Cc1cc(ccc1NCCCC(=O)N)I 34a_100000184554_100102525003 [0,2,0,0,0,0|2,0,0]=4 16845 B15R1.5821 Cc1cc(ccc1NCCCC(=O)N)I 7a_100000184554_100102525003 [0,2,0,0,0,0|2,0,0]=4 16846 B15R1.5821 Cc1cc(ccc1NCCCC(=O)N)O 34a_100000756630_100102525003 [0,2,0,0,0,0|2,0,0]=4 16847 B15R1.5821 Cc1cc(ccc1OCCCC(=O)N)Br 34a_100000186361_100102525003 [0,2,0,0,0,0|2,0,0]=4 16848 B15R1.5821 Cc1cc(ccc1OCCCC(=O)N)Br 7a_100000186361_100102525003 [0,2,0,0,0,0|2,0,0]=4 16849 B15R1.5821 Cc1cc(ccc1OCCCC(=O)N)Cl 34a_100000211091_100102525003 [0,2,0,0,0,0|2,0,0]=4 16850 B15R1.5821 Cc1cc(ccc1OCCCC(=O)N)Cl 7a_100000211091_100102525003 [0,2,0,0,0,0|2,0,0]=4 16851 B15R1.5821 Cc1cc(ccc1OCCCC(=O)N)F 34a_100000764316_100102525003 [0,2,0,0,0,0|2,0,0]=4 16852 B15R1.5821 Cc1cc(ccc1OCCCC(=O)N)F 7a_100000764316_100102525003 [0,2,0,0,0,0|2,0,0]=4 16853 B15R1.5821 Cc1cc(ccc1OCCCC(=O)N)I 34a_100011218673_100102525003 [0,2,0,0,0,0|2,0,0]=4 16854 B15R1.5821 Cc1cc(ccc1OCCCC(=O)N)I 7a_100011218673_100102525003 [0,2,0,0,0,0|2,0,0]=4 16855 B15R1.5821 Cc1cc(ccc1OCCCC(=O)N)N 34a_100011218179_100102525003 [0,2,0,0,0,0|2,0,0]=4 16856 B15R1.5821 Cc1cc(ccc1OCCCC(=O)N)N 7a_100011218179_100102525003 [0,2,0,0,0,0|2,0,0]=4 16857 B15R1.5821 Cc1cc(ccc1SCCCC(=O)N)Br 62a_100000701812_100102525003 [0,2,0,0,0,0|2,0,0]=4 16858 B15R1.5821 Cc1cc(ccc1SCCCC(=O)N)Br 62a_100102525003_100000701812 [0,2,0,0,0,0|2,0,0]=4 16859 B15R1.5821 Cc1cc(ccc1SCCCC(=O)N)Cl 62a_100011219607_100102525003 [0,2,0,0,0,0|2,0,0]=4 16860 B15R1.5821 Cc1cc(ccc1SCCCC(=O)N)Cl 62a_100102525003_100011219607 [0,2,0,0,0,0|2,0,0]=4 16861 B15R1.5821 Cc1cc(ccc1SCCCC(=O)N)F 62a_100011205405_100102525003 [0,2,0,0,0,0|2,0,0]=4 16862 B15R1.5821 Cc1cc(ccc1SCCCC(=O)N)F 62a_100102525003_100011205405 [0,2,0,0,0,0|2,0,0]=4 16863 B15R1.5821 Cc1cc(ccc1SCCCC(=O)N)N 62a_100000210723_100102525003 [0,2,0,0,0,0|2,0,0]=4 16864 B15R1.5821 Cc1cc(ccc1SCCCC(=O)N)N 62a_100102525003_100000210723 [0,2,0,0,0,0|2,0,0]=4 16865 B15R1.5821 Cc1cc(ccc1SCCCC(=O)N)O 62a_100102525003_100000690111 [0,2,0,0,0,0|2,0,0]=4 16866 B15R1.5821 Cc1ccc(c(c1)Br)CNCCC(=O)N 207a_100000740010_100000692596 [0,2,0,0,0,0|2,0,0]=4 16867 B15R1.5821 Cc1ccc(c(c1)Br)NCCCC(=O)N 34a_100000210942_100102525003 [0,2,0,0,0,0|2,0,0]=4 16868 B15R1.5821 Cc1ccc(c(c1)Br)OCCCC(=O)N 34a_100000210800_100102525003 [0,2,0,0,0,0|2,0,0]=4 16869 B15R1.5821 Cc1ccc(c(c1)Br)OCCCC(=O)N 7a_100000210800_100102525003 [0,2,0,0,0,0|2,0,0]=4 16870 B15R1.5821 Cc1ccc(c(c1)Br)SCCCC(=O)N 62a_100009813563_100102525003 [0,2,0,0,0,0|2,0,0]=4 16871 B15R1.5821 Cc1ccc(c(c1)Br)SCCCC(=O)N 62a_100102525003_100009813563 [0,2,0,0,0,0|2,0,0]=4 16872 B15R1.5821 Cc1ccc(c(c1)C)CCNCC(=O)N 2230a_100000745621_100000747473 [0,2,0,0,0,0|2,0,0]=4 16873 B15R1.5821 Cc1ccc(c(c1)C)CCNCC(=O)N 34a_100000745621_100000187820 [0,2,0,0,0,0|2,0,0]=4 16874 B15R1.5821 Cc1ccc(c(c1)C)CCNCC(=O)[O-] 34a_100000745621_100020667443 [0,2,0,0,0,0|1,0,1]=4 16875 B15R1.5821 Cc1ccc(c(c1)C)CNCCC(=O)N 207a_100000740010_100000211342 [0,2,0,0,0,0|2,0,0]=4 16876 B15R1.5821 Cc1ccc(c(c1)C)CNCCC(=O)N 34a_100000737523_100000731001 [0,2,0,0,0,0|2,0,0]=4 16877 B15R1.5821 Cc1ccc(c(c1)C)CNOCC(=O)O 269956a_100000106656_100011219618 [0,2,0,0,0,0|2,0,0]=4 16878 B15R1.5821 Cc1ccc(c(c1)C)COCCC(=O)N 34a_100000757172_100011219618 [0,2,0,0,0,0|2,0,0]=4 16879 B15R1.5821 Cc1ccc(c(c1)C)COCCC(=O)N 34a_100011215341_100000731001 [0,2,0,0,0,0|2,0,0]=4 16880 B15R1.5821 Cc1ccc(c(c1)C)COCCC(=O)N 7a_100000757172_100011219618 [0,2,0,0,0,0|2,0,0]=4 16881 B15R1.5821 Cc1ccc(c(c1)C)COCCC(=O)N 7a_100011215341_100000744528 [0,2,0,0,0,0|2,0,0]=4 16882 B15R1.5821 Cc1ccc(c(c1)C)CSCCC(=O)N 62a_100000744528_100011219618 [0,2,0,0,0,0|2,0,0]=4 16883 B15R1.5821 Cc1ccc(c(c1)C)CSCCC(=O)N 62a_100011219618_100000744528 [0,2,0,0,0,0|2,0,0]=4 16884 B15R1.5821 Cc1ccc(c(c1)C)NCCCC(=O)N 34a_100000736561_100102525003 [0,2,0,0,0,0|2,0,0]=4 16885 B15R1.5821 Cc1ccc(c(c1)C)NCCCC(=O)N 7a_100000736561_100102525003 [0,2,0,0,0,0|2,0,0]=4 16886 B15R1.5821 Cc1ccc(c(c1)C)OCCCC(=O)N 34a_100000211776_100102525003 [0,2,0,0,0,0|2,0,0]=4 16887 B15R1.5821 Cc1ccc(c(c1)C)OCCCC(=O)N 7a_100000211776_100102525003 [0,2,0,0,0,0|2,0,0]=4 16888 B15R1.5821 Cc1ccc(c(c1)C)SCCCC(=O)N 62a_100011217332_100102525003 [0,2,0,0,0,0|2,0,0]=4 16889 B15R1.5821 Cc1ccc(c(c1)C)SCCCC(=O)N 62a_100102525003_100011217332 [0,2,0,0,0,0|2,0,0]=4 16890 B15R1.5821 Cc1ccc(c(c1)Cl)CNCCC(=O)N 207a_100000740010_100011935181 [0,2,0,0,0,0|2,0,0]=4 16891 B15R1.5821 Cc1ccc(c(c1)Cl)CNCCC(=O)N 34a_100011997539_100000731001 [0,2,0,0,0,0|2,0,0]=4 16892 B15R1.5821 Cc1ccc(c(c1)Cl)CNOCC(=O)O 269956a_100000106656_100012349684 [0,2,0,0,0,0|2,0,0]=4 16893 B15R1.5821 Cc1ccc(c(c1)Cl)COCCC(=O)N 34a_100000720314_100000731001 [0,2,0,0,0,0|2,0,0]=4 16894 B15R1.5821 Cc1ccc(c(c1)Cl)COCCC(=O)N 34a_100000757172_100012349684 [0,2,0,0,0,0|2,0,0]=4 16895 B15R1.5821 Cc1ccc(c(c1)Cl)COCCC(=O)N 7a_100000720314_100000744528 [0,2,0,0,0,0|2,0,0]=4 16896 B15R1.5821 Cc1ccc(c(c1)Cl)COCCC(=O)N 7a_100000757172_100012349684 [0,2,0,0,0,0|2,0,0]=4 16897 B15R1.5821 Cc1ccc(c(c1)Cl)CSCCC(=O)N 62a_100000744528_100012349684 [0,2,0,0,0,0|2,0,0]=4 16898 B15R1.5821 Cc1ccc(c(c1)Cl)CSCCC(=O)N 62a_100012349684_100000744528 [0,2,0,0,0,0|2,0,0]=4 16899 B15R1.5821 Cc1ccc(c(c1)Cl)NCCCC(=O)N 34a_100000210522_100102525003 [0,2,0,0,0,0|2,0,0]=4 16900 B15R1.5821 Cc1ccc(c(c1)Cl)OCCCC(=O)N 34a_100000749699_100102525003 [0,2,0,0,0,0|2,0,0]=4 16901 B15R1.5821 Cc1ccc(c(c1)Cl)OCCCC(=O)N 7a_100000749699_100102525003 [0,2,0,0,0,0|2,0,0]=4 16902 B15R1.5821 Cc1ccc(c(c1)Cl)SCCCC(=O)N 62a_100011263221_100102525003 [0,2,0,0,0,0|2,0,0]=4 16903 B15R1.5821 Cc1ccc(c(c1)Cl)SCCCC(=O)N 62a_100102525003_100011263221 [0,2,0,0,0,0|2,0,0]=4 16904 B15R1.5821 Cc1ccc(c(c1)F)CNCCC(=O)N 207a_100000740010_100011217368 [0,2,0,0,0,0|2,0,0]=4 16905 B15R1.5821 Cc1ccc(c(c1)F)CNCCC(=O)N 34a_100102887089_100000731001 [0,2,0,0,0,0|2,0,0]=4 16906 B15R1.5821 Cc1ccc(c(c1)F)CNOCC(=O)O 269956a_100000106656_100012002367 [0,2,0,0,0,0|2,0,0]=4 16907 B15R1.5821 Cc1ccc(c(c1)F)COCCC(=O)N 34a_100000757172_100012002367 [0,2,0,0,0,0|2,0,0]=4 16908 B15R1.5821 Cc1ccc(c(c1)F)COCCC(=O)N 34a_100011216587_100000731001 [0,2,0,0,0,0|2,0,0]=4 16909 B15R1.5821 Cc1ccc(c(c1)F)COCCC(=O)N 7a_100000757172_100012002367 [0,2,0,0,0,0|2,0,0]=4 16910 B15R1.5821 Cc1ccc(c(c1)F)COCCC(=O)N 7a_100011216587_100000744528 [0,2,0,0,0,0|2,0,0]=4 16911 B15R1.5821 Cc1ccc(c(c1)F)CSCCC(=O)N 62a_100000744528_100011217900 [0,2,0,0,0,0|2,0,0]=4 16912 B15R1.5821 Cc1ccc(c(c1)F)CSCCC(=O)N 62a_100011217900_100000744528 [0,2,0,0,0,0|2,0,0]=4 16913 B15R1.5821 Cc1ccc(c(c1)F)NCCCC(=O)N 34a_100000211023_100102525003 [0,2,0,0,0,0|2,0,0]=4 16914 B15R1.5821 Cc1ccc(c(c1)F)OCCCC(=O)N 34a_100011216688_100102525003 [0,2,0,0,0,0|2,0,0]=4 16915 B15R1.5821 Cc1ccc(c(c1)F)OCCCC(=O)N 7a_100011216688_100102525003 [0,2,0,0,0,0|2,0,0]=4 16916 B15R1.5821 Cc1ccc(c(c1)F)SCCCC(=O)N 62a_100011216119_100102525003 [0,2,0,0,0,0|2,0,0]=4 16917 B15R1.5821 Cc1ccc(c(c1)F)SCCCC(=O)N 62a_100102525003_100011216119 [0,2,0,0,0,0|2,0,0]=4 16918 B15R1.5821 Cc1ccc(c(c1)I)CNCCC(=O)N 207a_100000740010_100010150104 [0,2,0,0,0,0|2,0,0]=4 16919 B15R1.5821 Cc1ccc(c(c1)I)NCCCC(=O)N 34a_100011356834_100102525003 [0,2,0,0,0,0|2,0,0]=4 16920 B15R1.5821 Cc1ccc(c(c1)I)OCCCC(=O)N 34a_100000765521_100102525003 [0,2,0,0,0,0|2,0,0]=4 16921 B15R1.5821 Cc1ccc(c(c1)I)OCCCC(=O)N 7a_100000765521_100102525003 [0,2,0,0,0,0|2,0,0]=4 16922 B15R1.5821 Cc1ccc(c(c1)N)COCCC(=O)N 34a_100000087799_100000731001 [0,2,0,0,0,0|2,0,0]=4 16923 B15R1.5821 Cc1ccc(c(c1)N)COCCC(=O)N 7a_100000087799_100000744528 [0,2,0,0,0,0|2,0,0]=4 16924 B15R1.5821 Cc1ccc(c(c1)N)OCCCC(=O)N 34a_100011215204_100102525003 [0,2,0,0,0,0|2,0,0]=4 16925 B15R1.5821 Cc1ccc(c(c1)N)OCCCC(=O)N 7a_100011215204_100102525003 [0,2,0,0,0,0|2,0,0]=4 16926 B15R1.5821 Cc1ccc(c(c1)N)SCCCC(=O)N 62a_100011216686_100102525003 [0,2,0,0,0,0|2,0,0]=4 16927 B15R1.5821 Cc1ccc(c(c1)N)SCCCC(=O)N 62a_100102525003_100011216686 [0,2,0,0,0,0|2,0,0]=4 16928 B15R1.5821 Cc1ccc(c(c1)O)NCCCC(=O)N 34a_100000211527_100102525003 [0,2,0,0,0,0|2,0,0]=4 16929 B15R1.5821 Cc1ccc(c(c1)O)SCCCC(=O)N 62a_100012002257_100102525003 [0,2,0,0,0,0|2,0,0]=4 16930 B15R1.5821 Cc1ccc(c(c1)O)SCCCC(=O)N 62a_100102525003_100012002257 [0,2,0,0,0,0|2,0,0]=4 16931 B15R1.5821 NC(=O)CCCNc1ccc(cc1Br)Br 34a_100000211012_100102525003 [0,2,0,0,0,0|2,0,0]=4 16932 B15R1.5821 NC(=O)CCCNc1ccc(cc1Br)Cl 34a_100000752454_100102525003 [0,2,0,0,0,0|2,0,0]=4 16933 B15R1.5821 NC(=O)CCCNc1ccc(cc1Br)F 34a_100000738039_100102525003 [0,2,0,0,0,0|2,0,0]=4 16934 B15R1.5821 NC(=O)CCCNc1ccc(cc1Br)O 34a_100012001276_100102525003 [0,2,0,0,0,0|2,0,0]=4 16935 B15R1.5821 NC(=O)CCCNc1ccc(cc1Cl)Br 34a_100000211467_100102525003 [0,2,0,0,0,0|2,0,0]=4 16936 B15R1.5821 NC(=O)CCCNc1ccc(cc1Cl)Cl 34a_100000185861_100102525003 [0,2,0,0,0,0|2,0,0]=4 16937 B15R1.5821 NC(=O)CCCNc1ccc(cc1Cl)F 34a_100000212003_100102525003 [0,2,0,0,0,0|2,0,0]=4 16938 B15R1.5821 NC(=O)CCCNc1ccc(cc1Cl)I 34a_100011218065_100102525003 [0,2,0,0,0,0|2,0,0]=4 16939 B15R1.5821 NC(=O)CCCNc1ccc(cc1Cl)O 34a_100011215599_100102525003 [0,2,0,0,0,0|2,0,0]=4 16940 B15R1.5821 NC(=O)CCCNc1ccc(cc1F)Br 34a_100000210722_100102525003 [0,2,0,0,0,0|2,0,0]=4 16941 B15R1.5821 NC(=O)CCCNc1ccc(cc1F)Cl 34a_100000211020_100102525003 [0,2,0,0,0,0|2,0,0]=4 16942 B15R1.5821 NC(=O)CCCNc1ccc(cc1F)F 34a_100000210720_100102525003 [0,2,0,0,0,0|2,0,0]=4 16943 B15R1.5821 NC(=O)CCCNc1ccc(cc1F)I 34a_100011215594_100102525003 [0,2,0,0,0,0|2,0,0]=4 16944 B15R1.5821 NC(=O)CCCNc1ccc(cc1F)O 34a_100000759473_100102525003 [0,2,0,0,0,0|2,0,0]=4 16945 B15R1.5821 NC(=O)CCCNc1ccc(cc1I)Br 34a_100000187925_100102525003 [0,2,0,0,0,0|2,0,0]=4 16946 B15R1.5821 NC(=O)CCCNc1ccc(cc1I)Cl 34a_100000761889_100102525003 [0,2,0,0,0,0|2,0,0]=4 16947 B15R1.5821 NC(=O)CCCNc1ccc(cc1I)F 34a_100000760547_100102525003 [0,2,0,0,0,0|2,0,0]=4 16948 B15R1.5821 NC(=O)CCCNc1ccc(cc1I)O 34a_100010084370_100102525003 [0,2,0,0,0,0|2,0,0]=4 16949 B15R1.5821 NC(=O)CCCNc1ccc(cc1O)Br 34a_100000739049_100102525003 [0,2,0,0,0,0|2,0,0]=4 16950 B15R1.5821 NC(=O)CCCNc1ccc(cc1O)Cl 34a_100000185728_100102525003 [0,2,0,0,0,0|2,0,0]=4 16951 B15R1.5821 NC(=O)CCCNc1ccc(cc1O)F 34a_100000753323_100102525003 [0,2,0,0,0,0|2,0,0]=4 16952 B15R1.5821 NC(=O)CCCNc1ccc(cc1O)O 34a_100000106777_100102525003 [0,2,0,0,0,0|2,0,0]=4 16953 B15R1.5821 NC(=O)CCCOc1ccc(cc1Br)Br 34a_100000188717_100102525003 [0,2,0,0,0,0|2,0,0]=4 16954 B15R1.5821 NC(=O)CCCOc1ccc(cc1Br)Br 7a_100000188717_100102525003 [0,2,0,0,0,0|2,0,0]=4 16955 B15R1.5821 NC(=O)CCCOc1ccc(cc1Br)Cl 34a_100000211998_100102525003 [0,2,0,0,0,0|2,0,0]=4 16956 B15R1.5821 NC(=O)CCCOc1ccc(cc1Br)Cl 7a_100000211998_100102525003 [0,2,0,0,0,0|2,0,0]=4 16957 B15R1.5821 NC(=O)CCCOc1ccc(cc1Br)F 34a_100000211999_100102525003 [0,2,0,0,0,0|2,0,0]=4 16958 B15R1.5821 NC(=O)CCCOc1ccc(cc1Br)F 7a_100000211999_100102525003 [0,2,0,0,0,0|2,0,0]=4 16959 B15R1.5821 NC(=O)CCCOc1ccc(cc1Br)I 34a_100012361655_100102525003 [0,2,0,0,0,0|2,0,0]=4 16960 B15R1.5821 NC(=O)CCCOc1ccc(cc1Br)I 7a_100012361655_100102525003 [0,2,0,0,0,0|2,0,0]=4 16961 B15R1.5821 NC(=O)CCCOc1ccc(cc1Br)N 34a_100011534360_100102525003 [0,2,0,0,0,0|2,0,0]=4 16962 B15R1.5821 NC(=O)CCCOc1ccc(cc1Br)N 7a_100011534360_100102525003 [0,2,0,0,0,0|2,0,0]=4 16963 B15R1.5821 NC(=O)CCCOc1ccc(cc1Cl)Br 34a_100000186472_100102525003 [0,2,0,0,0,0|2,0,0]=4 16964 B15R1.5821 NC(=O)CCCOc1ccc(cc1Cl)Br 7a_100000186472_100102525003 [0,2,0,0,0,0|2,0,0]=4 16965 B15R1.5821 NC(=O)CCCOc1ccc(cc1Cl)Cl 34a_100015191787_100102525003 [0,2,0,0,0,0|2,0,0]=4 16966 B15R1.5821 NC(=O)CCCOc1ccc(cc1Cl)Cl 7a_100015191787_100102525003 [0,2,0,0,0,0|2,0,0]=4 16967 B15R1.5821 NC(=O)CCCOc1ccc(cc1Cl)F 34a_100000212004_100102525003 [0,2,0,0,0,0|2,0,0]=4 16968 B15R1.5821 NC(=O)CCCOc1ccc(cc1Cl)F 7a_100000212004_100102525003 [0,2,0,0,0,0|2,0,0]=4 16969 B15R1.5821 NC(=O)CCCOc1ccc(cc1Cl)I 34a_100012360047_100102525003 [0,2,0,0,0,0|2,0,0]=4 16970 B15R1.5821 NC(=O)CCCOc1ccc(cc1Cl)I 7a_100012360047_100102525003 [0,2,0,0,0,0|2,0,0]=4 16971 B15R1.5821 NC(=O)CCCOc1ccc(cc1Cl)N 34a_100000744943_100102525003 [0,2,0,0,0,0|2,0,0]=4 16972 B15R1.5821 NC(=O)CCCOc1ccc(cc1Cl)N 7a_100000744943_100102525003 [0,2,0,0,0,0|2,0,0]=4 16973 B15R1.5821 NC(=O)CCCOc1ccc(cc1F)Br 34a_100000185481_100102525003 [0,2,0,0,0,0|2,0,0]=4 16974 B15R1.5821 NC(=O)CCCOc1ccc(cc1F)Br 7a_100000185481_100102525003 [0,2,0,0,0,0|2,0,0]=4 16975 B15R1.5821 NC(=O)CCCOc1ccc(cc1F)Cl 34a_100000230166_100102525003 [0,2,0,0,0,0|2,0,0]=4 16976 B15R1.5821 NC(=O)CCCOc1ccc(cc1F)Cl 7a_100000230166_100102525003 [0,2,0,0,0,0|2,0,0]=4 16977 B15R1.5821 NC(=O)CCCOc1ccc(cc1F)F 34a_100000230127_100102525003 [0,2,0,0,0,0|2,0,0]=4 16978 B15R1.5821 NC(=O)CCCOc1ccc(cc1F)F 7a_100000230127_100102525003 [0,2,0,0,0,0|2,0,0]=4 16979 B15R1.5821 NC(=O)CCCOc1ccc(cc1F)I 34a_100011356965_100102525003 [0,2,0,0,0,0|2,0,0]=4 16980 B15R1.5821 NC(=O)CCCOc1ccc(cc1F)I 7a_100011356965_100102525003 [0,2,0,0,0,0|2,0,0]=4 16981 B15R1.5821 NC(=O)CCCOc1ccc(cc1F)N 34a_100011220035_100102525003 [0,2,0,0,0,0|2,0,0]=4 16982 B15R1.5821 NC(=O)CCCOc1ccc(cc1F)N 7a_100011220035_100102525003 [0,2,0,0,0,0|2,0,0]=4 16983 B15R1.5821 NC(=O)CCCOc1ccc(cc1I)Br 34a_100012355227_100102525003 [0,2,0,0,0,0|2,0,0]=4 16984 B15R1.5821 NC(=O)CCCOc1ccc(cc1I)Br 7a_100012355227_100102525003 [0,2,0,0,0,0|2,0,0]=4 16985 B15R1.5821 NC(=O)CCCOc1ccc(cc1I)Cl 34a_100011356953_100102525003 [0,2,0,0,0,0|2,0,0]=4 16986 B15R1.5821 NC(=O)CCCOc1ccc(cc1I)Cl 7a_100011356953_100102525003 [0,2,0,0,0,0|2,0,0]=4 16987 B15R1.5821 NC(=O)CCCOc1ccc(cc1I)F 34a_100012355409_100102525003 [0,2,0,0,0,0|2,0,0]=4 16988 B15R1.5821 NC(=O)CCCOc1ccc(cc1I)F 7a_100012355409_100102525003 [0,2,0,0,0,0|2,0,0]=4 16989 B15R1.5821 NC(=O)CCCOc1ccc(cc1I)I 7a_100010001573_100102525003 [0,2,0,0,0,0|2,0,0]=4 16990 B15R1.5821 NC(=O)CCCOc1ccc(cc1N)Br 34a_100000752626_100102525003 [0,2,0,0,0,0|2,0,0]=4 16991 B15R1.5821 NC(=O)CCCOc1ccc(cc1N)Br 7a_100000752626_100102525003 [0,2,0,0,0,0|2,0,0]=4 16992 B15R1.5821 NC(=O)CCCOc1ccc(cc1N)Cl 34a_100000210500_100102525003 [0,2,0,0,0,0|2,0,0]=4 16993 B15R1.5821 NC(=O)CCCOc1ccc(cc1N)Cl 7a_100000210500_100102525003 [0,2,0,0,0,0|2,0,0]=4 16994 B15R1.5821 NC(=O)CCCOc1ccc(cc1N)F 34a_100000759472_100102525003 [0,2,0,0,0,0|2,0,0]=4 16995 B15R1.5821 NC(=O)CCCOc1ccc(cc1N)F 7a_100000759472_100102525003 [0,2,0,0,0,0|2,0,0]=4 16996 B15R1.5821 NC(=O)CCCOc1ccc(cc1N)I 34a_100000753495_100102525003 [0,2,0,0,0,0|2,0,0]=4 16997 B15R1.5821 NC(=O)CCCOc1ccc(cc1N)I 7a_100000753495_100102525003 [0,2,0,0,0,0|2,0,0]=4 16998 B15R1.5821 NC(=O)CCCOc1ccc(cc1N)N 34a_100000725306_100102525003 [0,2,0,0,0,0|2,0,0]=4 16999 B15R1.5821 NC(=O)CCCSc1ccc(cc1Br)Br 62a_100011484698_100102525003 [0,2,0,0,0,0|2,0,0]=4 17000 B15R1.5821 NC(=O)CCCSc1ccc(cc1Br)Br 62a_100102525003_100011484698 [0,2,0,0,0,0|2,0,0]=4 17001 B15R1.5821 NC(=O)CCCSc1ccc(cc1Br)Cl 62a_100011219703_100102525003 [0,2,0,0,0,0|2,0,0]=4 17002 B15R1.5821 NC(=O)CCCSc1ccc(cc1Br)Cl 62a_100102525003_100011219703 [0,2,0,0,0,0|2,0,0]=4 17003 B15R1.5821 NC(=O)CCCSc1ccc(cc1Br)F 62a_100011217111_100102525003 [0,2,0,0,0,0|2,0,0]=4 17004 B15R1.5821 NC(=O)CCCSc1ccc(cc1Br)F 62a_100102525003_100011217111 [0,2,0,0,0,0|2,0,0]=4 17005 B15R1.5821 NC(=O)CCCSc1ccc(cc1Br)N 62a_100000750458_100102525003 [0,2,0,0,0,0|2,0,0]=4 17006 B15R1.5821 NC(=O)CCCSc1ccc(cc1Br)N 62a_100102525003_100000750458 [0,2,0,0,0,0|2,0,0]=4 17007 B15R1.5821 NC(=O)CCCSc1ccc(cc1Br)O 62a_100000701344_100102525003 [0,2,0,0,0,0|2,0,0]=4 17008 B15R1.5821 NC(=O)CCCSc1ccc(cc1Br)O 62a_100102525003_100000701344 [0,2,0,0,0,0|2,0,0]=4 17009 B15R1.5821 NC(=O)CCCSc1ccc(cc1Cl)Br 62a_100011216062_100102525003 [0,2,0,0,0,0|2,0,0]=4 17010 B15R1.5821 NC(=O)CCCSc1ccc(cc1Cl)Br 62a_100102525003_100011216062 [0,2,0,0,0,0|2,0,0]=4 17011 B15R1.5821 NC(=O)CCCSc1ccc(cc1Cl)Cl 62a_100000699841_100102525003 [0,2,0,0,0,0|2,0,0]=4 17012 B15R1.5821 NC(=O)CCCSc1ccc(cc1Cl)Cl 62a_100102525003_100000699841 [0,2,0,0,0,0|2,0,0]=4 17013 B15R1.5821 NC(=O)CCCSc1ccc(cc1Cl)F 62a_100000733362_100102525003 [0,2,0,0,0,0|2,0,0]=4 17014 B15R1.5821 NC(=O)CCCSc1ccc(cc1Cl)F 62a_100102525003_100000733362 [0,2,0,0,0,0|2,0,0]=4 17015 B15R1.5821 NC(=O)CCCSc1ccc(cc1Cl)N 62a_100000761885_100102525003 [0,2,0,0,0,0|2,0,0]=4 17016 B15R1.5821 NC(=O)CCCSc1ccc(cc1Cl)N 62a_100102525003_100000761885 [0,2,0,0,0,0|2,0,0]=4 17017 B15R1.5821 NC(=O)CCCSc1ccc(cc1Cl)O 62a_100000047559_100102525003 [0,2,0,0,0,0|2,0,0]=4 17018 B15R1.5821 NC(=O)CCCSc1ccc(cc1Cl)O 62a_100102525003_100000047559 [0,2,0,0,0,0|2,0,0]=4 17019 B15R1.5821 NC(=O)CCCSc1ccc(cc1F)Br 62a_100009814013_100102525003 [0,2,0,0,0,0|2,0,0]=4 17020 B15R1.5821 NC(=O)CCCSc1ccc(cc1F)Br 62a_100102525003_100009814013 [0,2,0,0,0,0|2,0,0]=4 17021 B15R1.5821 NC(=O)CCCSc1ccc(cc1F)Cl 62a_100011216042_100102525003 [0,2,0,0,0,0|2,0,0]=4 17022 B15R1.5821 NC(=O)CCCSc1ccc(cc1F)Cl 62a_100102525003_100011216042 [0,2,0,0,0,0|2,0,0]=4 17023 B15R1.5821 NC(=O)CCCSc1ccc(cc1F)F 62a_100000750030_100102525003 [0,2,0,0,0,0|2,0,0]=4 17024 B15R1.5821 NC(=O)CCCSc1ccc(cc1F)F 62a_100102525003_100000750030 [0,2,0,0,0,0|2,0,0]=4 17025 B15R1.5821 NC(=O)CCCSc1ccc(cc1F)N 62a_100011356925_100102525003 [0,2,0,0,0,0|2,0,0]=4 17026 B15R1.5821 NC(=O)CCCSc1ccc(cc1F)N 62a_100102525003_100011356925 [0,2,0,0,0,0|2,0,0]=4 17027 B15R1.5821 NC(=O)CCCSc1ccc(cc1F)O 62a_100000755031_100102525003 [0,2,0,0,0,0|2,0,0]=4 17028 B15R1.5821 NC(=O)CCCSc1ccc(cc1F)O 62a_100102525003_100000755031 [0,2,0,0,0,0|2,0,0]=4 17029 B15R1.5821 NC(=O)CCCSc1ccc(cc1N)Br 62a_100000743836_100102525003 [0,2,0,0,0,0|2,0,0]=4 17030 B15R1.5821 NC(=O)CCCSc1ccc(cc1N)Br 62a_100102525003_100000743836 [0,2,0,0,0,0|2,0,0]=4 17031 B15R1.5821 NC(=O)CCCSc1ccc(cc1N)Cl 62a_100000761886_100102525003 [0,2,0,0,0,0|2,0,0]=4 17032 B15R1.5821 NC(=O)CCCSc1ccc(cc1N)Cl 62a_100102525003_100000761886 [0,2,0,0,0,0|2,0,0]=4 17033 B15R1.5821 NC(=O)CCCSc1ccc(cc1N)F 62a_100000687223_100102525003 [0,2,0,0,0,0|2,0,0]=4 17034 B15R1.5821 NC(=O)CCCSc1ccc(cc1N)F 62a_100102525003_100000687223 [0,2,0,0,0,0|2,0,0]=4 17035 B15R1.5821 NC(=O)CCCSc1ccc(cc1N)N 62a_100102525003_200012175722 [0,2,0,0,0,0|2,0,0]=4 17036 B15R1.5821 NC(=O)CCCSc1ccc(cc1N)N 62a_200012175722_100102525003 [0,2,0,0,0,0|2,0,0]=4 17037 B15R1.5821 NC(=O)CCCSc1ccc(cc1N)O 62a_100011999798_100102525003 [0,2,0,0,0,0|2,0,0]=4 17038 B15R1.5821 NC(=O)CCCSc1ccc(cc1N)O 62a_100102525003_100011999798 [0,2,0,0,0,0|2,0,0]=4 17039 B15R1.5821 NC(=O)CCCSc1ccc(cc1O)Br 62a_100012344904_100102525003 [0,2,0,0,0,0|2,0,0]=4 17040 B15R1.5821 NC(=O)CCCSc1ccc(cc1O)Br 62a_100102525003_100012344904 [0,2,0,0,0,0|2,0,0]=4 17041 B15R1.5821 NC(=O)CCCSc1ccc(cc1O)Cl 62a_100000050036_100102525003 [0,2,0,0,0,0|2,0,0]=4 17042 B15R1.5821 NC(=O)CCCSc1ccc(cc1O)Cl 62a_100102525003_100000050036 [0,2,0,0,0,0|2,0,0]=4 17043 B15R1.5821 NC(=O)CCCSc1ccc(cc1O)F 62a_100000690578_100102525003 [0,2,0,0,0,0|2,0,0]=4 17044 B15R1.5821 NC(=O)CCCSc1ccc(cc1O)F 62a_100102525003_100000690578 [0,2,0,0,0,0|2,0,0]=4 17045 B15R1.5821 NC(=O)CCCSc1ccc(cc1O)O 62a_100102525003_100009813921 [0,2,0,0,0,0|2,0,0]=4 17046 B15R1.5821 NC(=O)CCNCc1ccc(cc1Br)Br 207a_100000740010_100012351556 [0,2,0,0,0,0|2,0,0]=4 17047 B15R1.5821 NC(=O)CCNCc1ccc(cc1Br)Cl 207a_100000740010_100000687667 [0,2,0,0,0,0|2,0,0]=4 17048 B15R1.5821 NC(=O)CCNCc1ccc(cc1Br)Cl 34a_100102692131_100000731001 [0,2,0,0,0,0|2,0,0]=4 17049 B15R1.5821 NC(=O)CCNCc1ccc(cc1Br)F 207a_100000740010_100000685661 [0,2,0,0,0,0|2,0,0]=4 17050 B15R1.5821 NC(=O)CCNCc1ccc(cc1Br)F 34a_100000708791_100000731001 [0,2,0,0,0,0|2,0,0]=4 17051 B15R1.5821 NC(=O)CCNCc1ccc(cc1Br)I 207a_100000740010_100010185650 [0,2,0,0,0,0|2,0,0]=4 17052 B15R1.5821 NC(=O)CCNCc1ccc(cc1Cl)Br 207a_100000740010_100000764164 [0,2,0,0,0,0|2,0,0]=4 17053 B15R1.5821 NC(=O)CCNCc1ccc(cc1Cl)Br 34a_100020628970_100000731001 [0,2,0,0,0,0|2,0,0]=4 17054 B15R1.5821 NC(=O)CCNCc1ccc(cc1Cl)Cl 207a_100000740010_100000188887 [0,2,0,0,0,0|2,0,0]=4 17055 B15R1.5821 NC(=O)CCNCc1ccc(cc1Cl)Cl 34a_100000174880_100000731001 [0,2,0,0,0,0|2,0,0]=4 17056 B15R1.5821 NC(=O)CCNCc1ccc(cc1Cl)F 207a_100000740010_100000752949 [0,2,0,0,0,0|2,0,0]=4 17057 B15R1.5821 NC(=O)CCNCc1ccc(cc1Cl)F 34a_100000174946_100000731001 [0,2,0,0,0,0|2,0,0]=4 17058 B15R1.5821 NC(=O)CCNCc1ccc(cc1Cl)I 207a_100000740010_100000727542 [0,2,0,0,0,0|2,0,0]=4 17059 B15R1.5821 NC(=O)CCNCc1ccc(cc1Cl)O 34a_200161156549_100000731001 [0,2,0,0,0,0|2,0,0]=4 17060 B15R1.5821 NC(=O)CCNCc1ccc(cc1F)Br 207a_100000740010_100000211676 [0,2,0,0,0,0|2,0,0]=4 17061 B15R1.5821 NC(=O)CCNCc1ccc(cc1F)Br 34a_100000754580_100000731001 [0,2,0,0,0,0|2,0,0]=4 17062 B15R1.5821 NC(=O)CCNCc1ccc(cc1F)Cl 207a_100000740010_100000697372 [0,2,0,0,0,0|2,0,0]=4 17063 B15R1.5821 NC(=O)CCNCc1ccc(cc1F)Cl 34a_100000708496_100000731001 [0,2,0,0,0,0|2,0,0]=4 17064 B15R1.5821 NC(=O)CCNCc1ccc(cc1F)F 207a_100000740010_100000211964 [0,2,0,0,0,0|2,0,0]=4 17065 B15R1.5821 NC(=O)CCNCc1ccc(cc1F)F 34a_100000737868_100000731001 [0,2,0,0,0,0|2,0,0]=4 17066 B15R1.5821 NC(=O)CCNCc1ccc(cc1F)I 207a_100000740010_100000050965 [0,2,0,0,0,0|2,0,0]=4 17067 B15R1.5821 NC(=O)CCNCc1ccc(cc1I)Br 207a_100000740010_100010146562 [0,2,0,0,0,0|2,0,0]=4 17068 B15R1.5821 NC(=O)CCNCc1ccc(cc1I)F 207a_100000740010_100010254405 [0,2,0,0,0,0|2,0,0]=4 17069 B15R1.5821 NC(=O)CCOCc1ccc(cc1Br)Br 34a_100000757172_200012351560 [0,2,0,0,0,0|2,0,0]=4 17070 B15R1.5821 NC(=O)CCOCc1ccc(cc1Br)Br 34a_100012357508_100000731001 [0,2,0,0,0,0|2,0,0]=4 17071 B15R1.5821 NC(=O)CCOCc1ccc(cc1Br)Br 7a_100000757172_200012351560 [0,2,0,0,0,0|2,0,0]=4 17072 B15R1.5821 NC(=O)CCOCc1ccc(cc1Br)Br 7a_100012357508_100000744528 [0,2,0,0,0,0|2,0,0]=4 17073 B15R1.5821 NC(=O)CCOCc1ccc(cc1Br)Cl 34a_100000707881_100000731001 [0,2,0,0,0,0|2,0,0]=4 17074 B15R1.5821 NC(=O)CCOCc1ccc(cc1Br)Cl 34a_100000757172_100000755608 [0,2,0,0,0,0|2,0,0]=4 17075 B15R1.5821 NC(=O)CCOCc1ccc(cc1Br)Cl 7a_100000707881_100000744528 [0,2,0,0,0,0|2,0,0]=4 17076 B15R1.5821 NC(=O)CCOCc1ccc(cc1Br)Cl 7a_100000757172_100000755608 [0,2,0,0,0,0|2,0,0]=4 17077 B15R1.5821 NC(=O)CCOCc1ccc(cc1Br)F 34a_100000744086_100000731001 [0,2,0,0,0,0|2,0,0]=4 17078 B15R1.5821 NC(=O)CCOCc1ccc(cc1Br)F 34a_100000757172_100000243222 [0,2,0,0,0,0|2,0,0]=4 17079 B15R1.5821 NC(=O)CCOCc1ccc(cc1Br)F 7a_100000744086_100000744528 [0,2,0,0,0,0|2,0,0]=4 17080 B15R1.5821 NC(=O)CCOCc1ccc(cc1Br)F 7a_100000757172_100000243222 [0,2,0,0,0,0|2,0,0]=4 17081 B15R1.5821 NC(=O)CCOCc1ccc(cc1Br)I 34a_100000757172_100010146610 [0,2,0,0,0,0|2,0,0]=4 17082 B15R1.5821 NC(=O)CCOCc1ccc(cc1Br)I 7a_100000757172_100010146610 [0,2,0,0,0,0|2,0,0]=4 17083 B15R1.5821 NC(=O)CCOCc1ccc(cc1Br)I 7a_100010240206_100000744528 [0,2,0,0,0,0|2,0,0]=4 17084 B15R1.5821 NC(=O)CCOCc1ccc(cc1Cl)Br 34a_100000756401_100000731001 [0,2,0,0,0,0|2,0,0]=4 17085 B15R1.5821 NC(=O)CCOCc1ccc(cc1Cl)Br 34a_100000757172_100011740631 [0,2,0,0,0,0|2,0,0]=4 17086 B15R1.5821 NC(=O)CCOCc1ccc(cc1Cl)Br 7a_100000756401_100000744528 [0,2,0,0,0,0|2,0,0]=4 17087 B15R1.5821 NC(=O)CCOCc1ccc(cc1Cl)Br 7a_100000757172_100011740631 [0,2,0,0,0,0|2,0,0]=4 17088 B15R1.5821 NC(=O)CCOCc1ccc(cc1Cl)Cl 34a_100000215721_100000731001 [0,2,0,0,0,0|2,0,0]=4 17089 B15R1.5821 NC(=O)CCOCc1ccc(cc1Cl)Cl 34a_100000757172_100000188473 [0,2,0,0,0,0|2,0,0]=4 17090 B15R1.5821 NC(=O)CCOCc1ccc(cc1Cl)Cl 7a_100000215721_100000744528 [0,2,0,0,0,0|2,0,0]=4 17091 B15R1.5821 NC(=O)CCOCc1ccc(cc1Cl)Cl 7a_100000757172_100000188473 [0,2,0,0,0,0|2,0,0]=4 17092 B15R1.5821 NC(=O)CCOCc1ccc(cc1Cl)F 34a_100000757172_100011216360 [0,2,0,0,0,0|2,0,0]=4 17093 B15R1.5821 NC(=O)CCOCc1ccc(cc1Cl)F 34a_100011219954_100000731001 [0,2,0,0,0,0|2,0,0]=4 17094 B15R1.5821 NC(=O)CCOCc1ccc(cc1Cl)F 7a_100000757172_100011216360 [0,2,0,0,0,0|2,0,0]=4 17095 B15R1.5821 NC(=O)CCOCc1ccc(cc1Cl)F 7a_100011219954_100000744528 [0,2,0,0,0,0|2,0,0]=4 17096 B15R1.5821 NC(=O)CCOCc1ccc(cc1Cl)N 34a_100000689119_100000731001 [0,2,0,0,0,0|2,0,0]=4 17097 B15R1.5821 NC(=O)CCOCc1ccc(cc1F)Br 34a_100000757172_100000211606 [0,2,0,0,0,0|2,0,0]=4 17098 B15R1.5821 NC(=O)CCOCc1ccc(cc1F)Br 34a_100011191541_100000731001 [0,2,0,0,0,0|2,0,0]=4 17099 B15R1.5821 NC(=O)CCOCc1ccc(cc1F)Br 7a_100000757172_100000211606 [0,2,0,0,0,0|2,0,0]=4 17100 B15R1.5821 NC(=O)CCOCc1ccc(cc1F)Br 7a_100011191541_100000744528 [0,2,0,0,0,0|2,0,0]=4 17101 B15R1.5821 NC(=O)CCOCc1ccc(cc1F)Cl 34a_100000757172_100000709361 [0,2,0,0,0,0|2,0,0]=4 17102 B15R1.5821 NC(=O)CCOCc1ccc(cc1F)Cl 34a_100011217562_100000731001 [0,2,0,0,0,0|2,0,0]=4 17103 B15R1.5821 NC(=O)CCOCc1ccc(cc1F)Cl 7a_100000757172_100000709361 [0,2,0,0,0,0|2,0,0]=4 17104 B15R1.5821 NC(=O)CCOCc1ccc(cc1F)Cl 7a_100011217562_100000744528 [0,2,0,0,0,0|2,0,0]=4 17105 B15R1.5821 NC(=O)CCOCc1ccc(cc1F)F 34a_100000757172_100000748237 [0,2,0,0,0,0|2,0,0]=4 17106 B15R1.5821 NC(=O)CCOCc1ccc(cc1F)F 34a_100011215441_100000731001 [0,2,0,0,0,0|2,0,0]=4 17107 B15R1.5821 NC(=O)CCOCc1ccc(cc1F)F 7a_100000757172_100000748237 [0,2,0,0,0,0|2,0,0]=4 17108 B15R1.5821 NC(=O)CCOCc1ccc(cc1F)F 7a_100011215441_100000744528 [0,2,0,0,0,0|2,0,0]=4 17109 B15R1.5821 NC(=O)CCOCc1ccc(cc1F)I 34a_100000757172_100010244991 [0,2,0,0,0,0|2,0,0]=4 17110 B15R1.5821 NC(=O)CCOCc1ccc(cc1F)I 34a_200010202041_100000731001 [0,2,0,0,0,0|2,0,0]=4 17111 B15R1.5821 NC(=O)CCOCc1ccc(cc1F)I 7a_100000757172_100010244991 [0,2,0,0,0,0|2,0,0]=4 17112 B15R1.5821 NC(=O)CCOCc1ccc(cc1F)I 7a_200010202041_100000744528 [0,2,0,0,0,0|2,0,0]=4 17113 B15R1.5821 NC(=O)CCOCc1ccc(cc1I)Br 34a_100000757172_100010146615 [0,2,0,0,0,0|2,0,0]=4 17114 B15R1.5821 NC(=O)CCOCc1ccc(cc1I)Br 7a_100000757172_100010146615 [0,2,0,0,0,0|2,0,0]=4 17115 B15R1.5821 NC(=O)CCOCc1ccc(cc1I)Br 7a_100010146605_100000744528 [0,2,0,0,0,0|2,0,0]=4 17116 B15R1.5821 NC(=O)CCOCc1ccc(cc1I)Cl 34a_100000722340_100000731001 [0,2,0,0,0,0|2,0,0]=4 17117 B15R1.5821 NC(=O)CCOCc1ccc(cc1I)Cl 34a_100000757172_100010254388 [0,2,0,0,0,0|2,0,0]=4 17118 B15R1.5821 NC(=O)CCOCc1ccc(cc1I)Cl 7a_100000722340_100000744528 [0,2,0,0,0,0|2,0,0]=4 17119 B15R1.5821 NC(=O)CCOCc1ccc(cc1I)Cl 7a_100000757172_100010254388 [0,2,0,0,0,0|2,0,0]=4 17120 B15R1.5821 NC(=O)CCOCc1ccc(cc1I)F 34a_100000757172_100012354799 [0,2,0,0,0,0|2,0,0]=4 17121 B15R1.5821 NC(=O)CCOCc1ccc(cc1I)F 34a_100011356828_100000731001 [0,2,0,0,0,0|2,0,0]=4 17122 B15R1.5821 NC(=O)CCOCc1ccc(cc1I)F 7a_100000757172_100012354799 [0,2,0,0,0,0|2,0,0]=4 17123 B15R1.5821 NC(=O)CCOCc1ccc(cc1I)F 7a_100011356828_100000744528 [0,2,0,0,0,0|2,0,0]=4 17124 B15R1.5821 NC(=O)CCOCc1ccc(cc1N)Br 34a_100000718831_100000731001 [0,2,0,0,0,0|2,0,0]=4 17125 B15R1.5821 NC(=O)CCOCc1ccc(cc1N)Br 7a_100000718831_100000744528 [0,2,0,0,0,0|2,0,0]=4 17126 B15R1.5821 NC(=O)CCOCc1ccc(cc1N)Cl 34a_100000238622_100000731001 [0,2,0,0,0,0|2,0,0]=4 17127 B15R1.5821 NC(=O)CCOCc1ccc(cc1N)Cl 7a_100000238622_100000744528 [0,2,0,0,0,0|2,0,0]=4 17128 B15R1.5821 NC(=O)CCOCc1ccc(cc1N)F 34a_100011996588_100000731001 [0,2,0,0,0,0|2,0,0]=4 17129 B15R1.5821 NC(=O)CCSCc1ccc(cc1Br)Br 62a_100000744528_200012351560 [0,2,0,0,0,0|2,0,0]=4 17130 B15R1.5821 NC(=O)CCSCc1ccc(cc1Br)Br 62a_200012351560_100000744528 [0,2,0,0,0,0|2,0,0]=4 17131 B15R1.5821 NC(=O)CCSCc1ccc(cc1Br)Cl 62a_100000744528_100000755608 [0,2,0,0,0,0|2,0,0]=4 17132 B15R1.5821 NC(=O)CCSCc1ccc(cc1Br)Cl 62a_100000755608_100000744528 [0,2,0,0,0,0|2,0,0]=4 17133 B15R1.5821 NC(=O)CCSCc1ccc(cc1Br)F 62a_100000243222_100000744528 [0,2,0,0,0,0|2,0,0]=4 17134 B15R1.5821 NC(=O)CCSCc1ccc(cc1Br)F 62a_100000744528_100000243222 [0,2,0,0,0,0|2,0,0]=4 17135 B15R1.5821 NC(=O)CCSCc1ccc(cc1Br)I 62a_100000744528_100010146610 [0,2,0,0,0,0|2,0,0]=4 17136 B15R1.5821 NC(=O)CCSCc1ccc(cc1Br)I 62a_100010146610_100000744528 [0,2,0,0,0,0|2,0,0]=4 17137 B15R1.5821 NC(=O)CCSCc1ccc(cc1Cl)Br 62a_100000744528_100011740631 [0,2,0,0,0,0|2,0,0]=4 17138 B15R1.5821 NC(=O)CCSCc1ccc(cc1Cl)Br 62a_100011740631_100000744528 [0,2,0,0,0,0|2,0,0]=4 17139 B15R1.5821 NC(=O)CCSCc1ccc(cc1Cl)Cl 62a_100000188473_100000744528 [0,2,0,0,0,0|2,0,0]=4 17140 B15R1.5821 NC(=O)CCSCc1ccc(cc1Cl)Cl 62a_100000744528_100000188473 [0,2,0,0,0,0|2,0,0]=4 17141 B15R1.5821 NC(=O)CCSCc1ccc(cc1Cl)F 62a_100000187853_100000744528 [0,2,0,0,0,0|2,0,0]=4 17142 B15R1.5821 NC(=O)CCSCc1ccc(cc1Cl)F 62a_100000744528_100000187853 [0,2,0,0,0,0|2,0,0]=4 17143 B15R1.5821 NC(=O)CCSCc1ccc(cc1F)Br 62a_100000211606_100000744528 [0,2,0,0,0,0|2,0,0]=4 17144 B15R1.5821 NC(=O)CCSCc1ccc(cc1F)Br 62a_100000744528_100000211606 [0,2,0,0,0,0|2,0,0]=4 17145 B15R1.5821 NC(=O)CCSCc1ccc(cc1F)Cl 62a_100000709361_100000744528 [0,2,0,0,0,0|2,0,0]=4 17146 B15R1.5821 NC(=O)CCSCc1ccc(cc1F)Cl 62a_100000744528_100000709361 [0,2,0,0,0,0|2,0,0]=4 17147 B15R1.5821 NC(=O)CCSCc1ccc(cc1F)F 62a_100000744528_100000748237 [0,2,0,0,0,0|2,0,0]=4 17148 B15R1.5821 NC(=O)CCSCc1ccc(cc1F)F 62a_100000748237_100000744528 [0,2,0,0,0,0|2,0,0]=4 17149 B15R1.5821 NC(=O)CCSCc1ccc(cc1F)I 62a_100000744528_100010244991 [0,2,0,0,0,0|2,0,0]=4 17150 B15R1.5821 NC(=O)CCSCc1ccc(cc1F)I 62a_100010244991_100000744528 [0,2,0,0,0,0|2,0,0]=4 17151 B15R1.5821 NC(=O)CCSCc1ccc(cc1I)Br 62a_100000744528_100010146615 [0,2,0,0,0,0|2,0,0]=4 17152 B15R1.5821 NC(=O)CCSCc1ccc(cc1I)Br 62a_100010146615_100000744528 [0,2,0,0,0,0|2,0,0]=4 17153 B15R1.5821 NC(=O)CCSCc1ccc(cc1I)Cl 62a_100000744528_100010254388 [0,2,0,0,0,0|2,0,0]=4 17154 B15R1.5821 NC(=O)CCSCc1ccc(cc1I)Cl 62a_100010254388_100000744528 [0,2,0,0,0,0|2,0,0]=4 17155 B15R1.5821 NC(=O)CCSCc1ccc(cc1I)F 62a_100000744528_100012354799 [0,2,0,0,0,0|2,0,0]=4 17156 B15R1.5821 NC(=O)CCSCc1ccc(cc1I)F 62a_100012354799_100000744528 [0,2,0,0,0,0|2,0,0]=4 17157 B15R1.5821 NC(=O)CNCCc1ccc(cc1Br)Cl 2230a_100000711301_200012945151 [0,2,0,0,0,0|2,0,0]=4 17158 B15R1.5821 NC(=O)CNCCc1ccc(cc1Cl)Cl 2230a_100000210994_100000747473 [0,2,0,0,0,0|2,0,0]=4 17159 B15R1.5821 NC(=O)CNCCc1ccc(cc1Cl)Cl 2230a_100000711301_200012161198 [0,2,0,0,0,0|2,0,0]=4 17160 B15R1.5821 NC(=O)CNCCc1ccc(cc1Cl)Cl 34a_100000210994_100000187820 [0,2,0,0,0,0|2,0,0]=4 17161 B15R1.5821 NC(=O)CNCCc1ccc(cc1F)Cl 2230a_103496529009_100000747473 [0,2,0,0,0,0|2,0,0]=4 17162 B15R1.5821 NC(=O)CNCCc1ccc(cc1F)Cl 34a_103496529009_100000187820 [0,2,0,0,0,0|2,0,0]=4 17163 B15R1.5821 NC(=O)CNCCc1ccc(cc1F)F 2230a_100000754870_100000747473 [0,2,0,0,0,0|2,0,0]=4 17164 B15R1.5821 NC(=O)CNCCc1ccc(cc1F)F 34a_100000754870_100000187820 [0,2,0,0,0,0|2,0,0]=4 17165 B15R1.5821 NC(=O)COCCc1ccc(cc1Cl)Br 34a_100013445822_100000187820 [0,2,0,0,0,0|2,0,0]=4 17166 B15R1.5821 NC(=O)COCCc1ccc(cc1Cl)Br 7a_100013445822_100000187820 [0,2,0,0,0,0|2,0,0]=4 17167 B15R1.5821 NC(=O)COCCc1ccc(cc1Cl)Cl 34a_100011215701_100000187820 [0,2,0,0,0,0|2,0,0]=4 17168 B15R1.5821 NC(=O)COCCc1ccc(cc1Cl)Cl 7a_100011215701_100000187820 [0,2,0,0,0,0|2,0,0]=4 17169 B15R1.5821 NC(=O)COCCc1ccc(cc1Cl)F 34a_100011962860_100000187820 [0,2,0,0,0,0|2,0,0]=4 17170 B15R1.5821 NC(=O)COCCc1ccc(cc1Cl)F 7a_100011962860_100000187820 [0,2,0,0,0,0|2,0,0]=4 17171 B15R1.5821 NC(=O)COCCc1ccc(cc1F)Br 34a_100011962869_100000187820 [0,2,0,0,0,0|2,0,0]=4 17172 B15R1.5821 NC(=O)COCCc1ccc(cc1F)Br 7a_100011962869_100000187820 [0,2,0,0,0,0|2,0,0]=4 17173 B15R1.5821 NC(=O)COCCc1ccc(cc1F)F 34a_100000697962_100000187820 [0,2,0,0,0,0|2,0,0]=4 17174 B15R1.5821 NC(=O)COCCc1ccc(cc1F)F 7a_100000697962_100000187820 [0,2,0,0,0,0|2,0,0]=4 17175 B15R1.5821 NC(=O)CSCCc1ccc(cc1Br)Cl 62a_100000747473_200012945151 [0,2,0,0,0,0|2,0,0]=4 17176 B15R1.5821 NC(=O)CSCCc1ccc(cc1Br)Cl 62a_200012945151_100000747473 [0,2,0,0,0,0|2,0,0]=4 17177 B15R1.5821 NC(=O)CSCCc1ccc(cc1Cl)Cl 62a_100000747473_200012161198 [0,2,0,0,0,0|2,0,0]=4 17178 B15R1.5821 NC(=O)CSCCc1ccc(cc1Cl)Cl 62a_200012161198_100000747473 [0,2,0,0,0,0|2,0,0]=4 17179 B15R1.5821 O=C(O)CNCCc1ccc(cc1Br)Cl 269956a_100016091260_200012945151 [0,2,0,0,0,0|1,0,0]=3 17180 B15R1.5821 O=C(O)CNCCc1ccc(cc1Cl)Cl 269956a_100016091260_200012161198 [0,2,0,0,0,0|1,0,0]=3 17181 B15R1.5821 O=C(O)CONCc1ccc(cc1Br)Br 269956a_100000106656_200012351560 [0,2,0,0,0,0|2,0,0]=4 17182 B15R1.5821 O=C(O)CONCc1ccc(cc1Br)Cl 269956a_100000106656_100000755608 [0,2,0,0,0,0|2,0,0]=4 17183 B15R1.5821 O=C(O)CONCc1ccc(cc1Br)F 269956a_100000106656_100000243222 [0,2,0,0,0,0|2,0,0]=4 17184 B15R1.5821 O=C(O)CONCc1ccc(cc1Br)I 269956a_100000106656_100010146610 [0,2,0,0,0,0|2,0,0]=4 17185 B15R1.5821 O=C(O)CONCc1ccc(cc1Cl)Br 269956a_100000106656_100011740631 [0,2,0,0,0,0|2,0,0]=4 17186 B15R1.5821 O=C(O)CONCc1ccc(cc1Cl)Cl 269956a_100000106656_100000188473 [0,2,0,0,0,0|2,0,0]=4 17187 B15R1.5821 O=C(O)CONCc1ccc(cc1Cl)F 269956a_100000106656_100000187853 [0,2,0,0,0,0|2,0,0]=4 17188 B15R1.5821 O=C(O)CONCc1ccc(cc1F)Br 269956a_100000106656_100000211606 [0,2,0,0,0,0|2,0,0]=4 17189 B15R1.5821 O=C(O)CONCc1ccc(cc1F)Cl 269956a_100000106656_100000709361 [0,2,0,0,0,0|2,0,0]=4 17190 B15R1.5821 O=C(O)CONCc1ccc(cc1F)F 269956a_100000106656_100000748237 [0,2,0,0,0,0|2,0,0]=4 17191 B15R1.5821 O=C(O)CONCc1ccc(cc1F)I 269956a_100000106656_100010244991 [0,2,0,0,0,0|2,0,0]=4 17192 B15R1.5821 O=C(O)CONCc1ccc(cc1I)Br 269956a_100000106656_100010146615 [0,2,0,0,0,0|2,0,0]=4 17193 B15R1.5821 O=C(O)CONCc1ccc(cc1I)Cl 269956a_100000106656_100010254388 [0,2,0,0,0,0|2,0,0]=4 17194 B15R1.5821 O=C(O)CONCc1ccc(cc1I)F 269956a_100000106656_100012354799 [0,2,0,0,0,0|2,0,0]=4 17195 B15R1.5821 O=C([O-])CNCCc1ccc(cc1Cl)Cl 34a_100000210994_100020667443 [0,2,0,0,0,0|1,0,1]=4 17196 B15R1.5821 O=C([O-])CNCCc1ccc(cc1F)Cl 34a_103496529009_100020667443 [0,2,0,0,0,0|1,0,1]=4 17197 B15R1.5821 O=C([O-])CNCCc1ccc(cc1F)F 34a_100000754870_100020667443 [0,2,0,0,0,0|1,0,1]=4 17198 B15R1.5821 O=C([O-])COCCc1ccc(cc1Cl)Br 34a_100013445822_100020667443 [0,2,0,0,0,0|1,0,1]=4 17199 B15R1.5821 O=C([O-])COCCc1ccc(cc1Cl)Cl 34a_100011215701_100020667443 [0,2,0,0,0,0|1,0,1]=4 17200 B15R1.5821 O=C([O-])COCCc1ccc(cc1Cl)F 34a_100011962860_100020667443 [0,2,0,0,0,0|1,0,1]=4 17201 B15R1.5821 O=C([O-])COCCc1ccc(cc1F)Br 34a_100011962869_100020667443 [0,2,0,0,0,0|1,0,1]=4 17202 B15R1.5821 O=C([O-])COCCc1ccc(cc1F)F 34a_100000697962_100020667443 [0,2,0,0,0,0|1,0,1]=4 17203 B15R1.5821 O=C([O-])CSCCc1ccc(cc1Br)Cl 62a_100020667443_200012945151 [0,2,0,0,0,0|1,0,1]=4 17204 B15R1.5821 O=C([O-])CSCCc1ccc(cc1Br)Cl 62a_200012945151_100020667443 [0,2,0,0,0,0|1,0,1]=4 17205 B15R1.5821 O=C([O-])CSCCc1ccc(cc1Cl)Cl 62a_100020667443_200012161198 [0,2,0,0,0,0|1,0,1]=4 17206 B15R1.5821 O=C([O-])CSCCc1ccc(cc1Cl)Cl 62a_200012161198_100020667443 [0,2,0,0,0,0|1,0,1]=4 17207 B15R1.5821 [13CH3]C(=O)CCCOc1ccc(cc1Cl)Cl 1458a_100000186546_200025704644 [0,2,0,0,0,0|2,0,0]=4 17208 B15R1.5821 [13CH3]C(=O)CCCOc1ccc(cc1F)F 1458a_100000746133_200025704644 [0,2,0,0,0,0|2,0,0]=4 17209 B15R1.8019 CC(=O)CCCC(=O)c1ccccc1Br 1458a_100000188424_100011215641 [0,2,0,0,0,0|1,0,1]=4 17210 B15R1.8019 CC(=O)CCCC(=O)c1ccccc1C 1458a_100000212026_100011215641 [0,2,0,0,0,0|1,0,1]=4 17211 B15R1.8019 CC(=O)CCCC(=O)c1ccccc1Cl 1458a_100000185844_100011215641 [0,2,0,0,0,0|1,0,1]=4 17212 B15R1.8019 CC(=O)CCCC(=O)c1ccccc1F 1458a_100000188656_100011215641 [0,2,0,0,0,0|1,0,1]=4 17213 B15R1.8019 CC(=O)CCCC(=O)c1ccccc1I 1458a_100000187884_100011215641 [0,2,0,0,0,0|1,0,1]=4 17214 B15R1.8019 CC(=O)CCCC(=O)c1ccccc1O 1458a_100015234032_100011215641 [0,2,0,0,0,0|1,0,1]=4 17215 B15R1.8019 CC(=O)CCCC(=O)c1ccccc1[O-] 1458a_100009911694_100011215641 [0,2,0,0,0,0|1,0,1]=4 17216 B15R1.8019 CC(=O)CCCN(C)c1ccccc1Br 269982a_100020606079_100011215641 [0,2,0,0,0,0|2,0,0]=4 17217 B15R1.8019 CC(=O)CCCN(C)c1ccccc1Br 34a_100020606079_100000685027 [0,2,0,0,0,0|2,0,0]=4 17218 B15R1.8019 CC(=O)CCCN(C)c1ccccc1C 269982a_100000219699_100011215641 [0,2,0,0,0,0|2,0,0]=4 17219 B15R1.8019 CC(=O)CCCN(C)c1ccccc1C 34a_100000219699_100000685027 [0,2,0,0,0,0|2,0,0]=4 17220 B15R1.8019 CC(=O)CCCN(C)c1ccccc1Cl 269982a_100000219374_100011215641 [0,2,0,0,0,0|2,0,0]=4 17221 B15R1.8019 CC(=O)CCCN(C)c1ccccc1Cl 34a_100000219374_100000685027 [0,2,0,0,0,0|2,0,0]=4 17222 B15R1.8019 CC(=O)CCCN(C)c1ccccc1F 269982a_100000220357_100011215641 [0,2,0,0,0,0|2,0,0]=4 17223 B15R1.8019 CC(=O)CCCN(C)c1ccccc1F 34a_100000220357_100000685027 [0,2,0,0,0,0|2,0,0]=4 17224 B15R1.8019 CC(=O)CCCN(C)c1ccccc1O 269982a_100000033821_100011215641 [0,2,0,0,0,0|2,0,0]=4 17225 B15R1.8019 CC(=O)CCOC(C)c1ccccc1Br 7a_100000702211_100000053229 [0,2,0,0,0,0|2,0,0]=4 17226 B15R1.8019 CC(=O)CCOC(C)c1ccccc1C 7a_100000742021_100000053229 [0,2,0,0,0,0|2,0,0]=4 17227 B15R1.8019 CC(=O)CCOC(C)c1ccccc1Cl 7a_100000740796_100000053229 [0,2,0,0,0,0|2,0,0]=4 17228 B15R1.8019 CC(=O)CCOC(C)c1ccccc1Cl 7a_100000759926_100000181259 [0,2,0,0,0,0|2,0,0]=4 17229 B15R1.8019 CC(=O)CCOC(C)c1ccccc1F 34a_100000759926_200000741388 [0,2,0,0,0,0|2,0,0]=4 17230 B15R1.8019 CC(=O)CCOC(C)c1ccccc1F 7a_100000697922_100000053229 [0,2,0,0,0,0|2,0,0]=4 17231 B15R1.8019 CC(=O)CCOC(C)c1ccccc1F 7a_100000759926_200000741388 [0,2,0,0,0,0|2,0,0]=4 17232 B15R1.8019 CC(=O)CCOC(C)c1ccccc1N 7a_100011405641_100000053229 [0,2,0,0,0,0|2,0,0]=4 17233 B15R1.8019 CC(=O)CCSC(C)c1ccccc1Cl 62a_100000053229_100000181259 [0,2,0,0,0,0|2,0,0]=4 17234 B15R1.8019 CC(=O)CCSC(C)c1ccccc1Cl 62a_100000181259_100000053229 [0,2,0,0,0,0|2,0,0]=4 17235 B15R1.8019 CC(=O)CCSC(C)c1ccccc1F 62a_100000053229_200000741388 [0,2,0,0,0,0|2,0,0]=4 17236 B15R1.8019 CC(=O)CCSC(C)c1ccccc1F 62a_200000741388_100000053229 [0,2,0,0,0,0|2,0,0]=4 17237 B15R1.8019 CC(NCCC(=O)N)c1ccccc1Br 2230a_100000181357_100000744528 [0,2,0,0,0,0|2,0,0]=4 17238 B15R1.8019 CC(NCCC(=O)N)c1ccccc1Br 269862a_100000740010_100000187085 [0,2,0,0,0,0|2,0,0]=4 17239 B15R1.8019 CC(NCCC(=O)N)c1ccccc1Cl 2230a_100000174978_100000744528 [0,2,0,0,0,0|2,0,0]=4 17240 B15R1.8019 CC(NCCC(=O)N)c1ccccc1Cl 269862a_100000740010_100000210134 [0,2,0,0,0,0|2,0,0]=4 17241 B15R1.8019 CC(NCCC(=O)N)c1ccccc1Cl 34a_100000174978_100000731001 [0,2,0,0,0,0|2,0,0]=4 17242 B15R1.8019 CC(NCCC(=O)N)c1ccccc1F 2230a_100000181408_100000744528 [0,2,0,0,0,0|2,0,0]=4 17243 B15R1.8019 CC(NCCC(=O)N)c1ccccc1F 269862a_100000740010_100000210632 [0,2,0,0,0,0|2,0,0]=4 17244 B15R1.8019 CC(NCCC(=O)N)c1ccccc1F 34a_100000181408_100000731001 [0,2,0,0,0,0|2,0,0]=4 17245 B15R1.8019 CC(NCCC(=O)N)c1ccccc1I 269862a_100000740010_100000751169 [0,2,0,0,0,0|2,0,0]=4 17246 B15R1.8019 CC(NOCC(=O)O)c1ccccc1Cl 269956a_100000106656_100000181259 [0,2,0,0,0,0|2,0,0]=4 17247 B15R1.8019 CC(NOCC(=O)O)c1ccccc1F 269956a_100000106656_200000741388 [0,2,0,0,0,0|2,0,0]=4 17248 B15R1.8019 CC(OCCC(=O)N)c1ccccc1Br 34a_100000702211_100000731001 [0,2,0,0,0,0|2,0,0]=4 17249 B15R1.8019 CC(OCCC(=O)N)c1ccccc1Br 7a_100000702211_100000744528 [0,2,0,0,0,0|2,0,0]=4 17250 B15R1.8019 CC(OCCC(=O)N)c1ccccc1Cl 34a_100000740796_100000731001 [0,2,0,0,0,0|2,0,0]=4 17251 B15R1.8019 CC(OCCC(=O)N)c1ccccc1Cl 7a_100000740796_100000744528 [0,2,0,0,0,0|2,0,0]=4 17252 B15R1.8019 CC(OCCC(=O)N)c1ccccc1Cl 7a_100000757172_100000181259 [0,2,0,0,0,0|2,0,0]=4 17253 B15R1.8019 CC(OCCC(=O)N)c1ccccc1F 34a_100000697922_100000731001 [0,2,0,0,0,0|2,0,0]=4 17254 B15R1.8019 CC(OCCC(=O)N)c1ccccc1F 34a_100000757172_200000741388 [0,2,0,0,0,0|2,0,0]=4 17255 B15R1.8019 CC(OCCC(=O)N)c1ccccc1F 7a_100000697922_100000744528 [0,2,0,0,0,0|2,0,0]=4 17256 B15R1.8019 CC(OCCC(=O)N)c1ccccc1F 7a_100000757172_200000741388 [0,2,0,0,0,0|2,0,0]=4 17257 B15R1.8019 CC(OCCC(=O)N)c1ccccc1N 7a_100011405641_100000744528 [0,2,0,0,0,0|2,0,0]=4 17258 B15R1.8019 CC(SCCC(=O)N)c1ccccc1Cl 62a_100000181259_100000744528 [0,2,0,0,0,0|2,0,0]=4 17259 B15R1.8019 CC(SCCC(=O)N)c1ccccc1Cl 62a_100000744528_100000181259 [0,2,0,0,0,0|2,0,0]=4 17260 B15R1.8019 CC(SCCC(=O)N)c1ccccc1F 62a_100000744528_200000741388 [0,2,0,0,0,0|2,0,0]=4 17261 B15R1.8019 CC(SCCC(=O)N)c1ccccc1F 62a_200000741388_100000744528 [0,2,0,0,0,0|2,0,0]=4 17262 B15R1.8019 CN(CCCC(=O)N)c1ccccc1Br 269982a_100020606079_100102525003 [0,2,0,0,0,0|2,0,0]=4 17263 B15R1.8019 CN(CCCC(=O)N)c1ccccc1Br 34a_100020606079_100102525003 [0,2,0,0,0,0|2,0,0]=4 17264 B15R1.8019 CN(CCCC(=O)N)c1ccccc1Cl 269982a_100000219374_100102525003 [0,2,0,0,0,0|2,0,0]=4 17265 B15R1.8019 CN(CCCC(=O)N)c1ccccc1Cl 34a_100000219374_100102525003 [0,2,0,0,0,0|2,0,0]=4 17266 B15R1.8019 CN(CCCC(=O)N)c1ccccc1F 269982a_100000220357_100102525003 [0,2,0,0,0,0|2,0,0]=4 17267 B15R1.8019 CN(CCCC(=O)N)c1ccccc1F 34a_100000220357_100102525003 [0,2,0,0,0,0|2,0,0]=4 17268 B15R1.8019 CN(CCCC(=O)N)c1ccccc1O 269982a_100000033821_100102525003 [0,2,0,0,0,0|2,0,0]=4 17269 B15R1.8019 C[C@@H](NCCC(=O)N)c1ccccc1O 2230a_100025703389_100000744528 [0,2,0,0,0,0|2,0,0]=4 17270 B15R1.8019 Cc1ccccc1C(=O)CCCC(=O)N 1458a_100000212026_100102525003 [0,2,0,0,0,0|1,0,1]=4 17271 B15R1.8019 Cc1ccccc1C(=O)CNCC(=O)O 269956a_100016091260_100000741374 [0,2,0,0,0,0|1,0,1]=4 17272 B15R1.8019 Cc1ccccc1C(C)NCCC(=O)N 2230a_100000181355_100000744528 [0,2,0,0,0,0|2,0,0]=4 17273 B15R1.8019 Cc1ccccc1C(C)NCCC(=O)N 269862a_100000740010_100000211656 [0,2,0,0,0,0|2,0,0]=4 17274 B15R1.8019 Cc1ccccc1C(C)NCCC(=O)N 34a_100000181355_100000731001 [0,2,0,0,0,0|2,0,0]=4 17275 B15R1.8019 Cc1ccccc1C(C)OCCC(=O)N 34a_100000742021_100000731001 [0,2,0,0,0,0|2,0,0]=4 17276 B15R1.8019 Cc1ccccc1C(C)OCCC(=O)N 7a_100000742021_100000744528 [0,2,0,0,0,0|2,0,0]=4 17277 B15R1.8019 Cc1ccccc1N(C)CCCC(=O)N 269982a_100000219699_100102525003 [0,2,0,0,0,0|2,0,0]=4 17278 B15R1.8019 Cc1ccccc1N(C)CCCC(=O)N 34a_100000219699_100102525003 [0,2,0,0,0,0|2,0,0]=4 17279 B15R1.8019 NC(=O)CCCC(=O)c1ccccc1Br 1458a_100000188424_100102525003 [0,2,0,0,0,0|1,0,1]=4 17280 B15R1.8019 NC(=O)CCCC(=O)c1ccccc1Cl 1458a_100000185844_100102525003 [0,2,0,0,0,0|1,0,1]=4 17281 B15R1.8019 NC(=O)CCCC(=O)c1ccccc1F 1458a_100000188656_100102525003 [0,2,0,0,0,0|1,0,1]=4 17282 B15R1.8019 NC(=O)CCCC(=O)c1ccccc1I 1458a_100000187884_100102525003 [0,2,0,0,0,0|1,0,1]=4 17283 B15R1.8019 NC(=O)CCCC(=O)c1ccccc1O 1458a_100015234032_100102525003 [0,2,0,0,0,0|1,0,1]=4 17284 B15R1.8019 NC(=O)CCCC(=O)c1ccccc1[O-] 1458a_100009911694_100102525003 [0,2,0,0,0,0|1,0,1]=4 17285 B15R1.8019 NC(=O)CNCC(O)c1ccccc1Br 2230a_100011236429_100000747473 [0,2,0,0,0,0|2,0,0]=4 17286 B15R1.8019 NC(=O)CNCC(O)c1ccccc1Cl 2230a_200000759403_100000747473 [0,2,0,0,0,0|2,0,0]=4 17287 B15R1.8019 NC(=O)CNCC(O)c1ccccc1Cl 34a_200000759403_100000187820 [0,2,0,0,0,0|2,0,0]=4 17288 B15R1.8019 NC(=O)COCC(N)c1ccccc1Cl 34a_100138412506_100000187820 [0,2,0,0,0,0|2,0,0]=4 17289 B15R1.8019 NC(=O)COC[C@@H](N)c1ccccc1Br 34a_100161155918_100000187820 [0,2,0,0,0,0|2,0,0]=4 17290 B15R1.8019 NC(=O)COC[C@H](N)c1ccccc1F 34a_100009818778_100000187820 [0,2,0,0,0,0|2,0,0]=4 17291 B15R1.8019 NC(COCC(=O)[O-])c1ccccc1Cl 34a_100138412506_100020667443 [0,2,0,0,0,0|1,0,1]=4 17292 B15R1.8019 N[C@@H](COCC(=O)[O-])c1ccccc1F 34a_100009818778_100020667443 [0,2,0,0,0,0|1,0,1]=4 17293 B15R1.8019 N[C@H](COCC(=O)[O-])c1ccccc1Br 34a_100161155918_100020667443 [0,2,0,0,0,0|1,0,1]=4 17294 B15R1.8019 O=C(O)CNCC(=O)c1ccccc1Br 269956a_100016091260_100000199116 [0,2,0,0,0,0|1,0,1]=4 17295 B15R1.8019 O=C(O)CNCC(=O)c1ccccc1Cl 269956a_100016091260_100000211432 [0,2,0,0,0,0|1,0,1]=4 17296 B15R1.8019 O=C(O)CNCC(=O)c1ccccc1F 269956a_100016091260_100000204681 [0,2,0,0,0,0|1,0,1]=4 17297 B15R1.8019 O=C(O)CNCC(=O)c1ccccc1O 269956a_100016091260_100000188908 [0,2,0,0,0,0|1,0,1]=4 17298 B15R1.8019 O=C([O-])CNCC(O)c1ccccc1Cl 34a_200000759403_100020667443 [0,2,0,0,0,0|1,0,1]=4 17299 B15R1.8290 CC(=O)CCCNc1c(cccc1Br)Br 34a_100000690995_100000685027 [0,2,0,0,0,0|2,0,0]=4 17300 B15R1.8290 CC(=O)CCCNc1c(cccc1Br)C 34a_100011834072_100000685027 [0,2,0,0,0,0|2,0,0]=4 17301 B15R1.8290 CC(=O)CCCNc1c(cccc1Br)Cl 34a_100102946385_100000685027 [0,2,0,0,0,0|2,0,0]=4 17302 B15R1.8290 CC(=O)CCCNc1c(cccc1Br)F 34a_100000684712_100000685027 [0,2,0,0,0,0|2,0,0]=4 17303 B15R1.8290 CC(=O)CCCNc1c(cccc1Br)O 34a_100011934926_100000685027 [0,2,0,0,0,0|2,0,0]=4 17304 B15R1.8290 CC(=O)CCCNc1c(cccc1C)C 34a_100000185769_100000685027 [0,2,0,0,0,0|2,0,0]=4 17305 B15R1.8290 CC(=O)CCCNc1c(cccc1Cl)C 34a_100000756524_100000685027 [0,2,0,0,0,0|2,0,0]=4 17306 B15R1.8290 CC(=O)CCCNc1c(cccc1Cl)Cl 34a_100000210028_100000685027 [0,2,0,0,0,0|2,0,0]=4 17307 B15R1.8290 CC(=O)CCCNc1c(cccc1Cl)F 34a_100000760031_100000685027 [0,2,0,0,0,0|2,0,0]=4 17308 B15R1.8290 CC(=O)CCCNc1c(cccc1Cl)O 34a_100012022510_100000685027 [0,2,0,0,0,0|2,0,0]=4 17309 B15R1.8290 CC(=O)CCCNc1c(cccc1F)C 34a_100000766463_100000685027 [0,2,0,0,0,0|2,0,0]=4 17310 B15R1.8290 CC(=O)CCCNc1c(cccc1F)F 34a_100000210704_100000685027 [0,2,0,0,0,0|2,0,0]=4 17311 B15R1.8290 CC(=O)CCCNc1c(cccc1F)O 34a_100020591140_100000685027 [0,2,0,0,0,0|2,0,0]=4 17312 B15R1.8290 CC(=O)CCCNc1c(cccc1I)F 34a_100000042321_100000685027 [0,2,0,0,0,0|2,0,0]=4 17313 B15R1.8290 CC(=O)CCCNc1c(cccc1O)C 34a_100000743429_100000685027 [0,2,0,0,0,0|2,0,0]=4 17314 B15R1.8290 CC(=O)CCCOc1c(cccc1Br)Br 34a_100000736428_100000685027 [0,2,0,0,0,0|2,0,0]=4 17315 B15R1.8290 CC(=O)CCCOc1c(cccc1Br)Br 7a_100000736428_100011215641 [0,2,0,0,0,0|2,0,0]=4 17316 B15R1.8290 CC(=O)CCCOc1c(cccc1Br)C 34a_100009817157_100000685027 [0,2,0,0,0,0|2,0,0]=4 17317 B15R1.8290 CC(=O)CCCOc1c(cccc1Br)C 7a_100009817157_100011215641 [0,2,0,0,0,0|2,0,0]=4 17318 B15R1.8290 CC(=O)CCCOc1c(cccc1Br)Cl 34a_100010214474_100000685027 [0,2,0,0,0,0|2,0,0]=4 17319 B15R1.8290 CC(=O)CCCOc1c(cccc1Br)Cl 7a_100010214474_100011215641 [0,2,0,0,0,0|2,0,0]=4 17320 B15R1.8290 CC(=O)CCCOc1c(cccc1Br)F 34a_100009813666_100000685027 [0,2,0,0,0,0|2,0,0]=4 17321 B15R1.8290 CC(=O)CCCOc1c(cccc1Br)F 7a_100009813666_100011215641 [0,2,0,0,0,0|2,0,0]=4 17322 B15R1.8290 CC(=O)CCCOc1c(cccc1Br)N 34a_100011934915_100000685027 [0,2,0,0,0,0|2,0,0]=4 17323 B15R1.8290 CC(=O)CCCOc1c(cccc1C)C 34a_100000210341_100000685027 [0,2,0,0,0,0|2,0,0]=4 17324 B15R1.8290 CC(=O)CCCOc1c(cccc1C)C 7a_100000210341_100011215641 [0,2,0,0,0,0|2,0,0]=4 17325 B15R1.8290 CC(=O)CCCOc1c(cccc1Cl)C 34a_100000033731_100000685027 [0,2,0,0,0,0|2,0,0]=4 17326 B15R1.8290 CC(=O)CCCOc1c(cccc1Cl)C 7a_100000033731_100011215641 [0,2,0,0,0,0|2,0,0]=4 17327 B15R1.8290 CC(=O)CCCOc1c(cccc1Cl)Cl 34a_100000211709_100000685027 [0,2,0,0,0,0|2,0,0]=4 17328 B15R1.8290 CC(=O)CCCOc1c(cccc1Cl)Cl 7a_100000211709_100011215641 [0,2,0,0,0,0|2,0,0]=4 17329 B15R1.8290 CC(=O)CCCOc1c(cccc1Cl)F 34a_100000694953_100000685027 [0,2,0,0,0,0|2,0,0]=4 17330 B15R1.8290 CC(=O)CCCOc1c(cccc1Cl)F 7a_100000694953_100011215641 [0,2,0,0,0,0|2,0,0]=4 17331 B15R1.8290 CC(=O)CCCOc1c(cccc1Cl)N 34a_100000754742_100000685027 [0,2,0,0,0,0|2,0,0]=4 17332 B15R1.8290 CC(=O)CCCOc1c(cccc1F)C 34a_100011659162_100000685027 [0,2,0,0,0,0|2,0,0]=4 17333 B15R1.8290 CC(=O)CCCOc1c(cccc1F)C 7a_100011659162_100011215641 [0,2,0,0,0,0|2,0,0]=4 17334 B15R1.8290 CC(=O)CCCOc1c(cccc1F)F 34a_100000230165_100000685027 [0,2,0,0,0,0|2,0,0]=4 17335 B15R1.8290 CC(=O)CCCOc1c(cccc1F)F 7a_100000230165_100011215641 [0,2,0,0,0,0|2,0,0]=4 17336 B15R1.8290 CC(=O)CCCOc1c(cccc1F)N 34a_100011934987_100000685027 [0,2,0,0,0,0|2,0,0]=4 17337 B15R1.8290 CC(=O)CCCOc1c(cccc1I)Br 34a_100010084509_100000685027 [0,2,0,0,0,0|2,0,0]=4 17338 B15R1.8290 CC(=O)CCCOc1c(cccc1I)Br 7a_100010084509_100011215641 [0,2,0,0,0,0|2,0,0]=4 17339 B15R1.8290 CC(=O)CCCOc1c(cccc1I)Cl 34a_100010202889_100000685027 [0,2,0,0,0,0|2,0,0]=4 17340 B15R1.8290 CC(=O)CCCOc1c(cccc1I)Cl 7a_100010202889_100011215641 [0,2,0,0,0,0|2,0,0]=4 17341 B15R1.8290 CC(=O)CCCOc1c(cccc1I)F 34a_100010186298_100000685027 [0,2,0,0,0,0|2,0,0]=4 17342 B15R1.8290 CC(=O)CCCOc1c(cccc1I)F 7a_100010186298_100011215641 [0,2,0,0,0,0|2,0,0]=4 17343 B15R1.8290 CC(=O)CCCOc1c(cccc1I)N 34a_100010084371_100000685027 [0,2,0,0,0,0|2,0,0]=4 17344 B15R1.8290 CC(=O)CCCOc1c(cccc1N)C 34a_100000756359_100000685027 [0,2,0,0,0,0|2,0,0]=4 17345 B15R1.8290 CC(=O)CCCOc1c(cccc1N)C 7a_100000756359_100011215641 [0,2,0,0,0,0|2,0,0]=4 17346 B15R1.8290 CC(=O)CCCOc1c(cccc1N)N 34a_200016994477_100000685027 [0,2,0,0,0,0|2,0,0]=4 17347 B15R1.8290 CC(=O)CCCSc1c(cccc1Br)Br 62a_100009994525_100011215641 [0,2,0,0,0,0|2,0,0]=4 17348 B15R1.8290 CC(=O)CCCSc1c(cccc1Br)Br 62a_100011215641_100009994525 [0,2,0,0,0,0|2,0,0]=4 17349 B15R1.8290 CC(=O)CCCSc1c(cccc1Br)C 62a_100010141302_100011215641 [0,2,0,0,0,0|2,0,0]=4 17350 B15R1.8290 CC(=O)CCCSc1c(cccc1Br)C 62a_100011215641_100010141302 [0,2,0,0,0,0|2,0,0]=4 17351 B15R1.8290 CC(=O)CCCSc1c(cccc1Br)Cl 62a_100010214488_100011215641 [0,2,0,0,0,0|2,0,0]=4 17352 B15R1.8290 CC(=O)CCCSc1c(cccc1Br)Cl 62a_100011215641_100010214488 [0,2,0,0,0,0|2,0,0]=4 17353 B15R1.8290 CC(=O)CCCSc1c(cccc1Br)F 62a_100011215641_100011219512 [0,2,0,0,0,0|2,0,0]=4 17354 B15R1.8290 CC(=O)CCCSc1c(cccc1Br)F 62a_100011219512_100011215641 [0,2,0,0,0,0|2,0,0]=4 17355 B15R1.8290 CC(=O)CCCSc1c(cccc1Br)N 62a_100011215641_100020590159 [0,2,0,0,0,0|2,0,0]=4 17356 B15R1.8290 CC(=O)CCCSc1c(cccc1Br)N 62a_100020590159_100011215641 [0,2,0,0,0,0|2,0,0]=4 17357 B15R1.8290 CC(=O)CCCSc1c(cccc1Br)O 62a_100010187912_100011215641 [0,2,0,0,0,0|2,0,0]=4 17358 B15R1.8290 CC(=O)CCCSc1c(cccc1Br)O 62a_100011215641_100010187912 [0,2,0,0,0,0|2,0,0]=4 17359 B15R1.8290 CC(=O)CCCSc1c(cccc1C)C 62a_100000033847_100011215641 [0,2,0,0,0,0|2,0,0]=4 17360 B15R1.8290 CC(=O)CCCSc1c(cccc1C)C 62a_100011215641_100000033847 [0,2,0,0,0,0|2,0,0]=4 17361 B15R1.8290 CC(=O)CCCSc1c(cccc1Cl)C 62a_100000043165_100011215641 [0,2,0,0,0,0|2,0,0]=4 17362 B15R1.8290 CC(=O)CCCSc1c(cccc1Cl)C 62a_100011215641_100000043165 [0,2,0,0,0,0|2,0,0]=4 17363 B15R1.8290 CC(=O)CCCSc1c(cccc1Cl)Cl 62a_100000034237_100011215641 [0,2,0,0,0,0|2,0,0]=4 17364 B15R1.8290 CC(=O)CCCSc1c(cccc1Cl)Cl 62a_100011215641_100000034237 [0,2,0,0,0,0|2,0,0]=4 17365 B15R1.8290 CC(=O)CCCSc1c(cccc1Cl)F 62a_100000050007_100011215641 [0,2,0,0,0,0|2,0,0]=4 17366 B15R1.8290 CC(=O)CCCSc1c(cccc1Cl)F 62a_100011215641_100000050007 [0,2,0,0,0,0|2,0,0]=4 17367 B15R1.8290 CC(=O)CCCSc1c(cccc1Cl)N 62a_100000049713_100011215641 [0,2,0,0,0,0|2,0,0]=4 17368 B15R1.8290 CC(=O)CCCSc1c(cccc1Cl)N 62a_100011215641_100000049713 [0,2,0,0,0,0|2,0,0]=4 17369 B15R1.8290 CC(=O)CCCSc1c(cccc1Cl)O 62a_100011215641_100000050174 [0,2,0,0,0,0|2,0,0]=4 17370 B15R1.8290 CC(=O)CCCSc1c(cccc1F)C 62a_100011215641_100011218421 [0,2,0,0,0,0|2,0,0]=4 17371 B15R1.8290 CC(=O)CCCSc1c(cccc1F)C 62a_100011218421_100011215641 [0,2,0,0,0,0|2,0,0]=4 17372 B15R1.8290 CC(=O)CCCSc1c(cccc1F)F 62a_100000693133_100011215641 [0,2,0,0,0,0|2,0,0]=4 17373 B15R1.8290 CC(=O)CCCSc1c(cccc1F)F 62a_100011215641_100000693133 [0,2,0,0,0,0|2,0,0]=4 17374 B15R1.8290 CC(=O)CCCSc1c(cccc1F)N 62a_100000690935_100011215641 [0,2,0,0,0,0|2,0,0]=4 17375 B15R1.8290 CC(=O)CCCSc1c(cccc1F)N 62a_100011215641_100000690935 [0,2,0,0,0,0|2,0,0]=4 17376 B15R1.8290 CC(=O)CCCSc1c(cccc1F)O 62a_100009820682_100011215641 [0,2,0,0,0,0|2,0,0]=4 17377 B15R1.8290 CC(=O)CCCSc1c(cccc1F)O 62a_100011215641_100009820682 [0,2,0,0,0,0|2,0,0]=4 17378 B15R1.8290 CC(=O)CCCSc1c(cccc1N)C 62a_100000684715_100011215641 [0,2,0,0,0,0|2,0,0]=4 17379 B15R1.8290 CC(=O)CCCSc1c(cccc1N)C 62a_100011215641_100000684715 [0,2,0,0,0,0|2,0,0]=4 17380 B15R1.8290 CC(=O)CCCSc1c(cccc1O)C 62a_100000686692_100011215641 [0,2,0,0,0,0|2,0,0]=4 17381 B15R1.8290 CC(=O)CCCSc1c(cccc1O)C 62a_100011215641_100000686692 [0,2,0,0,0,0|2,0,0]=4 17382 B15R1.8290 CC(=O)CCCSc1c(cccc1O)N 62a_100011215641_100012183704 [0,2,0,0,0,0|2,0,0]=4 17383 B15R1.8290 CC(=O)CCCSc1c(cccc1O)N 62a_100012183704_100011215641 [0,2,0,0,0,0|2,0,0]=4 17384 B15R1.8290 CC(=O)CCCSc1c(cccc1O)O 62a_100011215641_100010205330 [0,2,0,0,0,0|2,0,0]=4 17385 B15R1.8290 CC(=O)CCOCc1c(cccc1Br)Br 7a_100010172814_100000053229 [0,2,0,0,0,0|2,0,0]=4 17386 B15R1.8290 CC(=O)CCOCc1c(cccc1Br)C 34a_100000759926_100010146847 [0,2,0,0,0,0|2,0,0]=4 17387 B15R1.8290 CC(=O)CCOCc1c(cccc1Br)C 7a_100000759926_100010146847 [0,2,0,0,0,0|2,0,0]=4 17388 B15R1.8290 CC(=O)CCOCc1c(cccc1Br)Cl 34a_100000759926_100010138402 [0,2,0,0,0,0|2,0,0]=4 17389 B15R1.8290 CC(=O)CCOCc1c(cccc1Br)Cl 7a_100000759926_100010138402 [0,2,0,0,0,0|2,0,0]=4 17390 B15R1.8290 CC(=O)CCOCc1c(cccc1Br)F 34a_100000759926_100012145669 [0,2,0,0,0,0|2,0,0]=4 17391 B15R1.8290 CC(=O)CCOCc1c(cccc1Br)F 7a_100000759926_100000696636 [0,2,0,0,0,0|2,0,0]=4 17392 B15R1.8290 CC(=O)CCOCc1c(cccc1Br)F 7a_100012355691_100000053229 [0,2,0,0,0,0|2,0,0]=4 17393 B15R1.8290 CC(=O)CCOCc1c(cccc1C)C 34a_100000759926_100000758300 [0,2,0,0,0,0|2,0,0]=4 17394 B15R1.8290 CC(=O)CCOCc1c(cccc1C)C 7a_100000759926_100000758300 [0,2,0,0,0,0|2,0,0]=4 17395 B15R1.8290 CC(=O)CCOCc1c(cccc1C)C 7a_100011933981_100000053229 [0,2,0,0,0,0|2,0,0]=4 17396 B15R1.8290 CC(=O)CCOCc1c(cccc1Cl)C 7a_100000082531_100000053229 [0,2,0,0,0,0|2,0,0]=4 17397 B15R1.8290 CC(=O)CCOCc1c(cccc1Cl)Cl 34a_100000759926_100000187851 [0,2,0,0,0,0|2,0,0]=4 17398 B15R1.8290 CC(=O)CCOCc1c(cccc1Cl)Cl 7a_100000215722_100000053229 [0,2,0,0,0,0|2,0,0]=4 17399 B15R1.8290 CC(=O)CCOCc1c(cccc1Cl)Cl 7a_100000759926_100000187851 [0,2,0,0,0,0|2,0,0]=4 17400 B15R1.8290 CC(=O)CCOCc1c(cccc1Cl)F 34a_100000759926_100000187852 [0,2,0,0,0,0|2,0,0]=4 17401 B15R1.8290 CC(=O)CCOCc1c(cccc1Cl)F 7a_100000215723_100000053229 [0,2,0,0,0,0|2,0,0]=4 17402 B15R1.8290 CC(=O)CCOCc1c(cccc1Cl)F 7a_100000759926_100000187852 [0,2,0,0,0,0|2,0,0]=4 17403 B15R1.8290 CC(=O)CCOCc1c(cccc1F)C 34a_100000759926_100009814554 [0,2,0,0,0,0|2,0,0]=4 17404 B15R1.8290 CC(=O)CCOCc1c(cccc1F)C 7a_100000057874_100000053229 [0,2,0,0,0,0|2,0,0]=4 17405 B15R1.8290 CC(=O)CCOCc1c(cccc1F)C 7a_100000759926_100009814554 [0,2,0,0,0,0|2,0,0]=4 17406 B15R1.8290 CC(=O)CCOCc1c(cccc1F)F 34a_100000759926_100000698325 [0,2,0,0,0,0|2,0,0]=4 17407 B15R1.8290 CC(=O)CCOCc1c(cccc1F)F 7a_100000698215_100000053229 [0,2,0,0,0,0|2,0,0]=4 17408 B15R1.8290 CC(=O)CCOCc1c(cccc1F)F 7a_100000759926_100000698325 [0,2,0,0,0,0|2,0,0]=4 17409 B15R1.8290 CC(=O)CCOCc1c(cccc1I)Br 34a_100000759926_100010146611 [0,2,0,0,0,0|2,0,0]=4 17410 B15R1.8290 CC(=O)CCOCc1c(cccc1I)Br 7a_100000759926_100010146611 [0,2,0,0,0,0|2,0,0]=4 17411 B15R1.8290 CC(=O)CCOCc1c(cccc1I)C 34a_100000759926_100010150146 [0,2,0,0,0,0|2,0,0]=4 17412 B15R1.8290 CC(=O)CCOCc1c(cccc1I)C 7a_100000759926_100010150146 [0,2,0,0,0,0|2,0,0]=4 17413 B15R1.8290 CC(=O)CCOCc1c(cccc1I)F 34a_100000759926_100010149602 [0,2,0,0,0,0|2,0,0]=4 17414 B15R1.8290 CC(=O)CCOCc1c(cccc1I)F 7a_100000759926_100010149602 [0,2,0,0,0,0|2,0,0]=4 17415 B15R1.8290 CC(=O)CCOCc1c(cccc1I)F 7a_100010214973_100000053229 [0,2,0,0,0,0|2,0,0]=4 17416 B15R1.8290 CC(=O)CCSCc1c(cccc1Br)C 62a_100000053229_100010146847 [0,2,0,0,0,0|2,0,0]=4 17417 B15R1.8290 CC(=O)CCSCc1c(cccc1Br)C 62a_100010146847_100000053229 [0,2,0,0,0,0|2,0,0]=4 17418 B15R1.8290 CC(=O)CCSCc1c(cccc1Br)Cl 62a_100000053229_100010138402 [0,2,0,0,0,0|2,0,0]=4 17419 B15R1.8290 CC(=O)CCSCc1c(cccc1Br)Cl 62a_100010138402_100000053229 [0,2,0,0,0,0|2,0,0]=4 17420 B15R1.8290 CC(=O)CCSCc1c(cccc1Br)F 62a_100000053229_100012145669 [0,2,0,0,0,0|2,0,0]=4 17421 B15R1.8290 CC(=O)CCSCc1c(cccc1Br)F 62a_100012145669_100000053229 [0,2,0,0,0,0|2,0,0]=4 17422 B15R1.8290 CC(=O)CCSCc1c(cccc1C)C 62a_100000053229_100000758300 [0,2,0,0,0,0|2,0,0]=4 17423 B15R1.8290 CC(=O)CCSCc1c(cccc1C)C 62a_100000758300_100000053229 [0,2,0,0,0,0|2,0,0]=4 17424 B15R1.8290 CC(=O)CCSCc1c(cccc1Cl)Cl 62a_100000053229_100000187851 [0,2,0,0,0,0|2,0,0]=4 17425 B15R1.8290 CC(=O)CCSCc1c(cccc1Cl)Cl 62a_100000187851_100000053229 [0,2,0,0,0,0|2,0,0]=4 17426 B15R1.8290 CC(=O)CCSCc1c(cccc1Cl)F 62a_100000053229_100000187852 [0,2,0,0,0,0|2,0,0]=4 17427 B15R1.8290 CC(=O)CCSCc1c(cccc1Cl)F 62a_100000187852_100000053229 [0,2,0,0,0,0|2,0,0]=4 17428 B15R1.8290 CC(=O)CCSCc1c(cccc1F)C 62a_100000053229_100009814554 [0,2,0,0,0,0|2,0,0]=4 17429 B15R1.8290 CC(=O)CCSCc1c(cccc1F)C 62a_100009814554_100000053229 [0,2,0,0,0,0|2,0,0]=4 17430 B15R1.8290 CC(=O)CCSCc1c(cccc1F)F 62a_100000053229_100000698325 [0,2,0,0,0,0|2,0,0]=4 17431 B15R1.8290 CC(=O)CCSCc1c(cccc1F)F 62a_100000709179_100000053229 [0,2,0,0,0,0|2,0,0]=4 17432 B15R1.8290 CC(=O)CCSCc1c(cccc1I)Br 62a_100000053229_100010146611 [0,2,0,0,0,0|2,0,0]=4 17433 B15R1.8290 CC(=O)CCSCc1c(cccc1I)Br 62a_100010146611_100000053229 [0,2,0,0,0,0|2,0,0]=4 17434 B15R1.8290 CC(=O)CCSCc1c(cccc1I)C 62a_100000053229_100010150146 [0,2,0,0,0,0|2,0,0]=4 17435 B15R1.8290 CC(=O)CCSCc1c(cccc1I)C 62a_100010150146_100000053229 [0,2,0,0,0,0|2,0,0]=4 17436 B15R1.8290 CC(=O)CCSCc1c(cccc1I)F 62a_100000053229_100010149602 [0,2,0,0,0,0|2,0,0]=4 17437 B15R1.8290 CC(=O)CCSCc1c(cccc1I)F 62a_100010149602_100000053229 [0,2,0,0,0,0|2,0,0]=4 17438 B15R1.8290 CC(=O)COCCc1c(cccc1Cl)Cl 34a_100000211253_100012161200 [0,2,0,0,0,0|2,0,0]=4 17439 B15R1.8290 Cc1cccc(c1CNCCC(=O)N)Br 207a_100000740010_100009881667 [0,2,0,0,0,0|2,0,0]=4 17440 B15R1.8290 Cc1cccc(c1CNCCC(=O)N)C 207a_100000740010_100000758299 [0,2,0,0,0,0|2,0,0]=4 17441 B15R1.8290 Cc1cccc(c1CNCCC(=O)N)C 34a_100000689800_100000731001 [0,2,0,0,0,0|2,0,0]=4 17442 B15R1.8290 Cc1cccc(c1CNCCC(=O)N)Cl 207a_100000740010_100000041122 [0,2,0,0,0,0|2,0,0]=4 17443 B15R1.8290 Cc1cccc(c1CNCCC(=O)N)F 207a_100000740010_100000069827 [0,2,0,0,0,0|2,0,0]=4 17444 B15R1.8290 Cc1cccc(c1CNCCC(=O)N)F 34a_100000762012_100000731001 [0,2,0,0,0,0|2,0,0]=4 17445 B15R1.8290 Cc1cccc(c1CNOCC(=O)O)Br 269956a_100000106656_100010146847 [0,2,0,0,0,0|2,0,0]=4 17446 B15R1.8290 Cc1cccc(c1CNOCC(=O)O)C 269956a_100000106656_100000758300 [0,2,0,0,0,0|2,0,0]=4 17447 B15R1.8290 Cc1cccc(c1CNOCC(=O)O)F 269956a_100000106656_100009814554 [0,2,0,0,0,0|2,0,0]=4 17448 B15R1.8290 Cc1cccc(c1CNOCC(=O)O)I 269956a_100000106656_100010150146 [0,2,0,0,0,0|2,0,0]=4 17449 B15R1.8290 Cc1cccc(c1COCCC(=O)N)Br 34a_100000757172_100010146847 [0,2,0,0,0,0|2,0,0]=4 17450 B15R1.8290 Cc1cccc(c1COCCC(=O)N)Br 7a_100000757172_100010146847 [0,2,0,0,0,0|2,0,0]=4 17451 B15R1.8290 Cc1cccc(c1COCCC(=O)N)C 34a_100000757172_100000758300 [0,2,0,0,0,0|2,0,0]=4 17452 B15R1.8290 Cc1cccc(c1COCCC(=O)N)C 34a_100011933981_100000731001 [0,2,0,0,0,0|2,0,0]=4 17453 B15R1.8290 Cc1cccc(c1COCCC(=O)N)C 7a_100000757172_100000758300 [0,2,0,0,0,0|2,0,0]=4 17454 B15R1.8290 Cc1cccc(c1COCCC(=O)N)C 7a_100011933981_100000744528 [0,2,0,0,0,0|2,0,0]=4 17455 B15R1.8290 Cc1cccc(c1COCCC(=O)N)Cl 34a_100000082531_100000731001 [0,2,0,0,0,0|2,0,0]=4 17456 B15R1.8290 Cc1cccc(c1COCCC(=O)N)Cl 7a_100000082531_100000744528 [0,2,0,0,0,0|2,0,0]=4 17457 B15R1.8290 Cc1cccc(c1COCCC(=O)N)F 34a_100000057874_100000731001 [0,2,0,0,0,0|2,0,0]=4 17458 B15R1.8290 Cc1cccc(c1COCCC(=O)N)F 34a_100000757172_100009814554 [0,2,0,0,0,0|2,0,0]=4 17459 B15R1.8290 Cc1cccc(c1COCCC(=O)N)F 7a_100000057874_100000744528 [0,2,0,0,0,0|2,0,0]=4 17460 B15R1.8290 Cc1cccc(c1COCCC(=O)N)F 7a_100000757172_100009814554 [0,2,0,0,0,0|2,0,0]=4 17461 B15R1.8290 Cc1cccc(c1COCCC(=O)N)I 34a_100000757172_100010150146 [0,2,0,0,0,0|2,0,0]=4 17462 B15R1.8290 Cc1cccc(c1COCCC(=O)N)I 7a_100000757172_100010150146 [0,2,0,0,0,0|2,0,0]=4 17463 B15R1.8290 Cc1cccc(c1CSCCC(=O)N)Br 62a_100000744528_100010146847 [0,2,0,0,0,0|2,0,0]=4 17464 B15R1.8290 Cc1cccc(c1CSCCC(=O)N)Br 62a_100010146847_100000744528 [0,2,0,0,0,0|2,0,0]=4 17465 B15R1.8290 Cc1cccc(c1CSCCC(=O)N)C 62a_100000744528_100000758300 [0,2,0,0,0,0|2,0,0]=4 17466 B15R1.8290 Cc1cccc(c1CSCCC(=O)N)C 62a_100000758300_100000744528 [0,2,0,0,0,0|2,0,0]=4 17467 B15R1.8290 Cc1cccc(c1CSCCC(=O)N)F 62a_100000744528_100009814554 [0,2,0,0,0,0|2,0,0]=4 17468 B15R1.8290 Cc1cccc(c1CSCCC(=O)N)F 62a_100009814554_100000744528 [0,2,0,0,0,0|2,0,0]=4 17469 B15R1.8290 Cc1cccc(c1CSCCC(=O)N)I 62a_100000744528_100010150146 [0,2,0,0,0,0|2,0,0]=4 17470 B15R1.8290 Cc1cccc(c1CSCCC(=O)N)I 62a_100010150146_100000744528 [0,2,0,0,0,0|2,0,0]=4 17471 B15R1.8290 Cc1cccc(c1NCCCC(=O)N)Br 34a_100011834072_100102525003 [0,2,0,0,0,0|2,0,0]=4 17472 B15R1.8290 Cc1cccc(c1NCCCC(=O)N)C 34a_100000185769_100102525003 [0,2,0,0,0,0|2,0,0]=4 17473 B15R1.8290 Cc1cccc(c1NCCCC(=O)N)Cl 34a_100000756524_100102525003 [0,2,0,0,0,0|2,0,0]=4 17474 B15R1.8290 Cc1cccc(c1NCCCC(=O)N)F 34a_100000766463_100102525003 [0,2,0,0,0,0|2,0,0]=4 17475 B15R1.8290 Cc1cccc(c1NCCCC(=O)N)O 34a_100000743429_100102525003 [0,2,0,0,0,0|2,0,0]=4 17476 B15R1.8290 Cc1cccc(c1OCCCC(=O)N)Br 34a_100009817157_100102525003 [0,2,0,0,0,0|2,0,0]=4 17477 B15R1.8290 Cc1cccc(c1OCCCC(=O)N)Br 7a_100009817157_100102525003 [0,2,0,0,0,0|2,0,0]=4 17478 B15R1.8290 Cc1cccc(c1OCCCC(=O)N)C 34a_100000210341_100102525003 [0,2,0,0,0,0|2,0,0]=4 17479 B15R1.8290 Cc1cccc(c1OCCCC(=O)N)C 7a_100000210341_100102525003 [0,2,0,0,0,0|2,0,0]=4 17480 B15R1.8290 Cc1cccc(c1OCCCC(=O)N)Cl 34a_100000033731_100102525003 [0,2,0,0,0,0|2,0,0]=4 17481 B15R1.8290 Cc1cccc(c1OCCCC(=O)N)Cl 7a_100000033731_100102525003 [0,2,0,0,0,0|2,0,0]=4 17482 B15R1.8290 Cc1cccc(c1OCCCC(=O)N)F 34a_100011659162_100102525003 [0,2,0,0,0,0|2,0,0]=4 17483 B15R1.8290 Cc1cccc(c1OCCCC(=O)N)F 7a_100011659162_100102525003 [0,2,0,0,0,0|2,0,0]=4 17484 B15R1.8290 Cc1cccc(c1OCCCC(=O)N)N 34a_100000756359_100102525003 [0,2,0,0,0,0|2,0,0]=4 17485 B15R1.8290 Cc1cccc(c1OCCCC(=O)N)N 7a_100000756359_100102525003 [0,2,0,0,0,0|2,0,0]=4 17486 B15R1.8290 Cc1cccc(c1SCCCC(=O)N)Br 62a_100010141302_100102525003 [0,2,0,0,0,0|2,0,0]=4 17487 B15R1.8290 Cc1cccc(c1SCCCC(=O)N)Br 62a_100102525003_100010141302 [0,2,0,0,0,0|2,0,0]=4 17488 B15R1.8290 Cc1cccc(c1SCCCC(=O)N)C 62a_100000033847_100102525003 [0,2,0,0,0,0|2,0,0]=4 17489 B15R1.8290 Cc1cccc(c1SCCCC(=O)N)C 62a_100102525003_100000033847 [0,2,0,0,0,0|2,0,0]=4 17490 B15R1.8290 Cc1cccc(c1SCCCC(=O)N)Cl 62a_100000043165_100102525003 [0,2,0,0,0,0|2,0,0]=4 17491 B15R1.8290 Cc1cccc(c1SCCCC(=O)N)Cl 62a_100102525003_100000043165 [0,2,0,0,0,0|2,0,0]=4 17492 B15R1.8290 Cc1cccc(c1SCCCC(=O)N)F 62a_100011218421_100102525003 [0,2,0,0,0,0|2,0,0]=4 17493 B15R1.8290 Cc1cccc(c1SCCCC(=O)N)F 62a_100102525003_100011218421 [0,2,0,0,0,0|2,0,0]=4 17494 B15R1.8290 Cc1cccc(c1SCCCC(=O)N)N 62a_100000684715_100102525003 [0,2,0,0,0,0|2,0,0]=4 17495 B15R1.8290 Cc1cccc(c1SCCCC(=O)N)N 62a_100102525003_100000684715 [0,2,0,0,0,0|2,0,0]=4 17496 B15R1.8290 Cc1cccc(c1SCCCC(=O)N)O 62a_100000686692_100102525003 [0,2,0,0,0,0|2,0,0]=4 17497 B15R1.8290 Cc1cccc(c1SCCCC(=O)N)O 62a_100102525003_100000686692 [0,2,0,0,0,0|2,0,0]=4 17498 B15R1.8290 NC(=O)CCCNc1c(cccc1Br)Br 34a_100000690995_100102525003 [0,2,0,0,0,0|2,0,0]=4 17499 B15R1.8290 NC(=O)CCCNc1c(cccc1Br)Cl 34a_100102946385_100102525003 [0,2,0,0,0,0|2,0,0]=4 17500 B15R1.8290 NC(=O)CCCNc1c(cccc1Br)F 34a_100000684712_100102525003 [0,2,0,0,0,0|2,0,0]=4 17501 B15R1.8290 NC(=O)CCCNc1c(cccc1Br)O 34a_100011934926_100102525003 [0,2,0,0,0,0|2,0,0]=4 17502 B15R1.8290 NC(=O)CCCNc1c(cccc1Cl)Cl 34a_100000210028_100102525003 [0,2,0,0,0,0|2,0,0]=4 17503 B15R1.8290 NC(=O)CCCNc1c(cccc1Cl)F 34a_100000760031_100102525003 [0,2,0,0,0,0|2,0,0]=4 17504 B15R1.8290 NC(=O)CCCNc1c(cccc1Cl)O 34a_100012022510_100102525003 [0,2,0,0,0,0|2,0,0]=4 17505 B15R1.8290 NC(=O)CCCNc1c(cccc1F)F 34a_100000210704_100102525003 [0,2,0,0,0,0|2,0,0]=4 17506 B15R1.8290 NC(=O)CCCNc1c(cccc1F)O 34a_100020591140_100102525003 [0,2,0,0,0,0|2,0,0]=4 17507 B15R1.8290 NC(=O)CCCNc1c(cccc1I)F 34a_100000042321_100102525003 [0,2,0,0,0,0|2,0,0]=4 17508 B15R1.8290 NC(=O)CCCOc1c(cccc1Br)Br 34a_100000736428_100102525003 [0,2,0,0,0,0|2,0,0]=4 17509 B15R1.8290 NC(=O)CCCOc1c(cccc1Br)Br 7a_100000736428_100102525003 [0,2,0,0,0,0|2,0,0]=4 17510 B15R1.8290 NC(=O)CCCOc1c(cccc1Br)Cl 34a_100010214474_100102525003 [0,2,0,0,0,0|2,0,0]=4 17511 B15R1.8290 NC(=O)CCCOc1c(cccc1Br)Cl 7a_100010214474_100102525003 [0,2,0,0,0,0|2,0,0]=4 17512 B15R1.8290 NC(=O)CCCOc1c(cccc1Br)F 34a_100009813666_100102525003 [0,2,0,0,0,0|2,0,0]=4 17513 B15R1.8290 NC(=O)CCCOc1c(cccc1Br)F 7a_100009813666_100102525003 [0,2,0,0,0,0|2,0,0]=4 17514 B15R1.8290 NC(=O)CCCOc1c(cccc1Br)N 34a_100011934915_100102525003 [0,2,0,0,0,0|2,0,0]=4 17515 B15R1.8290 NC(=O)CCCOc1c(cccc1Cl)Cl 34a_100000211709_100102525003 [0,2,0,0,0,0|2,0,0]=4 17516 B15R1.8290 NC(=O)CCCOc1c(cccc1Cl)Cl 7a_100000211709_100102525003 [0,2,0,0,0,0|2,0,0]=4 17517 B15R1.8290 NC(=O)CCCOc1c(cccc1Cl)F 34a_100000694953_100102525003 [0,2,0,0,0,0|2,0,0]=4 17518 B15R1.8290 NC(=O)CCCOc1c(cccc1Cl)F 7a_100000694953_100102525003 [0,2,0,0,0,0|2,0,0]=4 17519 B15R1.8290 NC(=O)CCCOc1c(cccc1Cl)N 34a_100000754742_100102525003 [0,2,0,0,0,0|2,0,0]=4 17520 B15R1.8290 NC(=O)CCCOc1c(cccc1F)F 34a_100000230165_100102525003 [0,2,0,0,0,0|2,0,0]=4 17521 B15R1.8290 NC(=O)CCCOc1c(cccc1F)F 7a_100000230165_100102525003 [0,2,0,0,0,0|2,0,0]=4 17522 B15R1.8290 NC(=O)CCCOc1c(cccc1F)N 34a_100011934987_100102525003 [0,2,0,0,0,0|2,0,0]=4 17523 B15R1.8290 NC(=O)CCCOc1c(cccc1I)Br 34a_100010084509_100102525003 [0,2,0,0,0,0|2,0,0]=4 17524 B15R1.8290 NC(=O)CCCOc1c(cccc1I)Br 7a_100010084509_100102525003 [0,2,0,0,0,0|2,0,0]=4 17525 B15R1.8290 NC(=O)CCCOc1c(cccc1I)Cl 34a_100010202889_100102525003 [0,2,0,0,0,0|2,0,0]=4 17526 B15R1.8290 NC(=O)CCCOc1c(cccc1I)Cl 7a_100010202889_100102525003 [0,2,0,0,0,0|2,0,0]=4 17527 B15R1.8290 NC(=O)CCCOc1c(cccc1I)F 34a_100010186298_100102525003 [0,2,0,0,0,0|2,0,0]=4 17528 B15R1.8290 NC(=O)CCCOc1c(cccc1I)F 7a_100010186298_100102525003 [0,2,0,0,0,0|2,0,0]=4 17529 B15R1.8290 NC(=O)CCCOc1c(cccc1I)N 34a_100010084371_100102525003 [0,2,0,0,0,0|2,0,0]=4 17530 B15R1.8290 NC(=O)CCCOc1c(cccc1N)N 34a_200016994477_100102525003 [0,2,0,0,0,0|2,0,0]=4 17531 B15R1.8290 NC(=O)CCCSc1c(cccc1Br)Br 62a_100009994525_100102525003 [0,2,0,0,0,0|2,0,0]=4 17532 B15R1.8290 NC(=O)CCCSc1c(cccc1Br)Br 62a_100102525003_100009994525 [0,2,0,0,0,0|2,0,0]=4 17533 B15R1.8290 NC(=O)CCCSc1c(cccc1Br)Cl 62a_100010214488_100102525003 [0,2,0,0,0,0|2,0,0]=4 17534 B15R1.8290 NC(=O)CCCSc1c(cccc1Br)Cl 62a_100102525003_100010214488 [0,2,0,0,0,0|2,0,0]=4 17535 B15R1.8290 NC(=O)CCCSc1c(cccc1Br)F 62a_100011219512_100102525003 [0,2,0,0,0,0|2,0,0]=4 17536 B15R1.8290 NC(=O)CCCSc1c(cccc1Br)F 62a_100102525003_100011219512 [0,2,0,0,0,0|2,0,0]=4 17537 B15R1.8290 NC(=O)CCCSc1c(cccc1Br)N 62a_100020590159_100102525003 [0,2,0,0,0,0|2,0,0]=4 17538 B15R1.8290 NC(=O)CCCSc1c(cccc1Br)N 62a_100102525003_100020590159 [0,2,0,0,0,0|2,0,0]=4 17539 B15R1.8290 NC(=O)CCCSc1c(cccc1Br)O 62a_100010187912_100102525003 [0,2,0,0,0,0|2,0,0]=4 17540 B15R1.8290 NC(=O)CCCSc1c(cccc1Br)O 62a_100102525003_100010187912 [0,2,0,0,0,0|2,0,0]=4 17541 B15R1.8290 NC(=O)CCCSc1c(cccc1Cl)Cl 62a_100000034237_100102525003 [0,2,0,0,0,0|2,0,0]=4 17542 B15R1.8290 NC(=O)CCCSc1c(cccc1Cl)Cl 62a_100102525003_100000034237 [0,2,0,0,0,0|2,0,0]=4 17543 B15R1.8290 NC(=O)CCCSc1c(cccc1Cl)F 62a_100000050007_100102525003 [0,2,0,0,0,0|2,0,0]=4 17544 B15R1.8290 NC(=O)CCCSc1c(cccc1Cl)F 62a_100102525003_100000050007 [0,2,0,0,0,0|2,0,0]=4 17545 B15R1.8290 NC(=O)CCCSc1c(cccc1Cl)N 62a_100000049713_100102525003 [0,2,0,0,0,0|2,0,0]=4 17546 B15R1.8290 NC(=O)CCCSc1c(cccc1Cl)N 62a_100102525003_100000049713 [0,2,0,0,0,0|2,0,0]=4 17547 B15R1.8290 NC(=O)CCCSc1c(cccc1Cl)O 62a_100102525003_100000050174 [0,2,0,0,0,0|2,0,0]=4 17548 B15R1.8290 NC(=O)CCCSc1c(cccc1F)F 62a_100000693133_100102525003 [0,2,0,0,0,0|2,0,0]=4 17549 B15R1.8290 NC(=O)CCCSc1c(cccc1F)F 62a_100102525003_100000693133 [0,2,0,0,0,0|2,0,0]=4 17550 B15R1.8290 NC(=O)CCCSc1c(cccc1F)N 62a_100000690935_100102525003 [0,2,0,0,0,0|2,0,0]=4 17551 B15R1.8290 NC(=O)CCCSc1c(cccc1F)N 62a_100102525003_100000690935 [0,2,0,0,0,0|2,0,0]=4 17552 B15R1.8290 NC(=O)CCCSc1c(cccc1F)O 62a_100009820682_100102525003 [0,2,0,0,0,0|2,0,0]=4 17553 B15R1.8290 NC(=O)CCCSc1c(cccc1F)O 62a_100102525003_100009820682 [0,2,0,0,0,0|2,0,0]=4 17554 B15R1.8290 NC(=O)CCCSc1c(cccc1O)N 62a_100012183704_100102525003 [0,2,0,0,0,0|2,0,0]=4 17555 B15R1.8290 NC(=O)CCCSc1c(cccc1O)N 62a_100102525003_100012183704 [0,2,0,0,0,0|2,0,0]=4 17556 B15R1.8290 NC(=O)CCCSc1c(cccc1O)O 62a_100102525003_100010205330 [0,2,0,0,0,0|2,0,0]=4 17557 B15R1.8290 NC(=O)CCNCc1c(cccc1Br)Br 207a_100000740010_100010233043 [0,2,0,0,0,0|2,0,0]=4 17558 B15R1.8290 NC(=O)CCNCc1c(cccc1Br)Cl 207a_100000740010_100011249081 [0,2,0,0,0,0|2,0,0]=4 17559 B15R1.8290 NC(=O)CCNCc1c(cccc1Br)F 207a_100000740010_100000752695 [0,2,0,0,0,0|2,0,0]=4 17560 B15R1.8290 NC(=O)CCNCc1c(cccc1Br)F 34a_100012349121_100000731001 [0,2,0,0,0,0|2,0,0]=4 17561 B15R1.8290 NC(=O)CCNCc1c(cccc1Cl)Cl 207a_100000740010_100000189306 [0,2,0,0,0,0|2,0,0]=4 17562 B15R1.8290 NC(=O)CCNCc1c(cccc1Cl)Cl 2230a_100000174884_100000744528 [0,2,0,0,0,0|2,0,0]=4 17563 B15R1.8290 NC(=O)CCNCc1c(cccc1Cl)Cl 34a_100000174884_100000731001 [0,2,0,0,0,0|2,0,0]=4 17564 B15R1.8290 NC(=O)CCNCc1c(cccc1Cl)F 207a_100000740010_100000210083 [0,2,0,0,0,0|2,0,0]=4 17565 B15R1.8290 NC(=O)CCNCc1c(cccc1Cl)F 34a_100000174883_100000731001 [0,2,0,0,0,0|2,0,0]=4 17566 B15R1.8290 NC(=O)CCNCc1c(cccc1F)F 207a_100000740010_100000211061 [0,2,0,0,0,0|2,0,0]=4 17567 B15R1.8290 NC(=O)CCNCc1c(cccc1F)F 34a_100000688400_100000731001 [0,2,0,0,0,0|2,0,0]=4 17568 B15R1.8290 NC(=O)CCNCc1c(cccc1I)Cl 207a_100000740010_100010147682 [0,2,0,0,0,0|2,0,0]=4 17569 B15R1.8290 NC(=O)CCNCc1c(cccc1I)F 207a_100000740010_100010178011 [0,2,0,0,0,0|2,0,0]=4 17570 B15R1.8290 NC(=O)CCOCc1c(cccc1Br)Br 34a_100010172814_100000731001 [0,2,0,0,0,0|2,0,0]=4 17571 B15R1.8290 NC(=O)CCOCc1c(cccc1Br)Br 7a_100010172814_100000744528 [0,2,0,0,0,0|2,0,0]=4 17572 B15R1.8290 NC(=O)CCOCc1c(cccc1Br)Cl 34a_100000757172_100010138402 [0,2,0,0,0,0|2,0,0]=4 17573 B15R1.8290 NC(=O)CCOCc1c(cccc1Br)Cl 7a_100000757172_100010138402 [0,2,0,0,0,0|2,0,0]=4 17574 B15R1.8290 NC(=O)CCOCc1c(cccc1Br)F 34a_100000757172_100012145669 [0,2,0,0,0,0|2,0,0]=4 17575 B15R1.8290 NC(=O)CCOCc1c(cccc1Br)F 34a_100012355691_100000731001 [0,2,0,0,0,0|2,0,0]=4 17576 B15R1.8290 NC(=O)CCOCc1c(cccc1Br)F 7a_100000757172_100000696636 [0,2,0,0,0,0|2,0,0]=4 17577 B15R1.8290 NC(=O)CCOCc1c(cccc1Br)F 7a_100012355691_100000744528 [0,2,0,0,0,0|2,0,0]=4 17578 B15R1.8290 NC(=O)CCOCc1c(cccc1Br)N 34a_100000747656_100000731001 [0,2,0,0,0,0|2,0,0]=4 17579 B15R1.8290 NC(=O)CCOCc1c(cccc1Cl)Cl 34a_100000215722_100000731001 [0,2,0,0,0,0|2,0,0]=4 17580 B15R1.8290 NC(=O)CCOCc1c(cccc1Cl)Cl 34a_100000757172_100000187851 [0,2,0,0,0,0|2,0,0]=4 17581 B15R1.8290 NC(=O)CCOCc1c(cccc1Cl)Cl 7a_100000215722_100000744528 [0,2,0,0,0,0|2,0,0]=4 17582 B15R1.8290 NC(=O)CCOCc1c(cccc1Cl)Cl 7a_100000757172_100000187851 [0,2,0,0,0,0|2,0,0]=4 17583 B15R1.8290 NC(=O)CCOCc1c(cccc1Cl)F 34a_100000215723_100000731001 [0,2,0,0,0,0|2,0,0]=4 17584 B15R1.8290 NC(=O)CCOCc1c(cccc1Cl)F 34a_100000757172_100000187852 [0,2,0,0,0,0|2,0,0]=4 17585 B15R1.8290 NC(=O)CCOCc1c(cccc1Cl)F 7a_100000215723_100000744528 [0,2,0,0,0,0|2,0,0]=4 17586 B15R1.8290 NC(=O)CCOCc1c(cccc1Cl)F 7a_100000757172_100000187852 [0,2,0,0,0,0|2,0,0]=4 17587 B15R1.8290 NC(=O)CCOCc1c(cccc1Cl)N 34a_100011916388_100000731001 [0,2,0,0,0,0|2,0,0]=4 17588 B15R1.8290 NC(=O)CCOCc1c(cccc1F)F 34a_100000698215_100000731001 [0,2,0,0,0,0|2,0,0]=4 17589 B15R1.8290 NC(=O)CCOCc1c(cccc1F)F 34a_100000757172_100000698325 [0,2,0,0,0,0|2,0,0]=4 17590 B15R1.8290 NC(=O)CCOCc1c(cccc1F)F 7a_100000698215_100000744528 [0,2,0,0,0,0|2,0,0]=4 17591 B15R1.8290 NC(=O)CCOCc1c(cccc1F)F 7a_100000757172_100000698325 [0,2,0,0,0,0|2,0,0]=4 17592 B15R1.8290 NC(=O)CCOCc1c(cccc1F)N 34a_100011846719_100000731001 [0,2,0,0,0,0|2,0,0]=4 17593 B15R1.8290 NC(=O)CCOCc1c(cccc1I)Br 34a_100000757172_100010146611 [0,2,0,0,0,0|2,0,0]=4 17594 B15R1.8290 NC(=O)CCOCc1c(cccc1I)Br 7a_100000757172_100010146611 [0,2,0,0,0,0|2,0,0]=4 17595 B15R1.8290 NC(=O)CCOCc1c(cccc1I)F 34a_100000757172_100010149602 [0,2,0,0,0,0|2,0,0]=4 17596 B15R1.8290 NC(=O)CCOCc1c(cccc1I)F 34a_100010214973_100000731001 [0,2,0,0,0,0|2,0,0]=4 17597 B15R1.8290 NC(=O)CCOCc1c(cccc1I)F 7a_100000757172_100010149602 [0,2,0,0,0,0|2,0,0]=4 17598 B15R1.8290 NC(=O)CCOCc1c(cccc1I)F 7a_100010214973_100000744528 [0,2,0,0,0,0|2,0,0]=4 17599 B15R1.8290 NC(=O)CCSCc1c(cccc1Br)Cl 62a_100000744528_100010138402 [0,2,0,0,0,0|2,0,0]=4 17600 B15R1.8290 NC(=O)CCSCc1c(cccc1Br)Cl 62a_100010138402_100000744528 [0,2,0,0,0,0|2,0,0]=4 17601 B15R1.8290 NC(=O)CCSCc1c(cccc1Br)F 62a_100000744528_100012145669 [0,2,0,0,0,0|2,0,0]=4 17602 B15R1.8290 NC(=O)CCSCc1c(cccc1Br)F 62a_100012145669_100000744528 [0,2,0,0,0,0|2,0,0]=4 17603 B15R1.8290 NC(=O)CCSCc1c(cccc1Cl)Cl 62a_100000187851_100000744528 [0,2,0,0,0,0|2,0,0]=4 17604 B15R1.8290 NC(=O)CCSCc1c(cccc1Cl)Cl 62a_100000744528_100000187851 [0,2,0,0,0,0|2,0,0]=4 17605 B15R1.8290 NC(=O)CCSCc1c(cccc1Cl)F 62a_100000187852_100000744528 [0,2,0,0,0,0|2,0,0]=4 17606 B15R1.8290 NC(=O)CCSCc1c(cccc1Cl)F 62a_100000744528_100000187852 [0,2,0,0,0,0|2,0,0]=4 17607 B15R1.8290 NC(=O)CCSCc1c(cccc1F)F 62a_100000709179_100000744528 [0,2,0,0,0,0|2,0,0]=4 17608 B15R1.8290 NC(=O)CCSCc1c(cccc1F)F 62a_100000744528_100000698325 [0,2,0,0,0,0|2,0,0]=4 17609 B15R1.8290 NC(=O)CCSCc1c(cccc1I)Br 62a_100000744528_100010146611 [0,2,0,0,0,0|2,0,0]=4 17610 B15R1.8290 NC(=O)CCSCc1c(cccc1I)Br 62a_100010146611_100000744528 [0,2,0,0,0,0|2,0,0]=4 17611 B15R1.8290 NC(=O)CCSCc1c(cccc1I)F 62a_100000744528_100010149602 [0,2,0,0,0,0|2,0,0]=4 17612 B15R1.8290 NC(=O)CCSCc1c(cccc1I)F 62a_100010149602_100000744528 [0,2,0,0,0,0|2,0,0]=4 17613 B15R1.8290 NC(=O)CNCCc1c(cccc1Cl)Cl 2230a_100000711301_100012161200 [0,2,0,0,0,0|2,0,0]=4 17614 B15R1.8290 NC(=O)CNCCc1c(cccc1Cl)Cl 2230a_100032004868_100000747473 [0,2,0,0,0,0|2,0,0]=4 17615 B15R1.8290 NC(=O)CNCCc1c(cccc1Cl)Cl 34a_100032004868_100000187820 [0,2,0,0,0,0|2,0,0]=4 17616 B15R1.8290 NC(=O)CNCCc1c(cccc1Cl)F 2230a_100000688150_100000747473 [0,2,0,0,0,0|2,0,0]=4 17617 B15R1.8290 NC(=O)CNCCc1c(cccc1Cl)F 34a_100000688150_100000187820 [0,2,0,0,0,0|2,0,0]=4 17618 B15R1.8290 NC(=O)COCCc1c(cccc1Cl)Cl 34a_100011934077_100000187820 [0,2,0,0,0,0|2,0,0]=4 17619 B15R1.8290 NC(=O)COCCc1c(cccc1Cl)Cl 7a_100011934077_100000187820 [0,2,0,0,0,0|2,0,0]=4 17620 B15R1.8290 NC(=O)COCCc1c(cccc1Cl)F 34a_100011273940_100000187820 [0,2,0,0,0,0|2,0,0]=4 17621 B15R1.8290 NC(=O)COCCc1c(cccc1Cl)F 7a_100011273940_100000187820 [0,2,0,0,0,0|2,0,0]=4 17622 B15R1.8290 NC(=O)COCCc1c(cccc1F)F 34a_100011975733_100000187820 [0,2,0,0,0,0|2,0,0]=4 17623 B15R1.8290 NC(=O)COCCc1c(cccc1F)F 7a_100011975733_100000187820 [0,2,0,0,0,0|2,0,0]=4 17624 B15R1.8290 NC(=O)CSCCc1c(cccc1Cl)Cl 62a_100000747473_100012161200 [0,2,0,0,0,0|2,0,0]=4 17625 B15R1.8290 NC(=O)CSCCc1c(cccc1Cl)Cl 62a_100012161200_100000747473 [0,2,0,0,0,0|2,0,0]=4 17626 B15R1.8290 O=C(O)CNCCc1c(cccc1Cl)Cl 269956a_100016091260_100012161200 [0,2,0,0,0,0|1,0,0]=3 17627 B15R1.8290 O=C(O)CONCc1c(cccc1Br)Cl 269956a_100000106656_100010138402 [0,2,0,0,0,0|2,0,0]=4 17628 B15R1.8290 O=C(O)CONCc1c(cccc1Br)F 269956a_100000106656_100012145669 [0,2,0,0,0,0|2,0,0]=4 17629 B15R1.8290 O=C(O)CONCc1c(cccc1Cl)Cl 269956a_100000106656_100000187851 [0,2,0,0,0,0|2,0,0]=4 17630 B15R1.8290 O=C(O)CONCc1c(cccc1Cl)F 269956a_100000106656_100000187852 [0,2,0,0,0,0|2,0,0]=4 17631 B15R1.8290 O=C(O)CONCc1c(cccc1F)F 269956a_100000106656_100000709179 [0,2,0,0,0,0|2,0,0]=4 17632 B15R1.8290 O=C(O)CONCc1c(cccc1I)Br 269956a_100000106656_100010146611 [0,2,0,0,0,0|2,0,0]=4 17633 B15R1.8290 O=C(O)CONCc1c(cccc1I)F 269956a_100000106656_100010149602 [0,2,0,0,0,0|2,0,0]=4 17634 B15R1.8290 O=C([O-])CNCCc1c(cccc1Cl)Cl 34a_100032004868_100020667443 [0,2,0,0,0,0|1,0,1]=4 17635 B15R1.8290 O=C([O-])CNCCc1c(cccc1Cl)F 34a_100000688150_100020667443 [0,2,0,0,0,0|1,0,1]=4 17636 B15R1.8290 O=C([O-])COCCc1c(cccc1Cl)Cl 34a_100011934077_100020667443 [0,2,0,0,0,0|1,0,1]=4 17637 B15R1.8290 O=C([O-])COCCc1c(cccc1Cl)F 34a_100011273940_100020667443 [0,2,0,0,0,0|1,0,1]=4 17638 B15R1.8290 O=C([O-])COCCc1c(cccc1F)F 34a_100011975733_100020667443 [0,2,0,0,0,0|1,0,1]=4 17639 B15R1.8290 O=C([O-])CSCCc1c(cccc1Cl)Cl 62a_100012161200_100020667443 [0,2,0,0,0,0|1,0,1]=4 17640 B15R1.8290 O=C([O-])CSCCc1c(cccc1Cl)Cl 62a_100020667443_100012161200 [0,2,0,0,0,0|1,0,1]=4 17641 B15R1.490 CC(=O)CCOC(C)(C)c1ccccc1 7a_100000694644_100000053229 [0,2,0,0,0,0|2,0,0]=4 17642 B15R1.490 CC(=O)CCOC(F)(F)c1ccccc1 7a_100000759926_100000036403 [0,2,0,0,0,0|2,0,0]=4 17643 B15R1.490 CC(=O)CCSC(C)(C)c1ccccc1 62a_100000034625_100000053229 [0,2,0,0,0,0|2,0,0]=4 17644 B15R1.490 CC(=O)CCSC(C)(C)c1ccccc1 62a_100000053229_100000034625 [0,2,0,0,0,0|2,0,0]=4 17645 B15R1.490 CC(=O)CCSC(F)(F)c1ccccc1 62a_100000053229_100000036403 [0,2,0,0,0,0|2,0,0]=4 17646 B15R1.490 CC(=O)COCC(F)(F)c1ccccc1 34a_100000211253_100009875531 [0,2,0,0,0,0|2,0,0]=4 17647 B15R1.490 CC(C)(CNCC(=O)N)c1ccccc1 2230a_100011211644_100000747473 [0,2,0,0,0,0|2,0,0]=4 17648 B15R1.490 CC(C)(CNCC(=O)O)c1ccccc1 269956a_100016091260_100000703224 [0,2,0,0,0,0|1,0,0]=3 17649 B15R1.490 CC(C)(COCC(=O)N)c1ccccc1 7a_100000747608_100000187820 [0,2,0,0,0,0|2,0,0]=4 17650 B15R1.490 CC(C)(CSCC(=O)N)c1ccccc1 62a_100000703224_100000747473 [0,2,0,0,0,0|2,0,0]=4 17651 B15R1.490 CC(C)(CSCC(=O)N)c1ccccc1 62a_100000747473_100000703224 [0,2,0,0,0,0|2,0,0]=4 17652 B15R1.490 CC(C)(CSCC(=O)[O-])c1ccccc1 62a_100000703224_100020667443 [0,2,0,0,0,0|1,0,1]=4 17653 B15R1.490 CC(C)(CSCC(=O)[O-])c1ccccc1 62a_100020667443_100000703224 [0,2,0,0,0,0|1,0,1]=4 17654 B15R1.490 CC(C)(NCCC(=O)N)c1ccccc1 2230a_100011218174_100000744528 [0,2,0,0,0,0|2,0,0]=4 17655 B15R1.490 CC(C)(NOCC(=O)O)c1ccccc1 269956a_100000106656_100000034625 [0,2,0,0,0,0|2,0,0]=4 17656 B15R1.490 CC(C)(OCCC(=O)N)c1ccccc1 7a_100000694644_100000744528 [0,2,0,0,0,0|2,0,0]=4 17657 B15R1.490 CC(C)(SCCC(=O)N)c1ccccc1 62a_100000034625_100000744528 [0,2,0,0,0,0|2,0,0]=4 17658 B15R1.490 CC(C)(SCCC(=O)N)c1ccccc1 62a_100000744528_100000034625 [0,2,0,0,0,0|2,0,0]=4 17659 B15R1.490 CC(O)(CNCC(=O)N)c1ccccc1 2230a_100011660926_100000747473 [0,2,0,0,0,0|2,0,0]=4 17660 B15R1.490 C[Si](C)(CNCC(=O)O)c1ccccc1 269956a_100016091260_100000038972 [0,2,0,0,0,0|1,1,0]=4 17661 B15R1.490 NC(=O)CCOC(F)(F)c1ccccc1 7a_100000757172_100000036403 [0,2,0,0,0,0|2,0,0]=4 17662 B15R1.490 NC(=O)CCSC(F)(F)c1ccccc1 62a_100000744528_100000036403 [0,2,0,0,0,0|2,0,0]=4 17663 B15R1.490 NC(=O)CNCC(F)(F)c1ccccc1 34a_100000717977_100000187820 [0,2,0,0,0,0|2,0,0]=4 17664 B15R1.490 NC(=O)CSCC(F)(F)c1ccccc1 62a_100000747473_100009875531 [0,2,0,0,0,0|2,0,0]=4 17665 B15R1.490 NC(=O)CSCC(F)(F)c1ccccc1 62a_100009875531_100000747473 [0,2,0,0,0,0|2,0,0]=4 17666 B15R1.490 O=C(O)CNCC(F)(F)c1ccccc1 269956a_100016091260_100009875531 [0,2,0,0,0,0|1,0,0]=3 17667 B15R1.490 O=C(O)CNCS(=O)(=O)c1ccccc1 269956a_100016091260_100000240042 [0,2,0,0,0,0|2,0,0]=4 17668 B15R1.490 O=C(O)CONC(F)(F)c1ccccc1 269956a_100000106656_100000036403 [0,2,0,0,0,0|2,0,0]=4 17669 B15R1.490 O=C([O-])CNCC(F)(F)c1ccccc1 34a_100000717977_100020667443 [0,2,0,0,0,0|1,0,1]=4 17670 B15R1.490 O=C([O-])CSCC(F)(F)c1ccccc1 62a_100009875531_100020667443 [0,2,0,0,0,0|1,0,1]=4 17671 B15R1.490 O=C([O-])CSCC(F)(F)c1ccccc1 62a_100020667443_100009875531 [0,2,0,0,0,0|1,0,1]=4 17672 B15R1.500 CC(=O)C(C)COC(C)c1ccccc1 34a_100000032740_100000211855 [0,2,0,0,0,0|2,0,0]=4 17673 B15R1.500 CC(=O)C(C)COC(C)c1ccccc1 7a_100000032740_100000230085 [0,2,0,0,0,0|2,0,0]=4 17674 B15R1.500 CC(=O)C(C)NCC(C)c1ccccc1 2230a_100000701038_100009814033 [0,2,0,0,0,0|2,0,0]=4 17675 B15R1.500 CC(=O)C(C)NCC(O)c1ccccc1 2230a_100000210709_100009814033 [0,2,0,0,0,0|2,0,0]=4 17676 B15R1.500 CC(=O)C(C)OCC(C)c1ccccc1 34a_100000212229_100000756946 [0,2,0,0,0,0|2,0,0]=4 17677 B15R1.500 CC(=O)C(C)OCC(C)c1ccccc1 7a_100011215166_100000179758 [0,2,0,0,0,0|2,0,0]=4 17678 B15R1.500 CC(=O)C(C)OCC(O)c1ccccc1 34a_100000212229_100000185958 [0,2,0,0,0,0|2,0,0]=4 17679 B15R1.500 CC(=O)C(C)OC[C@@H](O)c1ccccc1 34a_100000212229_100011933945 [0,2,0,0,0,0|2,0,0]=4 17680 B15R1.500 CC(=O)C(C)SCC(C)c1ccccc1 62a_100000756946_100009814033 [0,2,0,0,0,0|2,0,0]=4 17681 B15R1.500 CC(=O)C(C)SCC(C)c1ccccc1 62a_100009814033_100000756946 [0,2,0,0,0,0|2,0,0]=4 17682 B15R1.500 CC(=O)C(C)SCC(O)c1ccccc1 62a_100000185958_100009814033 [0,2,0,0,0,0|2,0,0]=4 17683 B15R1.500 CC(=O)C(C)SCC(O)c1ccccc1 62a_100009814033_100000185958 [0,2,0,0,0,0|2,0,0]=4 17684 B15R1.500 CC(=O)C(C)SC[C@@H](O)c1ccccc1 62a_100009814033_100011933945 [0,2,0,0,0,0|2,0,0]=4 17685 B15R1.500 CC(=O)C(C)SC[C@@H](O)c1ccccc1 62a_100011933945_100009814033 [0,2,0,0,0,0|2,0,0]=4 17686 B15R1.500 CC(=O)N(C)CCC(O)c1ccccc1 240690a_100011218556_100015343762 [0,2,0,0,0,0|2,0,0]=4 17687 B15R1.500 CC(=O)N(C)CCC(O)c1ccccc1 527a_100011218556_100103153847 [0,2,0,0,0,0|2,0,0]=4 17688 B15R1.500 CC(CNC(C)c1ccccc1)C(=O)O 269956a_100000749485_100000211855 [0,2,0,0,0,0|1,0,0]=3 17689 B15R1.500 CC(CNC(F)C(=O)N)c1ccccc1 2230a_100000701038_100009813875 [0,2,0,0,0,0|2,0,0]=4 17690 B15R1.500 CC(CNC(F)C(=O)N)c1ccccc1 34a_100000701038_100009813875 [0,2,0,0,0,0|2,0,0]=4 17691 B15R1.500 CC(CNC(F)C(=O)[O-])c1ccccc1 34a_100000701038_100020610796 [0,2,0,0,0,0|1,0,1]=4 17692 B15R1.500 CC(CN[C@@H](C)C(=O)O)c1ccccc1 269956a_100000743915_100000756946 [0,2,0,0,0,0|1,0,0]=3 17693 B15R1.500 CC(CN[C@H](C)C(=O)N)c1ccccc1 2230a_100000119354_100000756946 [0,2,0,0,0,0|2,0,0]=4 17694 B15R1.500 CC(CN[C@H](C)C(=O)N)c1ccccc1 270004a_100000119354_100000212034 [0,2,0,0,0,0|2,0,0]=4 17695 B15R1.500 CC(CN[C@H](C)C(=O)N)c1ccccc1 34a_100000119354_100000756946 [0,2,0,0,0,0|2,0,0]=4 17696 B15R1.500 CC(COC(F)C(=O)N)c1ccccc1 34a_100011215166_100009813875 [0,2,0,0,0,0|2,0,0]=4 17697 B15R1.500 CC(COC(F)C(=O)N)c1ccccc1 7a_100011215166_100009813875 [0,2,0,0,0,0|2,0,0]=4 17698 B15R1.500 CC(COC(F)C(=O)[O-])c1ccccc1 34a_100011215166_100020610796 [0,2,0,0,0,0|1,0,1]=4 17699 B15R1.500 CC(CO[C@@H](C)C(=O)[O-])c1ccccc1 7a_217856618621_100000756946 [0,2,0,0,0,0|1,0,1]=4 17700 B15R1.500 CC(CO[C@H](C)C(=O)N)c1ccccc1 34a_100000731257_100000756946 [0,2,0,0,0,0|2,0,0]=4 17701 B15R1.500 CC(CO[C@H](C)C(=O)N)c1ccccc1 7a_100000731257_100000756946 [0,2,0,0,0,0|2,0,0]=4 17702 B15R1.500 CC(CSC(F)C(=O)N)c1ccccc1 62a_100000756946_100009813875 [0,2,0,0,0,0|2,0,0]=4 17703 B15R1.500 CC(CSC(F)C(=O)N)c1ccccc1 62a_100009813875_100000756946 [0,2,0,0,0,0|2,0,0]=4 17704 B15R1.500 CC(CSC(F)C(=O)[O-])c1ccccc1 62a_100000756946_100020610796 [0,2,0,0,0,0|1,0,1]=4 17705 B15R1.500 CC(CSC(F)C(=O)[O-])c1ccccc1 62a_100020610796_100000756946 [0,2,0,0,0,0|1,0,1]=4 17706 B15R1.500 CC(NCC(C)c1ccccc1)C(=O)N 2230a_100000701038_100000702099 [0,2,0,0,0,0|2,0,0]=4 17707 B15R1.500 CC(NCC(C)c1ccccc1)C(=O)N 34a_100000701038_100000702099 [0,2,0,0,0,0|2,0,0]=4 17708 B15R1.500 CC(NCC(F)C(=O)O)c1ccccc1 269956a_100000084737_100000211855 [0,2,0,0,0,0|1,0,0]=3 17709 B15R1.500 CC(NCC(O)c1ccccc1)C(=O)N 2230a_100000210709_100000702099 [0,2,0,0,0,0|2,0,0]=4 17710 B15R1.500 CC(OCC(C)c1ccccc1)C(=O)N 34a_100011215166_100000702099 [0,2,0,0,0,0|2,0,0]=4 17711 B15R1.500 CC(OCC(C)c1ccccc1)C(=O)N 7a_100011215166_100000702099 [0,2,0,0,0,0|2,0,0]=4 17712 B15R1.500 CC(OC[C@@H](N)c1ccccc1)C(=O)N 34a_100000751927_100000702099 [0,2,0,0,0,0|2,0,0]=4 17713 B15R1.500 CC(OC[C@H](N)C(=O)N)c1ccccc1 34a_100000729942_100000211855 [0,2,0,0,0,0|2,0,0]=4 17714 B15R1.500 CC(SCC(C)c1ccccc1)C(=O)N 62a_100000702099_100000756946 [0,2,0,0,0,0|2,0,0]=4 17715 B15R1.500 CC(SCC(C)c1ccccc1)C(=O)N 62a_100000756946_100000702099 [0,2,0,0,0,0|2,0,0]=4 17716 B15R1.500 CC(SCC(O)c1ccccc1)C(=O)N 62a_100000185958_100000702099 [0,2,0,0,0,0|2,0,0]=4 17717 B15R1.500 CC(SCC(O)c1ccccc1)C(=O)N 62a_100000702099_100000185958 [0,2,0,0,0,0|2,0,0]=4 17718 B15R1.500 CC(SC[C@@H](O)c1ccccc1)C(=O)N 62a_100000702099_100011933945 [0,2,0,0,0,0|2,0,0]=4 17719 B15R1.500 CC(SC[C@@H](O)c1ccccc1)C(=O)N 62a_100011933945_100000702099 [0,2,0,0,0,0|2,0,0]=4 17720 B15R1.500 C[C@@H](NCC(O)c1ccccc1)C(=O)N 2230a_100000119354_100000185958 [0,2,0,0,0,0|2,0,0]=4 17721 B15R1.500 C[C@@H](NCC(O)c1ccccc1)C(=O)N 34a_100000119354_100000185958 [0,2,0,0,0,0|2,0,0]=4 17722 B15R1.500 C[C@@H](NC[C@@H](O)c1ccccc1)C(=O)N 2230a_100000119354_100011933945 [0,2,0,0,0,0|2,0,0]=4 17723 B15R1.500 C[C@@H](NC[C@@H](O)c1ccccc1)C(=O)N 34a_100000119354_100011933945 [0,2,0,0,0,0|2,0,0]=4 17724 B15R1.500 C[C@@H](OCC(O)c1ccccc1)C(=O)N 34a_100000731257_100000185958 [0,2,0,0,0,0|2,0,0]=4 17725 B15R1.500 C[C@@H](OCC(O)c1ccccc1)C(=O)N 7a_100000731257_100000185958 [0,2,0,0,0,0|2,0,0]=4 17726 B15R1.500 C[C@@H](OC[C@@H](O)c1ccccc1)C(=O)N 34a_100000731257_100011933945 [0,2,0,0,0,0|2,0,0]=4 17727 B15R1.500 C[C@@H](OC[C@@H](O)c1ccccc1)C(=O)N 7a_100000731257_100011933945 [0,2,0,0,0,0|2,0,0]=4 17728 B15R1.500 C[C@H](NCC(=O)c1ccccc1)C(=O)O 269956a_100000743915_100000211460 [0,2,0,0,0,0|1,0,1]=4 17729 B15R1.500 C[C@H](NCC(O)c1ccccc1)C(=O)O 269956a_100000743915_100000185958 [0,2,0,0,0,0|1,0,0]=3 17730 B15R1.500 C[C@H](NCS(=O)c1ccccc1)C(=O)O 269956a_100000743915_100000031784 [0,2,0,0,0,0|2,0,0]=4 17731 B15R1.500 C[C@H](NC[C@@H](O)c1ccccc1)C(=O)O 269956a_100000743915_100011933945 [0,2,0,0,0,0|1,0,0]=3 17732 B15R1.500 C[C@H](OCC(O)c1ccccc1)C(=O)[O-] 7a_217856618621_100000185958 [0,2,0,0,0,0|1,0,1]=4 17733 B15R1.500 C[C@H](OC[C@@H](O)c1ccccc1)C(=O)[O-] 7a_217856618621_100011933945 [0,2,0,0,0,0|1,0,1]=4 17734 B15R1.500 NC(=O)C(F)NCC(O)c1ccccc1 2230a_100000210709_100009813875 [0,2,0,0,0,0|2,0,0]=4 17735 B15R1.500 NC(=O)C(F)OC[C@@H](N)c1ccccc1 34a_100000751927_100009813875 [0,2,0,0,0,0|2,0,0]=4 17736 B15R1.500 NC(=O)C(F)SCC(O)c1ccccc1 62a_100000185958_100009813875 [0,2,0,0,0,0|2,0,0]=4 17737 B15R1.500 NC(=O)C(F)SCC(O)c1ccccc1 62a_100009813875_100000185958 [0,2,0,0,0,0|2,0,0]=4 17738 B15R1.500 NC(=O)C(F)SC[C@@H](O)c1ccccc1 62a_100009813875_100011933945 [0,2,0,0,0,0|2,0,0]=4 17739 B15R1.500 NC(=O)C(F)SC[C@@H](O)c1ccccc1 62a_100011933945_100009813875 [0,2,0,0,0,0|2,0,0]=4 17740 B15R1.500 N[C@H](COC(F)C(=O)[O-])c1ccccc1 34a_100000751927_100020610796 [0,2,0,0,0,0|1,0,1]=4 17741 B15R1.500 O=C([O-])C(F)SCC(O)c1ccccc1 62a_100000185958_100020610796 [0,2,0,0,0,0|1,0,1]=4 17742 B15R1.500 O=C([O-])C(F)SCC(O)c1ccccc1 62a_100020610796_100000185958 [0,2,0,0,0,0|1,0,1]=4 17743 B15R1.500 O=C([O-])C(F)SC[C@@H](O)c1ccccc1 62a_100011933945_100020610796 [0,2,0,0,0,0|1,0,1]=4 17744 B15R1.500 O=C([O-])C(F)SC[C@@H](O)c1ccccc1 62a_100020610796_100011933945 [0,2,0,0,0,0|1,0,1]=4 17745 B15R1.882 CC(=O)CCCC(=O)c1ccc(cc1)Br 1458a_100000070787_100000211046 [0,2,0,0,0,0|1,0,1]=4 17746 B15R1.882 CC(=O)CCCC(=O)c1ccc(cc1)Br 1458a_100000185839_100011215641 [0,2,0,0,0,0|1,0,1]=4 17747 B15R1.882 CC(=O)CCCC(=O)c1ccc(cc1)C 1458a_100000188618_100011215641 [0,2,0,0,0,0|1,0,1]=4 17748 B15R1.882 CC(=O)CCCC(=O)c1ccc(cc1)Cl 1458a_100000070787_200011217871 [0,2,0,0,0,0|1,0,1]=4 17749 B15R1.882 CC(=O)CCCC(=O)c1ccc(cc1)Cl 1458a_100000210187_100011215641 [0,2,0,0,0,0|1,0,1]=4 17750 B15R1.882 CC(=O)CCCC(=O)c1ccc(cc1)F 1458a_100000070787_100000211961 [0,2,0,0,0,0|1,0,1]=4 17751 B15R1.882 CC(=O)CCCC(=O)c1ccc(cc1)F 1458a_100000187176_100011215641 [0,2,0,0,0,0|1,0,1]=4 17752 B15R1.882 CC(=O)CCCC(=O)c1ccc(cc1)I 1458a_100000187904_100011215641 [0,2,0,0,0,0|1,0,1]=4 17753 B15R1.882 CC(=O)CCCC(=O)c1ccc(cc1)O 1458a_100000070787_100000039620 [0,2,0,0,0,0|1,0,1]=4 17754 B15R1.882 CC(=O)CCCC(=O)c1ccc(cc1)O 1458a_100000212099_100011215641 [0,2,0,0,0,0|1,0,1]=4 17755 B15R1.882 CC(=O)CCCN(C)c1ccc(cc1)Br 269982a_100000219623_100011215641 [0,2,0,0,0,0|2,0,0]=4 17756 B15R1.882 CC(=O)CCCN(C)c1ccc(cc1)Br 34a_100000219623_100000685027 [0,2,0,0,0,0|2,0,0]=4 17757 B15R1.882 CC(=O)CCCN(C)c1ccc(cc1)C 269982a_100000219977_100011215641 [0,2,0,0,0,0|2,0,0]=4 17758 B15R1.882 CC(=O)CCCN(C)c1ccc(cc1)C 34a_100000219977_100000685027 [0,2,0,0,0,0|2,0,0]=4 17759 B15R1.882 CC(=O)CCCN(C)c1ccc(cc1)Cl 269982a_100020629279_100011215641 [0,2,0,0,0,0|2,0,0]=4 17760 B15R1.882 CC(=O)CCCN(C)c1ccc(cc1)Cl 34a_100020629279_100000685027 [0,2,0,0,0,0|2,0,0]=4 17761 B15R1.882 CC(=O)CCCN(C)c1ccc(cc1)F 269982a_100000219829_100011215641 [0,2,0,0,0,0|2,0,0]=4 17762 B15R1.882 CC(=O)CCCN(C)c1ccc(cc1)F 34a_100000219829_100000685027 [0,2,0,0,0,0|2,0,0]=4 17763 B15R1.882 CC(=O)CCCN(C)c1ccc(cc1)I 269982a_100000743151_100011215641 [0,2,0,0,0,0|2,0,0]=4 17764 B15R1.882 CC(=O)CCCN(C)c1ccc(cc1)I 34a_100000743151_100000685027 [0,2,0,0,0,0|2,0,0]=4 17765 B15R1.882 CC(=O)CCCN(C)c1ccc(cc1)O 269982a_100000182112_100011215641 [0,2,0,0,0,0|2,0,0]=4 17766 B15R1.882 CC(=O)CCCN(C)c1ccc(cc1)O 34a_100000182112_100000685027 [0,2,0,0,0,0|2,0,0]=4 17767 B15R1.882 CC(=O)CCCS(=O)c1ccc(cc1)Br 1458a_100000753581_200000210301 [0,2,0,0,0,0|2,0,0]=4 17768 B15R1.882 CC(=O)CCOC(C)c1ccc(cc1)Br 34a_100000759926_100000755118 [0,2,0,0,0,0|2,0,0]=4 17769 B15R1.882 CC(=O)CCOC(C)c1ccc(cc1)Br 7a_100000745893_100000053229 [0,2,0,0,0,0|2,0,0]=4 17770 B15R1.882 CC(=O)CCOC(C)c1ccc(cc1)C 34a_100000759926_100011261388 [0,2,0,0,0,0|2,0,0]=4 17771 B15R1.882 CC(=O)CCOC(C)c1ccc(cc1)C 7a_100000759926_100011261388 [0,2,0,0,0,0|2,0,0]=4 17772 B15R1.882 CC(=O)CCOC(C)c1ccc(cc1)Cl 7a_100000759926_100000684792 [0,2,0,0,0,0|2,0,0]=4 17773 B15R1.882 CC(=O)CCOC(C)c1ccc(cc1)F 34a_100000759926_100000743420 [0,2,0,0,0,0|2,0,0]=4 17774 B15R1.882 CC(=O)CCOC(C)c1ccc(cc1)F 7a_100000181323_100000053229 [0,2,0,0,0,0|2,0,0]=4 17775 B15R1.882 CC(=O)CCOC(C)c1ccc(cc1)F 7a_100000759926_100000743420 [0,2,0,0,0,0|2,0,0]=4 17776 B15R1.882 CC(=O)CCO[C@@H](C)c1ccc(cc1)Cl 7a_100011852131_100000053229 [0,2,0,0,0,0|2,0,0]=4 17777 B15R1.882 CC(=O)CCO[C@H](C)c1ccc(cc1)C 7a_100000690690_100000053229 [0,2,0,0,0,0|2,0,0]=4 17778 B15R1.882 CC(=O)CCSC(C)c1ccc(cc1)Br 62a_100000053229_100000755118 [0,2,0,0,0,0|2,0,0]=4 17779 B15R1.882 CC(=O)CCSC(C)c1ccc(cc1)Br 62a_100000755118_100000053229 [0,2,0,0,0,0|2,0,0]=4 17780 B15R1.882 CC(=O)CCSC(C)c1ccc(cc1)C 62a_100000053229_100011261388 [0,2,0,0,0,0|2,0,0]=4 17781 B15R1.882 CC(=O)CCSC(C)c1ccc(cc1)C 62a_100011261388_100000053229 [0,2,0,0,0,0|2,0,0]=4 17782 B15R1.882 CC(=O)CCSC(C)c1ccc(cc1)Cl 62a_100000053229_100000684792 [0,2,0,0,0,0|2,0,0]=4 17783 B15R1.882 CC(=O)CCSC(C)c1ccc(cc1)Cl 62a_100000684792_100000053229 [0,2,0,0,0,0|2,0,0]=4 17784 B15R1.882 CC(=O)CCSC(C)c1ccc(cc1)F 62a_100000053229_100000743420 [0,2,0,0,0,0|2,0,0]=4 17785 B15R1.882 CC(=O)CCSC(C)c1ccc(cc1)F 62a_100000743420_100000053229 [0,2,0,0,0,0|2,0,0]=4 17786 B15R1.882 CC(=O)COCC(O)c1ccc(cc1)Cl 34a_100000211253_200011996143 [0,2,0,0,0,0|2,0,0]=4 17787 B15R1.882 CC(=O)COC[C@H](O)c1ccc(cc1)F 34a_100000211253_100000720402 [0,2,0,0,0,0|2,0,0]=4 17788 B15R1.882 CC(CNCC(=O)N)c1ccc(cc1)O 34a_200015188644_100000187820 [0,2,0,0,0,0|2,0,0]=4 17789 B15R1.882 CC(CNCC(=O)[O-])c1ccc(cc1)O 34a_200015188644_100020667443 [0,2,0,0,0,0|1,0,1]=4 17790 B15R1.882 CC(NCCC(=O)N)c1ccc(cc1)Br 269862a_100000740010_100000185794 [0,2,0,0,0,0|2,0,0]=4 17791 B15R1.882 CC(NCCC(=O)N)c1ccc(cc1)Cl 269862a_100000740010_100000185797 [0,2,0,0,0,0|2,0,0]=4 17792 B15R1.882 CC(NCCC(=O)N)c1ccc(cc1)F 269862a_100000740010_100000185800 [0,2,0,0,0,0|2,0,0]=4 17793 B15R1.882 CC(NCCC(=O)N)c1ccc(cc1)I 269862a_100000740010_100000185465 [0,2,0,0,0,0|2,0,0]=4 17794 B15R1.882 CC(NOCC(=O)O)c1ccc(cc1)Br 269956a_100000106656_100000755118 [0,2,0,0,0,0|2,0,0]=4 17795 B15R1.882 CC(NOCC(=O)O)c1ccc(cc1)Cl 269956a_100000106656_100000684792 [0,2,0,0,0,0|2,0,0]=4 17796 B15R1.882 CC(NOCC(=O)O)c1ccc(cc1)F 269956a_100000106656_100000743420 [0,2,0,0,0,0|2,0,0]=4 17797 B15R1.882 CC(OCCC(=O)N)c1ccc(cc1)Br 34a_100000745893_100000731001 [0,2,0,0,0,0|2,0,0]=4 17798 B15R1.882 CC(OCCC(=O)N)c1ccc(cc1)Br 34a_100000757172_100000755118 [0,2,0,0,0,0|2,0,0]=4 17799 B15R1.882 CC(OCCC(=O)N)c1ccc(cc1)Br 7a_100000745893_100000744528 [0,2,0,0,0,0|2,0,0]=4 17800 B15R1.882 CC(OCCC(=O)N)c1ccc(cc1)Cl 7a_100000757172_100000684792 [0,2,0,0,0,0|2,0,0]=4 17801 B15R1.882 CC(OCCC(=O)N)c1ccc(cc1)F 34a_100000181323_100000731001 [0,2,0,0,0,0|2,0,0]=4 17802 B15R1.882 CC(OCCC(=O)N)c1ccc(cc1)F 34a_100000757172_100000743420 [0,2,0,0,0,0|2,0,0]=4 17803 B15R1.882 CC(OCCC(=O)N)c1ccc(cc1)F 7a_100000181323_100000744528 [0,2,0,0,0,0|2,0,0]=4 17804 B15R1.882 CC(OCCC(=O)N)c1ccc(cc1)F 7a_100000757172_100000743420 [0,2,0,0,0,0|2,0,0]=4 17805 B15R1.882 CC(OCCC(=O)N)c1ccc(cc1)N 34a_100011216399_100000731001 [0,2,0,0,0,0|2,0,0]=4 17806 B15R1.882 CC(SCCC(=O)N)c1ccc(cc1)Br 62a_100000744528_100000755118 [0,2,0,0,0,0|2,0,0]=4 17807 B15R1.882 CC(SCCC(=O)N)c1ccc(cc1)Br 62a_100000755118_100000744528 [0,2,0,0,0,0|2,0,0]=4 17808 B15R1.882 CC(SCCC(=O)N)c1ccc(cc1)Cl 62a_100000684792_100000744528 [0,2,0,0,0,0|2,0,0]=4 17809 B15R1.882 CC(SCCC(=O)N)c1ccc(cc1)Cl 62a_100000744528_100000684792 [0,2,0,0,0,0|2,0,0]=4 17810 B15R1.882 CC(SCCC(=O)N)c1ccc(cc1)F 62a_100000743420_100000744528 [0,2,0,0,0,0|2,0,0]=4 17811 B15R1.882 CC(SCCC(=O)N)c1ccc(cc1)F 62a_100000744528_100000743420 [0,2,0,0,0,0|2,0,0]=4 17812 B15R1.882 CN(CCCC(=O)N)c1ccc(cc1)Br 269982a_100000219623_100102525003 [0,2,0,0,0,0|2,0,0]=4 17813 B15R1.882 CN(CCCC(=O)N)c1ccc(cc1)Br 34a_100000219623_100102525003 [0,2,0,0,0,0|2,0,0]=4 17814 B15R1.882 CN(CCCC(=O)N)c1ccc(cc1)Cl 269982a_100020629279_100102525003 [0,2,0,0,0,0|2,0,0]=4 17815 B15R1.882 CN(CCCC(=O)N)c1ccc(cc1)Cl 34a_100020629279_100102525003 [0,2,0,0,0,0|2,0,0]=4 17816 B15R1.882 CN(CCCC(=O)N)c1ccc(cc1)F 269982a_100000219829_100102525003 [0,2,0,0,0,0|2,0,0]=4 17817 B15R1.882 CN(CCCC(=O)N)c1ccc(cc1)F 34a_100000219829_100102525003 [0,2,0,0,0,0|2,0,0]=4 17818 B15R1.882 CN(CCCC(=O)N)c1ccc(cc1)I 269982a_100000743151_100102525003 [0,2,0,0,0,0|2,0,0]=4 17819 B15R1.882 CN(CCCC(=O)N)c1ccc(cc1)I 34a_100000743151_100102525003 [0,2,0,0,0,0|2,0,0]=4 17820 B15R1.882 CN(CCCC(=O)N)c1ccc(cc1)O 269982a_100000182112_100102525003 [0,2,0,0,0,0|2,0,0]=4 17821 B15R1.882 CN(CCCC(=O)N)c1ccc(cc1)O 34a_100000182112_100102525003 [0,2,0,0,0,0|2,0,0]=4 17822 B15R1.882 C[C@@H](NCCC(=O)N)c1ccc(cc1)Br 2230a_100000720352_100000744528 [0,2,0,0,0,0|2,0,0]=4 17823 B15R1.882 C[C@@H](NCCC(=O)N)c1ccc(cc1)Cl 2230a_100015205461_100000744528 [0,2,0,0,0,0|2,0,0]=4 17824 B15R1.882 C[C@@H](NCCC(=O)N)c1ccc(cc1)Cl 34a_100015205461_100000731001 [0,2,0,0,0,0|2,0,0]=4 17825 B15R1.882 C[C@H](NCCC(=O)N)c1ccc(cc1)F 2230a_100025705893_100000744528 [0,2,0,0,0,0|2,0,0]=4 17826 B15R1.882 C[C@H](NCCC(=O)N)c1ccc(cc1)F 34a_100025705893_100000731001 [0,2,0,0,0,0|2,0,0]=4 17827 B15R1.882 C[C@H](NCCC(=O)N)c1ccc(cc1)I 2230a_100000753911_100000744528 [0,2,0,0,0,0|2,0,0]=4 17828 B15R1.882 C[C@H](NCCC(=O)N)c1ccc(cc1)O 2230a_100161106496_100000744528 [0,2,0,0,0,0|2,0,0]=4 17829 B15R1.882 C[C@H](OCCC(=O)N)c1ccc(cc1)Cl 34a_100011852131_100000731001 [0,2,0,0,0,0|2,0,0]=4 17830 B15R1.882 C[C@H](OCCC(=O)N)c1ccc(cc1)Cl 7a_100011852131_100000744528 [0,2,0,0,0,0|2,0,0]=4 17831 B15R1.882 Cc1ccc(cc1)C(=O)CCCC(=O)N 1458a_100000188618_100102525003 [0,2,0,0,0,0|1,0,1]=4 17832 B15R1.882 Cc1ccc(cc1)C(=O)CNCC(=O)O 269956a_100016091260_100000211441 [0,2,0,0,0,0|1,0,1]=4 17833 B15R1.882 Cc1ccc(cc1)C(C)NCCC(=O)N 269862a_100000740010_100000185793 [0,2,0,0,0,0|2,0,0]=4 17834 B15R1.882 Cc1ccc(cc1)C(C)NOCC(=O)O 269956a_100000106656_100011261388 [0,2,0,0,0,0|2,0,0]=4 17835 B15R1.882 Cc1ccc(cc1)C(C)OCCC(=O)N 34a_100000757172_100011261388 [0,2,0,0,0,0|2,0,0]=4 17836 B15R1.882 Cc1ccc(cc1)C(C)OCCC(=O)N 7a_100000757172_100011261388 [0,2,0,0,0,0|2,0,0]=4 17837 B15R1.882 Cc1ccc(cc1)C(C)SCCC(=O)N 62a_100000744528_100011261388 [0,2,0,0,0,0|2,0,0]=4 17838 B15R1.882 Cc1ccc(cc1)C(C)SCCC(=O)N 62a_100011261388_100000744528 [0,2,0,0,0,0|2,0,0]=4 17839 B15R1.882 Cc1ccc(cc1)C(O)CNCC(=O)N 2230a_200020610344_100000747473 [0,2,0,0,0,0|2,0,0]=4 17840 B15R1.882 Cc1ccc(cc1)C(O)CNCC(=O)N 34a_200020610344_100000187820 [0,2,0,0,0,0|2,0,0]=4 17841 B15R1.882 Cc1ccc(cc1)C(O)CNCC(=O)[O-] 34a_200020610344_100020667443 [0,2,0,0,0,0|1,0,1]=4 17842 B15R1.882 Cc1ccc(cc1)N(C)CCCC(=O)N 269982a_100000219977_100102525003 [0,2,0,0,0,0|2,0,0]=4 17843 B15R1.882 Cc1ccc(cc1)N(C)CCCC(=O)N 34a_100000219977_100102525003 [0,2,0,0,0,0|2,0,0]=4 17844 B15R1.882 Cc1ccc(cc1)[C@@H](C)NCCC(=O)N 2230a_100016988085_100000744528 [0,2,0,0,0,0|2,0,0]=4 17845 B15R1.882 Cc1ccc(cc1)[C@@H](C)NCCC(=O)N 34a_100016988085_100000731001 [0,2,0,0,0,0|2,0,0]=4 17846 B15R1.882 Cc1ccc(cc1)[C@@H](C)OCCC(=O)N 34a_100000690690_100000731001 [0,2,0,0,0,0|2,0,0]=4 17847 B15R1.882 Cc1ccc(cc1)[C@@H](C)OCCC(=O)N 7a_100000690690_100000744528 [0,2,0,0,0,0|2,0,0]=4 17848 B15R1.882 Cc1ccc(cc1)[C@@H](N)COCC(=O)N 34a_100009818840_100000187820 [0,2,0,0,0,0|2,0,0]=4 17849 B15R1.882 Cc1ccc(cc1)[C@@H](N)COCC(=O)[O-] 34a_100009818840_100020667443 [0,2,0,0,0,0|1,0,1]=4 17850 B15R1.882 NC(=O)CCCC(=O)c1ccc(cc1)Br 1458a_100000185839_100102525003 [0,2,0,0,0,0|1,0,1]=4 17851 B15R1.882 NC(=O)CCCC(=O)c1ccc(cc1)Cl 1458a_100000210187_100102525003 [0,2,0,0,0,0|1,0,1]=4 17852 B15R1.882 NC(=O)CCCC(=O)c1ccc(cc1)F 1458a_100000187176_100102525003 [0,2,0,0,0,0|1,0,1]=4 17853 B15R1.882 NC(=O)CCCC(=O)c1ccc(cc1)I 1458a_100000187904_100102525003 [0,2,0,0,0,0|1,0,1]=4 17854 B15R1.882 NC(=O)CCCC(=O)c1ccc(cc1)O 1458a_100000212099_100102525003 [0,2,0,0,0,0|1,0,1]=4 17855 B15R1.882 NC(=O)CNCC(O)c1ccc(cc1)Br 2230a_100020626992_100000747473 [0,2,0,0,0,0|2,0,0]=4 17856 B15R1.882 NC(=O)CNCC(O)c1ccc(cc1)Br 34a_100020626992_100000187820 [0,2,0,0,0,0|2,0,0]=4 17857 B15R1.882 NC(=O)CNCC(O)c1ccc(cc1)Cl 2230a_100000711301_200011996143 [0,2,0,0,0,0|2,0,0]=4 17858 B15R1.882 NC(=O)CNCC(O)c1ccc(cc1)Cl 2230a_100000736658_100000747473 [0,2,0,0,0,0|2,0,0]=4 17859 B15R1.882 NC(=O)CNCC(O)c1ccc(cc1)Cl 34a_100000736658_100000187820 [0,2,0,0,0,0|2,0,0]=4 17860 B15R1.882 NC(=O)CNCC(O)c1ccc(cc1)O 34a_100000067596_100000187820 [0,2,0,0,0,0|2,0,0]=4 17861 B15R1.882 NC(=O)CNC[C@H](O)c1ccc(cc1)F 2230a_100000711301_100000720402 [0,2,0,0,0,0|2,0,0]=4 17862 B15R1.882 NC(=O)COCC(N)c1ccc(cc1)Br 34a_100000734186_100000187820 [0,2,0,0,0,0|2,0,0]=4 17863 B15R1.882 NC(=O)COCC(N)c1ccc(cc1)F 34a_100000705410_100000187820 [0,2,0,0,0,0|2,0,0]=4 17864 B15R1.882 NC(=O)COC[C@@H](N)c1ccc(cc1)Cl 34a_100009818818_100000187820 [0,2,0,0,0,0|2,0,0]=4 17865 B15R1.882 NC(=O)CSCC(O)c1ccc(cc1)Cl 62a_100000747473_200011996143 [0,2,0,0,0,0|2,0,0]=4 17866 B15R1.882 NC(=O)CSCC(O)c1ccc(cc1)Cl 62a_200011996143_100000747473 [0,2,0,0,0,0|2,0,0]=4 17867 B15R1.882 NC(=O)CSC[C@H](O)c1ccc(cc1)F 62a_100000720402_100000747473 [0,2,0,0,0,0|2,0,0]=4 17868 B15R1.882 NC(=O)CSC[C@H](O)c1ccc(cc1)F 62a_100000747473_100000720402 [0,2,0,0,0,0|2,0,0]=4 17869 B15R1.882 NC(COCC(=O)[O-])c1ccc(cc1)Br 34a_100000734186_100020667443 [0,2,0,0,0,0|1,0,1]=4 17870 B15R1.882 NC(COCC(=O)[O-])c1ccc(cc1)F 34a_100000705410_100020667443 [0,2,0,0,0,0|1,0,1]=4 17871 B15R1.882 N[C@H](COCC(=O)[O-])c1ccc(cc1)Cl 34a_100009818818_100020667443 [0,2,0,0,0,0|1,0,1]=4 17872 B15R1.882 O=C(O)CNCC(=O)c1ccc(cc1)Br 269956a_100016091260_100000188085 [0,2,0,0,0,0|1,0,1]=4 17873 B15R1.882 O=C(O)CNCC(=O)c1ccc(cc1)Cl 269956a_100016091260_100000211071 [0,2,0,0,0,0|1,0,1]=4 17874 B15R1.882 O=C(O)CNCC(=O)c1ccc(cc1)F 269956a_100016091260_100000211279 [0,2,0,0,0,0|1,0,1]=4 17875 B15R1.882 O=C(O)CNCC(=O)c1ccc(cc1)I 269956a_100016091260_100011216261 [0,2,0,0,0,0|1,0,1]=4 17876 B15R1.882 O=C(O)CNCC(=O)c1ccc(cc1)O 269956a_100016091260_100009814261 [0,2,0,0,0,0|1,0,1]=4 17877 B15R1.882 O=C(O)CNCC(O)c1ccc(cc1)Cl 269956a_100016091260_200011996143 [0,2,0,0,0,0|1,0,0]=3 17878 B15R1.882 O=C(O)CNC[C@H](O)c1ccc(cc1)F 269956a_100016091260_100000720402 [0,2,0,0,0,0|1,0,0]=3 17879 B15R1.882 O=C([O-])CNCC(O)c1ccc(cc1)Br 34a_100020626992_100020667443 [0,2,0,0,0,0|1,0,1]=4 17880 B15R1.882 O=C([O-])CNCC(O)c1ccc(cc1)Cl 34a_100000736658_100020667443 [0,2,0,0,0,0|1,0,1]=4 17881 B15R1.882 O=C([O-])CNCC(O)c1ccc(cc1)O 34a_100000067596_100020667443 [0,2,0,0,0,0|1,0,1]=4 17882 B15R1.882 O=C([O-])CSCC(O)c1ccc(cc1)Cl 62a_100020667443_200011996143 [0,2,0,0,0,0|1,0,1]=4 17883 B15R1.882 O=C([O-])CSCC(O)c1ccc(cc1)Cl 62a_200011996143_100020667443 [0,2,0,0,0,0|1,0,1]=4 17884 B15R1.882 O=C([O-])CSC[C@H](O)c1ccc(cc1)F 62a_100000720402_100020667443 [0,2,0,0,0,0|1,0,1]=4 17885 B15R1.882 O=C([O-])CSC[C@H](O)c1ccc(cc1)F 62a_100020667443_100000720402 [0,2,0,0,0,0|1,0,1]=4 17886 B15R1.882 [13CH3]C(=O)CCCS(=O)c1ccc(cc1)Br 1458a_100000753581_200025704644 [0,2,0,0,0,0|2,0,0]=4 17887 B15R1.882 [2H]C(OCCC(=O)C)c1ccc(cc1)F 7a_217856618577_100000053229 [0,2,0,0,0,0|2,0,0]=4 17888 B15R1.882 [2H]C(OCCC(=O)N)c1ccc(cc1)F 34a_217856618577_100000731001 [0,2,0,0,0,0|2,0,0]=4 17889 B15R1.882 [2H]C(OCCC(=O)N)c1ccc(cc1)F 7a_217856618577_100000744528 [0,2,0,0,0,0|2,0,0]=4 17890 B15R1.959 C#CC(=O)CCCC(=O)c1ccccc1 1458a_100000211873_100000211006 [0,2,0,0,0,0|1,0,1]=4 17891 B15R1.959 C=C(CCCC(=O)CC)c1ccccc1 1458a_200009911520_100000210202 [0,2,0,0,0,0|1,0,1]=4 17892 B15R1.959 C=C(CCCC(=O)CF)c1ccccc1 1458a_200009911520_100015361967 [0,2,0,0,0,0|1,0,1]=4 17893 B15R1.959 C=C(CCCC(=O)NC)c1ccccc1 11a_106832991635_200009911520 [0,2,0,0,0,0|1,0,1]=4 17894 B15R1.959 C=C(CCCC(=O)NC)c1ccccc1 1626a_100102657272_200009911520 [0,2,0,0,0,0|1,0,1]=4 17895 B15R1.959 C=C(CCCC(=O)NC)c1ccccc1 240690a_100102657272_200009911520 [0,2,0,0,0,0|1,0,1]=4 17896 B15R1.959 C=C(CCCC(=O)NC)c1ccccc1 527a_100102657272_200009911520 [0,2,0,0,0,0|1,0,1]=4 17897 B15R1.959 C=CC(=O)CCCC(=O)c1ccccc1 1458a_100000185746_100000211006 [0,2,0,0,0,0|1,0,1]=4 17898 B15R1.959 C=CC(=O)NCCC(O)c1ccccc1 240690a_100000763605_200121576911 [0,2,0,0,0,0|2,0,0]=4 17899 B15R1.959 CC(OCCC(=NO)N)c1ccccc1 34a_100000749954_100000211855 [0,2,0,0,0,0|2,0,0]=4 17900 B15R1.959 CCC(=O)CCCC(=O)c1ccccc1 1458a_100000210414_100000211006 [0,2,0,0,0,0|1,0,1]=4 17901 B15R1.959 CCC(=O)COCC(C)c1ccccc1 34a_100000725409_100000756946 [0,2,0,0,0,0|2,0,0]=4 17902 B15R1.959 CCC(=O)COCC(C)c1ccccc1 7a_100011215166_100000747405 [0,2,0,0,0,0|2,0,0]=4 17903 B15R1.959 CCC(=O)COCC(O)c1ccccc1 34a_100000725409_100000185958 [0,2,0,0,0,0|2,0,0]=4 17904 B15R1.959 CCC(=O)COC[C@@H](O)c1ccccc1 34a_100000725409_100011933945 [0,2,0,0,0,0|2,0,0]=4 17905 B15R1.959 CCC(=O)CSCC(C)c1ccccc1 62a_100000747405_100000756946 [0,2,0,0,0,0|2,0,0]=4 17906 B15R1.959 CCC(=O)CSCC(C)c1ccccc1 62a_100000756946_100000747405 [0,2,0,0,0,0|2,0,0]=4 17907 B15R1.959 CCC(=O)CSCC(O)c1ccccc1 62a_100000185958_100000747405 [0,2,0,0,0,0|2,0,0]=4 17908 B15R1.959 CCC(=O)CSCC(O)c1ccccc1 62a_100000747405_100000185958 [0,2,0,0,0,0|2,0,0]=4 17909 B15R1.959 CCC(=O)CSC[C@@H](O)c1ccccc1 62a_100000747405_100011933945 [0,2,0,0,0,0|2,0,0]=4 17910 B15R1.959 CCC(=O)CSC[C@@H](O)c1ccccc1 62a_100011933945_100000747405 [0,2,0,0,0,0|2,0,0]=4 17911 B15R1.959 CCC(=O)NCCC(O)c1ccccc1 240690a_100000763605_100000210414 [0,2,0,0,0,0|2,0,0]=4 17912 B15R1.959 CCC(=O)NCCC(O)c1ccccc1 527a_100000763605_100000210414 [0,2,0,0,0,0|2,0,0]=4 17913 B15R1.959 CN(CCNC(=O)CO)c1ccccc1 240690a_100000231046_100000210174 [0,2,0,0,0,0|2,0,0]=4 17914 B15R1.959 CN(CCNC(=O)CO)c1ccccc1 527a_100000231046_100000210174 [0,2,0,0,0,0|2,0,0]=4 17915 B15R1.959 CNC(=O)CCCC(=O)c1ccccc1 1458a_100000185807_100000741757 [0,2,0,0,0,0|1,0,1]=4 17916 B15R1.959 CNC(=O)CCCN(C)c1ccccc1 2230a_100000210012_100000741757 [0,2,0,0,0,0|2,0,0]=4 17917 B15R1.959 CNC(=O)CCCN(C)c1ccccc1 269982a_100000210012_100000741757 [0,2,0,0,0,0|2,0,0]=4 17918 B15R1.959 CNC(=O)CCCN(C)c1ccccc1 34a_100000210012_100000741757 [0,2,0,0,0,0|2,0,0]=4 17919 B15R1.959 CNC(=O)CCNC(C)c1ccccc1 2230a_100000738227_100000230085 [0,2,0,0,0,0|2,0,0]=4 17920 B15R1.959 CNC(=O)CCNC(C)c1ccccc1 269862a_100000738227_100000185851 [0,2,0,0,0,0|2,0,0]=4 17921 B15R1.959 CNC(=O)CCNC(C)c1ccccc1 34a_100000738227_100000211855 [0,2,0,0,0,0|2,0,0]=4 17922 B15R1.959 CNC(=O)CCN[C@H](C)c1ccccc1 2230a_100000751104_100000737683 [0,2,0,0,0,0|2,0,0]=4 17923 B15R1.959 CNC(=O)CCOC(C)c1ccccc1 34a_100000754576_100000211855 [0,2,0,0,0,0|2,0,0]=4 17924 B15R1.959 CNC(=O)CCO[C@H](C)c1ccccc1 34a_100000761318_100012179268 [0,2,0,0,0,0|2,0,0]=4 17925 B15R1.959 CNC(=O)CCO[C@H](C)c1ccccc1 7a_100000761318_100000737683 [0,2,0,0,0,0|2,0,0]=4 17926 B15R1.959 CNC(=O)CCSC(C)c1ccccc1 62a_100000230085_100000737683 [0,2,0,0,0,0|2,0,0]=4 17927 B15R1.959 CNC(=O)CCSC(C)c1ccccc1 62a_100000737683_100000230085 [0,2,0,0,0,0|2,0,0]=4 17928 B15R1.959 CNC(=O)CNCC(C)c1ccccc1 2230a_100000693194_100000756946 [0,2,0,0,0,0|2,0,0]=4 17929 B15R1.959 CNC(=O)CNCC(C)c1ccccc1 2230a_100000701038_100000183359 [0,2,0,0,0,0|2,0,0]=4 17930 B15R1.959 CNC(=O)CNCC(C)c1ccccc1 270004a_100000693194_100000212034 [0,2,0,0,0,0|2,0,0]=4 17931 B15R1.959 CNC(=O)CNCC(C)c1ccccc1 34a_100000701038_100000183359 [0,2,0,0,0,0|2,0,0]=4 17932 B15R1.959 CNC(=O)CNCC(O)c1ccccc1 2230a_100000210709_100000183359 [0,2,0,0,0,0|2,0,0]=4 17933 B15R1.959 CNC(=O)CNCC(O)c1ccccc1 2230a_100000693194_100000185958 [0,2,0,0,0,0|2,0,0]=4 17934 B15R1.959 CNC(=O)CNC[C@@H](O)c1ccccc1 2230a_100000693194_100011933945 [0,2,0,0,0,0|2,0,0]=4 17935 B15R1.959 CNC(=O)COCC(C)c1ccccc1 34a_100000750040_100000756946 [0,2,0,0,0,0|2,0,0]=4 17936 B15R1.959 CNC(=O)COCC(C)c1ccccc1 34a_100011215166_100000183359 [0,2,0,0,0,0|2,0,0]=4 17937 B15R1.959 CNC(=O)COCC(C)c1ccccc1 7a_100011215166_100000183359 [0,2,0,0,0,0|2,0,0]=4 17938 B15R1.959 CNC(=O)COCC(O)c1ccccc1 34a_100000750040_100000185958 [0,2,0,0,0,0|2,0,0]=4 17939 B15R1.959 CNC(=O)COC[C@@H](N)c1ccccc1 34a_100000751927_100000183359 [0,2,0,0,0,0|2,0,0]=4 17940 B15R1.959 CNC(=O)COC[C@@H](O)c1ccccc1 34a_100000750040_100011933945 [0,2,0,0,0,0|2,0,0]=4 17941 B15R1.959 CNC(=O)CSCC(C)c1ccccc1 62a_100000183359_100000756946 [0,2,0,0,0,0|2,0,0]=4 17942 B15R1.959 CNC(=O)CSCC(C)c1ccccc1 62a_100000756946_100000183359 [0,2,0,0,0,0|2,0,0]=4 17943 B15R1.959 CNC(=O)CSCC(O)c1ccccc1 62a_100000183359_100000185958 [0,2,0,0,0,0|2,0,0]=4 17944 B15R1.959 CNC(=O)CSCC(O)c1ccccc1 62a_100000185958_100000183359 [0,2,0,0,0,0|2,0,0]=4 17945 B15R1.959 CNC(=O)CSC[C@@H](O)c1ccccc1 62a_100000183359_100011933945 [0,2,0,0,0,0|2,0,0]=4 17946 B15R1.959 CNC(=O)CSC[C@@H](O)c1ccccc1 62a_100011933945_100000183359 [0,2,0,0,0,0|2,0,0]=4 17947 B15R1.959 CNC(=O)NCCC(O)c1ccccc1 2708a_100102657272_100000763605 [0,2,0,0,0,0|2,0,0]=4 17948 B15R1.959 CNC(=O)NCCC(O)c1ccccc1 273464a_100000763605_100102657272 [0,2,0,0,0,0|2,0,0]=4 17949 B15R1.959 CNC(=O)NCCC(O)c1ccccc1 273464a_100102657272_100000763605 [0,2,0,0,0,0|2,0,0]=4 17950 B15R1.959 CNC(=O)NCCC(O)c1ccccc1 512a_106832991638_100000763605 [0,2,0,0,0,0|2,0,0]=4 17951 B15R1.959 COC(=O)CCCC(=O)c1ccccc1 1458a_100000185807_100011218270 [0,2,0,0,0,0|0,0,1]=3 17952 B15R1.959 COC(=O)CCCN(C)c1ccccc1 2230a_100000210012_100011218270 [0,2,0,0,0,0|1,0,0]=3 17953 B15R1.959 COC(=O)CCCN(C)c1ccccc1 269982a_100000210012_100011218270 [0,2,0,0,0,0|1,0,0]=3 17954 B15R1.959 COC(=O)CCCN(C)c1ccccc1 34a_100000210012_100000742333 [0,2,0,0,0,0|1,0,0]=3 17955 B15R1.959 COC(=O)CCNC(=O)c1ccccc1 188690a_100000683876_100000185807 [0,2,0,0,0,0|1,0,1]=4 17956 B15R1.959 COC(=O)CCNC(C)c1ccccn1 2230a_100000181244_100000204255 [0,2,0,0,0,0|2,0,0]=4 17957 B15R1.959 COC(=O)CCNC(C)c1cccnc1 2230a_100000195435_100000204255 [0,2,0,0,0,0|2,0,0]=4 17958 B15R1.959 COC(=O)CCNC(C)c1ccncc1 2230a_100000181269_100000204255 [0,2,0,0,0,0|2,0,0]=4 17959 B15R1.959 COC(=O)CCN[C@H](C)c1ccccc1 2230a_100000751104_100000204255 [0,2,0,0,0,0|1,0,0]=3 17960 B15R1.959 COC(=O)CCO[C@H](C)c1ccccc1 34a_100000761318_100000742370 [0,2,0,0,0,0|1,0,0]=3 17961 B15R1.959 COC(=O)CCO[C@H](C)c1ccccc1 7a_100000761318_100000204255 [0,2,0,0,0,0|1,0,0]=3 17962 B15R1.959 COC(=O)CCSC(C)c1ccccc1 62a_100000204255_100000230085 [0,2,0,0,0,0|1,0,0]=3 17963 B15R1.959 COC(=O)CCSC(C)c1ccccc1 62a_100000230085_100000204255 [0,2,0,0,0,0|1,0,0]=3 17964 B15R1.959 COC(=O)CNCC(C)c1ccccc1 2230a_100000701038_100000747449 [0,2,0,0,0,0|1,0,0]=3 17965 B15R1.959 COC(=O)CNCC(C)c1ccccc1 34a_100000701038_100000747449 [0,2,0,0,0,0|1,0,0]=3 17966 B15R1.959 COC(=O)CNCC(O)c1ccccc1 2230a_100000210709_100000747449 [0,2,0,0,0,0|1,0,0]=3 17967 B15R1.959 COC(=O)CNCC(O)c1ccccn1 2230a_100000691469_100000747449 [0,2,0,0,0,0|2,0,0]=4 17968 B15R1.959 COC(=O)CNCC(O)c1cccnc1 2230a_100020605170_100000747449 [0,2,0,0,0,0|2,0,0]=4 17969 B15R1.959 COC(=O)COCC(C)c1ccccc1 34a_100011215166_100000747449 [0,2,0,0,0,0|1,0,0]=3 17970 B15R1.959 COC(=O)COCC(C)c1ccccc1 7a_100011215166_100000747449 [0,2,0,0,0,0|1,0,0]=3 17971 B15R1.959 COC(=O)COC[C@@H](N)c1ccccc1 34a_100000751927_100000747449 [0,2,0,0,0,0|1,0,0]=3 17972 B15R1.959 COC(=O)COC[C@@H](N)c1ccncc1 34a_100138412524_100000747449 [0,2,0,0,0,0|2,0,0]=4 17973 B15R1.959 COC(=O)CSCC(=O)c1ccccc1 62a_100000211460_100000747449 [0,2,0,0,0,0|1,0,1]=4 17974 B15R1.959 COC(=O)CSCC(=O)c1ccccc1 62a_100000747449_100000211460 [0,2,0,0,0,0|1,0,1]=4 17975 B15R1.959 COC(=O)CSCC(C)c1ccccc1 62a_100000747449_100000756946 [0,2,0,0,0,0|1,0,0]=3 17976 B15R1.959 COC(=O)CSCC(C)c1ccccc1 62a_100000756946_100000747449 [0,2,0,0,0,0|1,0,0]=3 17977 B15R1.959 COC(=O)CSCC(O)c1ccccc1 62a_100000185958_100000747449 [0,2,0,0,0,0|1,0,0]=3 17978 B15R1.959 COC(=O)CSCC(O)c1ccccc1 62a_100000747449_100000185958 [0,2,0,0,0,0|1,0,0]=3 17979 B15R1.959 COC(=O)CSCS(=O)c1ccccc1 62a_100000747449_100000031784 [0,2,0,0,0,0|2,0,0]=4 17980 B15R1.959 COC(=O)CSC[C@@H](O)c1ccccc1 62a_100000747449_100011933945 [0,2,0,0,0,0|1,0,0]=3 17981 B15R1.959 COC(=O)CSC[C@@H](O)c1ccccc1 62a_100011933945_100000747449 [0,2,0,0,0,0|1,0,0]=3 17982 B15R1.959 COC(=O)OCSC(C)c1ccccc1 62a_100000230085_100000139417 [0,2,0,0,0,0|2,0,0]=4 17983 B15R1.959 O=C(CO)CCCC(=O)c1ccccc1 1458a_100000210174_100000211006 [0,2,0,0,0,0|0,0,1]=3 17984 B15R1.959 O=C(CO)CCNC(=O)c1ccccc1 1458a_100000210174_200011215302 [0,2,0,0,0,0|1,0,1]=4 17985 B15R1.959 O=C(CO)CCOC(=O)c1ccccc1 1458a_100000210174_100000184176 [0,2,0,0,0,0|1,0,1]=4 17986 B15R1.959 O=C(CO)NCCC(O)c1ccccc1 240690a_100000763605_100000210174 [0,2,0,0,0,0|1,0,0]=3 17987 B15R1.959 O=C(CO)NCCC(O)c1ccccc1 527a_100000763605_100000210174 [0,2,0,0,0,0|1,0,0]=3 17988 B15R1.1076 CC(CC(=O)CC(=O)N)c1ccccc1 1458a_100000183687_100000187820 [0,2,0,0,0,0|1,0,1]=4 17989 B15R1.1076 CC(CC(=O)CC(=O)N)c1ccccc1 1458a_100134613110_100000756946 [0,2,0,0,0,0|1,0,1]=4 17990 B15R1.1076 CC(CC(=O)CC(=O)[O-])c1ccccc1 1458a_100000183687_100020667443 [0,2,0,0,0,0|0,0,2]=4 17991 B15R1.1076 CC(CN(C)CC(=O)N)c1ccccc1 2230a_100000739694_100000756946 [0,2,0,0,0,0|2,0,0]=4 17992 B15R1.1076 CC(CN(C)CC(=O)N)c1ccccc1 270004a_100000739694_100000212034 [0,2,0,0,0,0|2,0,0]=4 17993 B15R1.1076 CC(CN(C)CC(=O)O)c1ccccc1 269956a_100000746989_100000756946 [0,2,0,0,0,0|1,0,0]=3 17994 B15R1.1076 CN(CC(=O)N)CC(O)c1ccccc1 2230a_100000227976_100000747473 [0,2,0,0,0,0|2,0,0]=4 17995 B15R1.1076 CN(CC(=O)N)CC(O)c1ccccc1 2230a_100000739694_100000185958 [0,2,0,0,0,0|2,0,0]=4 17996 B15R1.1076 CN(CC(=O)N)CC(O)c1ccccc1 269982a_100000227976_100000187820 [0,2,0,0,0,0|2,0,0]=4 17997 B15R1.1076 CN(CC(=O)N)C[C@@H](O)c1ccccc1 2230a_100000739694_100011933945 [0,2,0,0,0,0|2,0,0]=4 17998 B15R1.1076 CN(CC(=O)O)CC(=O)c1ccccc1 269956a_100000746989_100000211460 [0,2,0,0,0,0|1,0,1]=4 17999 B15R1.1076 CN(CC(=O)O)CC(O)c1ccccc1 269956a_100000746989_100000185958 [0,2,0,0,0,0|1,0,0]=3 18000 B15R1.1076 CN(CC(=O)O)CS(=O)c1ccccc1 269956a_100000746989_100000031784 [0,2,0,0,0,0|2,0,0]=4 18001 B15R1.1076 CN(CC(=O)O)C[C@@H](O)c1ccccc1 269956a_100000746989_100011933945 [0,2,0,0,0,0|1,0,0]=3 18002 B15R1.1076 CN(CC(=O)[O-])CC(O)c1ccccc1 269982a_100000227976_100020667443 [0,2,0,0,0,0|1,0,1]=4 18003 B15R1.1076 NC(=O)CC(=O)CC(O)c1ccccc1 1458a_100000690199_100000187820 [0,2,0,0,0,0|1,0,1]=4 18004 B15R1.1076 NC(=O)CC(=O)CC(O)c1ccccc1 1458a_100134613110_100000185958 [0,2,0,0,0,0|1,0,1]=4 18005 B15R1.1076 NC(=O)CC(=O)C[C@@H](O)c1ccccc1 1458a_100134613110_100011933945 [0,2,0,0,0,0|1,0,1]=4 18006 B15R1.1076 O=C([O-])CC(=O)CC(O)c1ccccc1 1458a_100000690199_100020667443 [0,2,0,0,0,0|0,0,2]=4 18007 B15R1.1078 CC(=O)CCN(C)C(C)c1ccccc1 269982a_100000195388_100000053229 [0,2,0,0,0,0|2,0,0]=4 18008 B15R1.1078 CC(C(=O)CCC(=O)N)c1ccccc1 1458a_100011215257_100000230085 [0,2,0,0,0,0|1,0,1]=4 18009 B15R1.1078 CC(NCC(=O)O)C(=O)c1ccccc1 269956a_100016091260_100000239700 [0,2,0,0,0,0|1,0,1]=4 18010 B15R1.1078 CC(c1ccccc1)N(C)CCC(=O)N 2230a_100000195388_100000744528 [0,2,0,0,0,0|2,0,0]=4 18011 B15R1.1078 CC(c1ccccc1)N(C)CCC(=O)N 2230a_100000730477_100000230085 [0,2,0,0,0,0|2,0,0]=4 18012 B15R1.1078 CC(c1ccccc1)N(C)CCC(=O)N 269982a_100000195388_100000744528 [0,2,0,0,0,0|2,0,0]=4 18013 B15R1.1078 C[C@H](OCC(=O)N)[C@@H](N)c1ccccc1 34a_100134616770_100000187820 [0,2,0,0,0,0|2,0,0]=4 18014 B15R1.1078 C[C@H](OCC(=O)[O-])[C@@H](N)c1ccccc1 34a_100134616770_100020667443 [0,2,0,0,0,0|1,0,1]=4 18015 B15R1.5331 C#CC(OCCC(=O)C)c1ccccc1 7a_100011219616_100000053229 [0,2,0,0,0,0|2,0,0]=4 18016 B15R1.5331 C#CC(OCCC(=O)N)c1ccccc1 34a_100011219616_100000731001 [0,2,0,0,0,0|2,0,0]=4 18017 B15R1.5331 C#CC(OCCC(=O)N)c1ccccc1 7a_100011219616_100000744528 [0,2,0,0,0,0|2,0,0]=4 18018 B15R1.5331 C=CC(NOCC(=O)O)c1ccccc1 269956a_100000106656_200000085779 [0,2,0,0,0,0|2,0,0]=4 18019 B15R1.5331 C=CC(OCCC(=O)C)c1ccccc1 7a_100011215659_100000053229 [0,2,0,0,0,0|2,0,0]=4 18020 B15R1.5331 C=CC(OCCC(=O)N)c1ccccc1 34a_100011215659_100000731001 [0,2,0,0,0,0|2,0,0]=4 18021 B15R1.5331 C=CC(OCCC(=O)N)c1ccccc1 7a_100011215659_100000744528 [0,2,0,0,0,0|2,0,0]=4 18022 B15R1.5331 C=CC(SCCC(=O)C)c1ccccc1 62a_100000053229_200000085779 [0,2,0,0,0,0|2,0,0]=4 18023 B15R1.5331 C=CC(SCCC(=O)C)c1ccccc1 62a_200000085779_100000053229 [0,2,0,0,0,0|2,0,0]=4 18024 B15R1.5331 C=CC(SCCC(=O)N)c1ccccc1 62a_100000744528_200000085779 [0,2,0,0,0,0|2,0,0]=4 18025 B15R1.5331 C=CC(SCCC(=O)N)c1ccccc1 62a_200000085779_100000744528 [0,2,0,0,0,0|2,0,0]=4 18026 B15R1.5331 CC(=O)CCOC(C#N)c1ccccc1 7a_100011217353_100000053229 [0,2,0,0,0,0|2,0,0]=4 18027 B15R1.5331 CC(=O)CCOC(CBr)c1ccccc1 7a_100000185958_100000053229 [0,2,0,0,0,0|2,0,0]=4 18028 B15R1.5331 CC(=O)CCO[C@H](CCl)c1ccccc1 7a_100011933945_100000053229 [0,2,0,0,0,0|2,0,0]=4 18029 B15R1.5331 CCC(COCC(=O)N)c1ccccc1 34a_100000752371_100000187820 [0,2,0,0,0,0|2,0,0]=4 18030 B15R1.5331 CCC(COCC(=O)N)c1ccccc1 7a_100000752371_100000187820 [0,2,0,0,0,0|2,0,0]=4 18031 B15R1.5331 CCC(COCC(=O)[O-])c1ccccc1 34a_100000752371_100020667443 [0,2,0,0,0,0|1,0,1]=4 18032 B15R1.5331 CCC(NCCC(=O)N)c1ccccc1 2230a_100000737752_100000744528 [0,2,0,0,0,0|2,0,0]=4 18033 B15R1.5331 CCC(NCCC(=O)N)c1ccccc1 269862a_100000740010_100000210124 [0,2,0,0,0,0|2,0,0]=4 18034 B15R1.5331 CCC(OCCC(=O)C)c1ccccc1 7a_100000698172_100000053229 [0,2,0,0,0,0|2,0,0]=4 18035 B15R1.5331 CCC(OCCC(=O)N)c1ccccc1 34a_100000698172_100000731001 [0,2,0,0,0,0|2,0,0]=4 18036 B15R1.5331 CCC(OCCC(=O)N)c1ccccc1 7a_100000698172_100000744528 [0,2,0,0,0,0|2,0,0]=4 18037 B15R1.5331 CCN(CCCC(=O)C)c1ccccc1 269982a_100000210013_100011215641 [0,2,0,0,0,0|2,0,0]=4 18038 B15R1.5331 CCN(CCCC(=O)C)c1ccccc1 34a_100000210013_100000685027 [0,2,0,0,0,0|2,0,0]=4 18039 B15R1.5331 CCN(CCCC(=O)N)c1ccccc1 269982a_100000210013_100102525003 [0,2,0,0,0,0|2,0,0]=4 18040 B15R1.5331 CCN(CCCC(=O)N)c1ccccc1 34a_100000210013_100102525003 [0,2,0,0,0,0|2,0,0]=4 18041 B15R1.5331 COC(COCC(=O)N)c1ccccc1 34a_100011215540_100000187820 [0,2,0,0,0,0|2,0,0]=4 18042 B15R1.5331 COC(COCC(=O)N)c1ccccc1 7a_100011215540_100000187820 [0,2,0,0,0,0|2,0,0]=4 18043 B15R1.5331 COC(COCC(=O)[O-])c1ccccc1 34a_100011215540_100020667443 [0,2,0,0,0,0|1,0,1]=4 18044 B15R1.5331 N#CC(OCCC(=O)N)c1ccccc1 7a_100011217353_100000744528 [0,2,0,0,0,0|2,0,0]=4 18045 B15R1.5331 NC(=O)CCN[C@H](CO)c1ccccc1 2230a_100000751927_100000744528 [0,2,0,0,0,0|2,0,0]=4 18046 B15R1.5331 NC(=O)CCN[C@H](CO)c1ccccc1 34a_100000751927_100000731001 [0,2,0,0,0,0|2,0,0]=4 18047 B15R1.5331 NC(=O)CCOC(CBr)c1ccccc1 7a_100000185958_100000744528 [0,2,0,0,0,0|2,0,0]=4 18048 B15R1.5331 NC(=O)CCO[C@H](CCl)c1ccccc1 34a_100011933945_100000731001 [0,2,0,0,0,0|2,0,0]=4 18049 B15R1.5331 NC(=O)CCO[C@H](CCl)c1ccccc1 7a_100011933945_100000744528 [0,2,0,0,0,0|2,0,0]=4 18050 B15R1.5331 NCC(OCCC(=O)N)c1ccccc1 34a_100000210709_100000731001 [0,2,0,0,0,0|2,0,0]=4 18051 B15R1.111 CC(=O)CCN(C)Cc1ccc(cc1)Br 269982a_100000180866_100000053229 [0,2,0,0,0,0|2,0,0]=4 18052 B15R1.111 CC(=O)CCN(C)Cc1ccc(cc1)C 269982a_100000744650_100000053229 [0,2,0,0,0,0|2,0,0]=4 18053 B15R1.111 CC(=O)CCN(C)Cc1ccc(cc1)Cl 269982a_100000184517_100000053229 [0,2,0,0,0,0|2,0,0]=4 18054 B15R1.111 CC(=O)CCN(C)Cc1ccc(cc1)F 269982a_100000184576_100000053229 [0,2,0,0,0,0|2,0,0]=4 18055 B15R1.111 CC(=O)CCN(C)Cc1ccc(cc1)O 269982a_100000207500_100000053229 [0,2,0,0,0,0|2,0,0]=4 18056 B15R1.111 CC(Cc1ccc(cc1)F)OCC(=O)N 34a_100011351027_100000187820 [0,2,0,0,0,0|2,0,0]=4 18057 B15R1.111 CC(Cc1ccc(cc1)F)OCC(=O)N 7a_100011351027_100000187820 [0,2,0,0,0,0|2,0,0]=4 18058 B15R1.111 CC(Cc1ccc(cc1)F)OCC(=O)[O-] 34a_100011351027_100020667443 [0,2,0,0,0,0|1,0,1]=4 18059 B15R1.111 CC(Cc1ccc(cc1)O)NCC(=O)N 2230a_100102634573_100000747473 [0,2,0,0,0,0|2,0,0]=4 18060 B15R1.111 CC(Cc1ccc(cc1)O)NCC(=O)N 34a_100102634573_100000187820 [0,2,0,0,0,0|2,0,0]=4 18061 B15R1.111 CC(Cc1ccc(cc1)O)NCC(=O)[O-] 34a_100102634573_100020667443 [0,2,0,0,0,0|1,0,1]=4 18062 B15R1.111 CN(CCC(=O)N)Cc1ccc(cc1)Br 2230a_100000180866_100000744528 [0,2,0,0,0,0|2,0,0]=4 18063 B15R1.111 CN(CCC(=O)N)Cc1ccc(cc1)Br 2230a_100000730477_100011217064 [0,2,0,0,0,0|2,0,0]=4 18064 B15R1.111 CN(CCC(=O)N)Cc1ccc(cc1)Br 269982a_100000180866_100000744528 [0,2,0,0,0,0|2,0,0]=4 18065 B15R1.111 CN(CCC(=O)N)Cc1ccc(cc1)Br 270004a_100000730477_100000186029 [0,2,0,0,0,0|2,0,0]=4 18066 B15R1.111 CN(CCC(=O)N)Cc1ccc(cc1)Cl 2230a_100000184517_100000744528 [0,2,0,0,0,0|2,0,0]=4 18067 B15R1.111 CN(CCC(=O)N)Cc1ccc(cc1)Cl 2230a_100000730477_100000694040 [0,2,0,0,0,0|2,0,0]=4 18068 B15R1.111 CN(CCC(=O)N)Cc1ccc(cc1)Cl 269982a_100000184517_100000744528 [0,2,0,0,0,0|2,0,0]=4 18069 B15R1.111 CN(CCC(=O)N)Cc1ccc(cc1)Cl 270004a_100000730477_100000189385 [0,2,0,0,0,0|2,0,0]=4 18070 B15R1.111 CN(CCC(=O)N)Cc1ccc(cc1)Cl 34a_100000184517_100000731001 [0,2,0,0,0,0|2,0,0]=4 18071 B15R1.111 CN(CCC(=O)N)Cc1ccc(cc1)F 2230a_100000184576_100000744528 [0,2,0,0,0,0|2,0,0]=4 18072 B15R1.111 CN(CCC(=O)N)Cc1ccc(cc1)F 2230a_100000730477_100000198546 [0,2,0,0,0,0|2,0,0]=4 18073 B15R1.111 CN(CCC(=O)N)Cc1ccc(cc1)F 269982a_100000184576_100000744528 [0,2,0,0,0,0|2,0,0]=4 18074 B15R1.111 CN(CCC(=O)N)Cc1ccc(cc1)F 270004a_100000730477_100000210084 [0,2,0,0,0,0|2,0,0]=4 18075 B15R1.111 CN(CCC(=O)N)Cc1ccc(cc1)F 34a_100000184576_100000731001 [0,2,0,0,0,0|2,0,0]=4 18076 B15R1.111 CN(CCC(=O)N)Cc1ccc(cc1)I 2230a_100000730477_100000189116 [0,2,0,0,0,0|2,0,0]=4 18077 B15R1.111 CN(CCC(=O)N)Cc1ccc(cc1)O 2230a_100000207500_100000744528 [0,2,0,0,0,0|2,0,0]=4 18078 B15R1.111 CN(CCC(=O)N)Cc1ccc(cc1)O 269982a_100000207500_100000744528 [0,2,0,0,0,0|2,0,0]=4 18079 B15R1.111 Cc1ccc(cc1)CC(=O)CCC(=O)N 1458a_100011215257_100000210814 [0,2,0,0,0,0|1,0,1]=4 18080 B15R1.111 Cc1ccc(cc1)CN(C)CCC(=O)N 2230a_100000730477_100000210814 [0,2,0,0,0,0|2,0,0]=4 18081 B15R1.111 Cc1ccc(cc1)CN(C)CCC(=O)N 2230a_100000744650_100000744528 [0,2,0,0,0,0|2,0,0]=4 18082 B15R1.111 Cc1ccc(cc1)CN(C)CCC(=O)N 269982a_100000744650_100000744528 [0,2,0,0,0,0|2,0,0]=4 18083 B15R1.111 Cc1ccc(cc1)CN(C)CCC(=O)N 270004a_100000730477_100000211033 [0,2,0,0,0,0|2,0,0]=4 18084 B15R1.111 Cc1ccc(cc1)CN(C)CCC(=O)N 34a_100000744650_100000731001 [0,2,0,0,0,0|2,0,0]=4 18085 B15R1.111 NC(=O)CCC(=O)Cc1ccc(cc1)Br 1458a_100011215257_100000189115 [0,2,0,0,0,0|1,0,1]=4 18086 B15R1.111 NC(=O)CCC(=O)Cc1ccc(cc1)Cl 1458a_100011215257_100000694040 [0,2,0,0,0,0|1,0,1]=4 18087 B15R1.111 NC(=O)CCC(=O)Cc1ccc(cc1)F 1458a_100011215257_100000198546 [0,2,0,0,0,0|1,0,1]=4 18088 B15R1.111 NC(=O)CCC(=O)Cc1ccc(cc1)I 1458a_100011215257_100000189116 [0,2,0,0,0,0|1,0,1]=4 18089 B15R1.496 CC(Cc1ccccc1)C(=O)CC(=O)N 1458a_100000754839_100000187820 [0,2,0,0,0,0|1,0,1]=4 18090 B15R1.496 CC(Cc1ccccc1)C(=O)CC(=O)N 1458a_100134613110_200011218536 [0,2,0,0,0,0|1,0,1]=4 18091 B15R1.496 CC(Cc1ccccc1)C(=O)CC(=O)[O-] 1458a_100000754839_100020667443 [0,2,0,0,0,0|0,0,2]=4 18092 B15R1.496 CC(Cc1ccccc1)N(C)CC(=O)O 269956a_100000746989_200011218536 [0,2,0,0,0,0|1,0,0]=3 18093 B15R1.496 NC(=O)CC(=O)[C@H](O)Cc1ccccc1 1458a_100009816399_100000187820 [0,2,0,0,0,0|1,0,1]=4 18094 B15R1.496 O=C([O-])CC(=O)[C@H](O)Cc1ccccc1 1458a_100009816399_100020667443 [0,2,0,0,0,0|0,0,2]=4 18095 B15R1.964 C#CC(=O)CCN(C)Cc1ccccc1 1458a_100000211873_100015196923 [0,2,0,0,0,0|2,0,0]=4 18096 B15R1.964 C=CC(=O)CCN(C)Cc1ccccc1 1458a_100000185746_100015196923 [0,2,0,0,0,0|2,0,0]=4 18097 B15R1.964 C=CC(=O)NCC(O)Cc1ccccc1 240690a_100000752270_200121576911 [0,2,0,0,0,0|2,0,0]=4 18098 B15R1.964 CC(CNC(=O)CO)Oc1ccccc1 240690a_100000755676_100000210174 [0,2,0,0,0,0|2,0,0]=4 18099 B15R1.964 CC(CNC(=O)CO)Oc1ccccc1 527a_100000755676_100000210174 [0,2,0,0,0,0|2,0,0]=4 18100 B15R1.964 CCC(=O)CCN(C)Cc1ccccc1 1458a_100000177486_100000210202 [0,2,0,0,0,0|2,0,0]=4 18101 B15R1.964 CCC(=O)CCN(C)Cc1ccccc1 1458a_100000210414_100015196923 [0,2,0,0,0,0|2,0,0]=4 18102 B15R1.964 CCC(=O)COC(C)Cc1ccccc1 34a_100000725409_200011218536 [0,2,0,0,0,0|2,0,0]=4 18103 B15R1.964 CCC(=O)COC(C)Cc1ccccc1 7a_100000748627_100000747405 [0,2,0,0,0,0|2,0,0]=4 18104 B15R1.964 CCC(=O)CSC(C)Cc1ccccc1 62a_100000747405_200011218536 [0,2,0,0,0,0|2,0,0]=4 18105 B15R1.964 CCC(=O)CSC(C)Cc1ccccc1 62a_200011218536_100000747405 [0,2,0,0,0,0|2,0,0]=4 18106 B15R1.964 CCC(=O)NCC(O)Cc1ccccc1 240690a_100000752270_100000210414 [0,2,0,0,0,0|2,0,0]=4 18107 B15R1.964 CCC(=O)NCC(O)Cc1ccccc1 527a_100000752270_100000210414 [0,2,0,0,0,0|2,0,0]=4 18108 B15R1.964 CN(CCC(=O)CF)Cc1ccccc1 1458a_100000177486_100015361967 [0,2,0,0,0,0|2,0,0]=4 18109 B15R1.964 CN(CCC(=O)CO)Cc1ccccc1 1458a_100000210174_100015196923 [0,2,0,0,0,0|1,0,0]=3 18110 B15R1.964 CNC(=O)CCC(=O)Cc1ccccc1 1458a_100011309844_100015291786 [0,2,0,0,0,0|1,0,1]=4 18111 B15R1.964 CNC(=O)CCN(C)Cc1ccccc1 2230a_100000186898_100000737683 [0,2,0,0,0,0|2,0,0]=4 18112 B15R1.964 CNC(=O)CCN(C)Cc1ccccc1 2230a_100000750875_100015291786 [0,2,0,0,0,0|2,0,0]=4 18113 B15R1.964 CNC(=O)CCN(C)Cc1ccccc1 240690a_100102657272_100000177486 [0,2,0,0,0,0|2,0,0]=4 18114 B15R1.964 CNC(=O)CCN(C)Cc1ccccc1 269982a_100000186898_100000737683 [0,2,0,0,0,0|2,0,0]=4 18115 B15R1.964 CNC(=O)CCN(C)Cc1ccccc1 269982a_100000750875_100000211182 [0,2,0,0,0,0|2,0,0]=4 18116 B15R1.964 CNC(=O)CCN(C)Cc1ccccc1 270004a_100000750875_100015611070 [0,2,0,0,0,0|2,0,0]=4 18117 B15R1.964 CNC(=O)COC(C)Cc1ccccc1 34a_100000748627_100000183359 [0,2,0,0,0,0|2,0,0]=4 18118 B15R1.964 CNC(=O)COC(C)Cc1ccccc1 34a_100000750040_200011218536 [0,2,0,0,0,0|2,0,0]=4 18119 B15R1.964 CNC(=O)COC(C)Cc1ccccc1 7a_100000748627_100000183359 [0,2,0,0,0,0|2,0,0]=4 18120 B15R1.964 CNC(=O)CSC(C)Cc1ccccc1 62a_100000183359_200011218536 [0,2,0,0,0,0|2,0,0]=4 18121 B15R1.964 CNC(=O)CSC(C)Cc1ccccc1 62a_200011218536_100000183359 [0,2,0,0,0,0|2,0,0]=4 18122 B15R1.964 CNC(=O)NCC(O)Cc1ccccc1 2708a_100102657272_100000752270 [0,2,0,0,0,0|2,0,0]=4 18123 B15R1.964 CNC(=O)NCC(O)Cc1ccccc1 273464a_100000752270_100102657272 [0,2,0,0,0,0|2,0,0]=4 18124 B15R1.964 CNC(=O)NCC(O)Cc1ccccc1 273464a_100102657272_100000752270 [0,2,0,0,0,0|2,0,0]=4 18125 B15R1.964 CNC(=O)NCC(O)Cc1ccccc1 512a_106832991638_100000752270 [0,2,0,0,0,0|2,0,0]=4 18126 B15R1.964 COC(=O)CCC(=O)Cc1ccccc1 1458a_100000187943_100015291786 [0,2,0,0,0,0|0,0,1]=3 18127 B15R1.964 COC(=O)CCC(=O)Cc1ccccn1 1458a_100000187943_100000721315 [0,2,0,0,0,0|1,0,1]=4 18128 B15R1.964 COC(=O)CCC(=O)Cc1cccnc1 1458a_100000187943_100000733263 [0,2,0,0,0,0|1,0,1]=4 18129 B15R1.964 COC(=O)CCC(=O)Cc1ccncc1 1458a_100000187943_100000705612 [0,2,0,0,0,0|1,0,1]=4 18130 B15R1.964 COC(=O)CCC(=O)Nc1ccccc1 11a_100000106764_100000187943 [0,2,0,0,0,0|1,0,1]=4 18131 B15R1.964 COC(=O)CCC(=O)Nc1ccccc1 1626a_100000106764_100000187943 [0,2,0,0,0,0|1,0,1]=4 18132 B15R1.964 COC(=O)CCC(=O)Nc1ccccc1 527a_100000106764_100000187943 [0,2,0,0,0,0|1,0,1]=4 18133 B15R1.964 COC(=O)CCN(C)Cc1ccccc1 2230a_100000177508_200000210301 [0,2,0,0,0,0|1,0,0]=3 18134 B15R1.964 COC(=O)CCN(C)Cc1ccccc1 2230a_100000186898_100000204255 [0,2,0,0,0,0|1,0,0]=3 18135 B15R1.964 COC(=O)CCN(C)Cc1ccccc1 269982a_100000177508_200000210301 [0,2,0,0,0,0|1,0,0]=3 18136 B15R1.964 COC(=O)CCN(C)Cc1ccccc1 269982a_100000186898_100000204255 [0,2,0,0,0,0|1,0,0]=3 18137 B15R1.964 COC(=O)CCN(C)Cc1ccccc1 269982a_100025711912_100000211182 [0,2,0,0,0,0|1,0,0]=3 18138 B15R1.964 COC(=O)CCN(C)Cc1ccccn1 2230a_100000207498_100000204255 [0,2,0,0,0,0|2,0,0]=4 18139 B15R1.964 COC(=O)CCN(C)Cc1ccccn1 269982a_100000207498_100000204255 [0,2,0,0,0,0|2,0,0]=4 18140 B15R1.964 COC(=O)CCN(C)Cc1ccccn1 269982a_100025711912_100000721315 [0,2,0,0,0,0|2,0,0]=4 18141 B15R1.964 COC(=O)CCN(C)Cc1cccnc1 2230a_100000184577_100000204255 [0,2,0,0,0,0|2,0,0]=4 18142 B15R1.964 COC(=O)CCN(C)Cc1cccnc1 269982a_100000184577_100000204255 [0,2,0,0,0,0|2,0,0]=4 18143 B15R1.964 COC(=O)CCN(C)Cc1cccnc1 269982a_100025711912_100000733263 [0,2,0,0,0,0|2,0,0]=4 18144 B15R1.964 COC(=O)CCN(C)Cc1ccncc1 2230a_100000187231_100000204255 [0,2,0,0,0,0|2,0,0]=4 18145 B15R1.964 COC(=O)CCN(C)Cc1ccncc1 269982a_100000187231_100000204255 [0,2,0,0,0,0|2,0,0]=4 18146 B15R1.964 COC(=O)CCN(C)Cc1ccncc1 269982a_100025711912_100015193705 [0,2,0,0,0,0|2,0,0]=4 18147 B15R1.964 COC(=O)CCN([13CH3])Cc1ccccc1 2230a_100000177508_200025704644 [0,2,0,0,0,0|1,0,0]=3 18148 B15R1.964 COC(=O)CCN([13CH3])Cc1ccccc1 269982a_100000177508_200025704644 [0,2,0,0,0,0|1,0,0]=3 18149 B15R1.964 COC(=O)CNC(C)Cc1ccccn1 2230a_100000238496_100000747449 [0,2,0,0,0,0|2,0,0]=4 18150 B15R1.964 COC(=O)CNC(C)Cc1cccnc1 2230a_100011207255_100000747449 [0,2,0,0,0,0|2,0,0]=4 18151 B15R1.964 COC(=O)COC(C)Cc1ccccc1 34a_100000748627_100000747449 [0,2,0,0,0,0|1,0,0]=3 18152 B15R1.964 COC(=O)COC(C)Cc1ccccc1 7a_100000748627_100000747449 [0,2,0,0,0,0|1,0,0]=3 18153 B15R1.964 COC(=O)CSC(C)Cc1ccccc1 62a_100000747449_200011218536 [0,2,0,0,0,0|1,0,0]=3 18154 B15R1.964 COC(=O)CSC(C)Cc1ccccc1 62a_200011218536_100000747449 [0,2,0,0,0,0|1,0,0]=3 18155 B15R1.964 COC(=O)NCC(=O)Cc1ccccc1 1458a_100000215747_100015291786 [0,2,0,0,0,0|1,0,1]=4 18156 B15R1.964 O=C(CO)CCC(=O)Nc1ccccc1 1458a_100000210174_100000242058 [0,2,0,0,0,0|1,0,1]=4 18157 B15R1.964 O=C(CO)CCC(=O)Oc1ccccc1 1458a_100000210174_200000035796 [0,2,0,0,0,0|1,0,1]=4 18158 B15R1.964 O=C(CO)NCC(O)Cc1ccccc1 240690a_100000752270_100000210174 [0,2,0,0,0,0|1,0,0]=3 18159 B15R1.964 O=C(CO)NCC(O)Cc1ccccc1 527a_100000752270_100000210174 [0,2,0,0,0,0|1,0,0]=3 18160 B15R1.3675 CC(=O)C(C)OC(C)Cc1ccccc1 34a_100000212229_200011218536 [0,2,0,0,0,0|2,0,0]=4 18161 B15R1.3675 CC(=O)C(C)OC(C)Cc1ccccc1 7a_100000748627_100000179758 [0,2,0,0,0,0|2,0,0]=4 18162 B15R1.3675 CC(=O)C(C)SC(C)Cc1ccccc1 62a_100009814033_200011218536 [0,2,0,0,0,0|2,0,0]=4 18163 B15R1.3675 CC(=O)C(C)SC(C)Cc1ccccc1 62a_200011218536_100009814033 [0,2,0,0,0,0|2,0,0]=4 18164 B15R1.3675 CC(Cc1ccccc1)N[C@@H](C)C(=O)O 269956a_100000743915_200011218536 [0,2,0,0,0,0|1,0,0]=3 18165 B15R1.3675 CC(Cc1ccccc1)N[C@H](C)C(=O)N 34a_100000119354_200011218536 [0,2,0,0,0,0|2,0,0]=4 18166 B15R1.3675 CC(Cc1ccccc1)OC(C)C(=O)N 34a_100000748627_100000702099 [0,2,0,0,0,0|2,0,0]=4 18167 B15R1.3675 CC(Cc1ccccc1)OC(C)C(=O)N 7a_100000748627_100000702099 [0,2,0,0,0,0|2,0,0]=4 18168 B15R1.3675 CC(Cc1ccccc1)OC(F)C(=O)N 34a_100000748627_100009813875 [0,2,0,0,0,0|2,0,0]=4 18169 B15R1.3675 CC(Cc1ccccc1)OC(F)C(=O)N 7a_100000748627_100009813875 [0,2,0,0,0,0|2,0,0]=4 18170 B15R1.3675 CC(Cc1ccccc1)OC(F)C(=O)[O-] 34a_100000748627_100020610796 [0,2,0,0,0,0|1,0,1]=4 18171 B15R1.3675 CC(Cc1ccccc1)O[C@@H](C)C(=O)[O-] 7a_217856618621_200011218536 [0,2,0,0,0,0|1,0,1]=4 18172 B15R1.3675 CC(Cc1ccccc1)O[C@H](C)C(=O)N 34a_100000731257_200011218536 [0,2,0,0,0,0|2,0,0]=4 18173 B15R1.3675 CC(Cc1ccccc1)O[C@H](C)C(=O)N 7a_100000731257_200011218536 [0,2,0,0,0,0|2,0,0]=4 18174 B15R1.3675 CC(Cc1ccccc1)SC(C)C(=O)N 62a_100000702099_200011218536 [0,2,0,0,0,0|2,0,0]=4 18175 B15R1.3675 CC(Cc1ccccc1)SC(C)C(=O)N 62a_200011218536_100000702099 [0,2,0,0,0,0|2,0,0]=4 18176 B15R1.3675 CC(Cc1ccccc1)SC(F)C(=O)N 62a_100009813875_200011218536 [0,2,0,0,0,0|2,0,0]=4 18177 B15R1.3675 CC(Cc1ccccc1)SC(F)C(=O)N 62a_200011218536_100009813875 [0,2,0,0,0,0|2,0,0]=4 18178 B15R1.3675 CC(Cc1ccccc1)SC(F)C(=O)[O-] 62a_100020610796_200011218536 [0,2,0,0,0,0|1,0,1]=4 18179 B15R1.3675 CC(Cc1ccccc1)SC(F)C(=O)[O-] 62a_200011218536_100020610796 [0,2,0,0,0,0|1,0,1]=4 18180 B15R1.4008 C#CC(Cc1ccccc1)OCC(=O)N 34a_100000685211_100000187820 [0,2,0,0,0,0|2,0,0]=4 18181 B15R1.4008 C#CC(Cc1ccccc1)OCC(=O)N 7a_100000685211_100000187820 [0,2,0,0,0,0|2,0,0]=4 18182 B15R1.4008 C#CC(Cc1ccccc1)OCC(=O)[O-] 34a_100000685211_100020667443 [0,2,0,0,0,0|1,0,1]=4 18183 B15R1.4008 CC(=O)NCC(CO)Cc1ccccc1 240690a_100160572655_100015343762 [0,2,0,0,0,0|2,0,0]=4 18184 B15R1.4008 CC(=O)NCC(CO)Cc1ccccc1 527a_100160572655_100103153847 [0,2,0,0,0,0|2,0,0]=4 18185 B15R1.4008 CCC(Cc1ccccc1)OCC(=O)N 7a_100000760156_100000187820 [0,2,0,0,0,0|2,0,0]=4 18186 B15R1.4008 CCN(CCC(=O)C)Cc1ccccc1 269982a_100000186914_100000053229 [0,2,0,0,0,0|2,0,0]=4 18187 B15R1.4008 CCN(CCC(=O)N)Cc1ccccc1 2230a_100000177509_100000210202 [0,2,0,0,0,0|2,0,0]=4 18188 B15R1.4008 CCN(CCC(=O)N)Cc1ccccc1 2230a_100000186914_100000744528 [0,2,0,0,0,0|2,0,0]=4 18189 B15R1.4008 CCN(CCC(=O)N)Cc1ccccc1 2230a_100020645749_100015291786 [0,2,0,0,0,0|2,0,0]=4 18190 B15R1.4008 CCN(CCC(=O)N)Cc1ccccc1 269982a_100000177509_100000204670 [0,2,0,0,0,0|2,0,0]=4 18191 B15R1.4008 CCN(CCC(=O)N)Cc1ccccc1 269982a_100000186914_100000744528 [0,2,0,0,0,0|2,0,0]=4 18192 B15R1.4008 CCN(CCC(=O)N)Cc1ccccc1 270004a_100020645749_100015611070 [0,2,0,0,0,0|2,0,0]=4 18193 B15R1.4008 N#CC(Cc1ccccc1)NCC(=O)N 2230a_100000746547_100000747473 [0,2,0,0,0,0|2,0,0]=4 18194 B15R1.4008 N#CC(Cc1ccccc1)NCC(=O)O 269956a_100016091260_100000183401 [0,2,0,0,0,0|1,0,0]=3 18195 B15R1.4008 N#CC(Cc1ccccc1)SCC(=O)N 62a_100000183401_100000747473 [0,2,0,0,0,0|2,0,0]=4 18196 B15R1.4008 N#CC(Cc1ccccc1)SCC(=O)N 62a_100000747473_100000183401 [0,2,0,0,0,0|2,0,0]=4 18197 B15R1.4008 N#CC(Cc1ccccc1)SCC(=O)[O-] 62a_100000183401_100020667443 [0,2,0,0,0,0|1,0,1]=4 18198 B15R1.4008 N#CC(Cc1ccccc1)SCC(=O)[O-] 62a_100020667443_100000183401 [0,2,0,0,0,0|1,0,1]=4 18199 B15R1.4008 NC(=O)CCN(CF)Cc1ccccc1 269982a_100000177509_100015361967 [0,2,0,0,0,0|2,0,0]=4 18200 B15R1.4008 NC(=O)CNC(CO)Cc1ccccc1 2230a_100000739027_100000747473 [0,2,0,0,0,0|2,0,0]=4 18201 B15R1.4008 NC(=O)CO[C@H](CCl)Cc1ccccc1 7a_100000729385_100000187820 [0,2,0,0,0,0|2,0,0]=4 18202 B15R1.4008 NCC(Cc1ccccc1)OCC(=O)N 34a_100000752270_100000187820 [0,2,0,0,0,0|2,0,0]=4 18203 B15R1.4008 NCC(Cc1ccccc1)OCC(=O)[O-] 34a_100000752270_100020667443 [0,2,0,0,0,0|1,0,1]=4 18204 B15R1.12243 CC(C)(Cc1ccccc1)OCC(=O)N 7a_100011215222_100000187820 [0,2,0,0,0,0|2,0,0]=4 18205 B15R1.12243 O=C(O)CNC(F)(F)Oc1ccccc1 269956a_100016091260_200000057402 [0,2,0,0,0,0|2,0,0]=4 18206 B15R1.4 C#Cc1ccc(cc1)CNCCC(=O)N 207a_100000740010_100011361452 [0,2,0,0,0,0|2,0,0]=4 18207 B15R1.4 C#Cc1ccc(cc1)CNCCC(=O)N 2230a_100015199678_100000744528 [0,2,0,0,0,0|2,0,0]=4 18208 B15R1.4 C#Cc1ccc(cc1)CNCCC(=O)N 34a_100015199678_100000731001 [0,2,0,0,0,0|2,0,0]=4 18209 B15R1.4 C#Cc1ccc(cc1)CNOCC(=O)O 269956a_100000106656_100000140223 [0,2,0,0,0,0|2,0,0]=4 18210 B15R1.4 C#Cc1ccc(cc1)COCCC(=O)C 34a_100000759926_100000140223 [0,2,0,0,0,0|2,0,0]=4 18211 B15R1.4 C#Cc1ccc(cc1)COCCC(=O)C 7a_100000054647_100000053229 [0,2,0,0,0,0|2,0,0]=4 18212 B15R1.4 C#Cc1ccc(cc1)COCCC(=O)C 7a_100000759926_100000140223 [0,2,0,0,0,0|2,0,0]=4 18213 B15R1.4 C#Cc1ccc(cc1)COCCC(=O)N 34a_100000054647_100000731001 [0,2,0,0,0,0|2,0,0]=4 18214 B15R1.4 C#Cc1ccc(cc1)COCCC(=O)N 34a_100000757172_100000140223 [0,2,0,0,0,0|2,0,0]=4 18215 B15R1.4 C#Cc1ccc(cc1)COCCC(=O)N 7a_100000054647_100000744528 [0,2,0,0,0,0|2,0,0]=4 18216 B15R1.4 C#Cc1ccc(cc1)COCCC(=O)N 7a_100000757172_100000140223 [0,2,0,0,0,0|2,0,0]=4 18217 B15R1.4 C#Cc1ccc(cc1)CSCCC(=O)C 62a_100000053229_100000140223 [0,2,0,0,0,0|2,0,0]=4 18218 B15R1.4 C#Cc1ccc(cc1)CSCCC(=O)N 62a_100000744528_100000140223 [0,2,0,0,0,0|2,0,0]=4 18219 B15R1.4 C#Cc1ccc(cc1)NCCCC(=O)C 34a_100011215031_100000685027 [0,2,0,0,0,0|2,0,0]=4 18220 B15R1.4 C#Cc1ccc(cc1)NCCCC(=O)N 34a_100011215031_100102525003 [0,2,0,0,0,0|2,0,0]=4 18221 B15R1.4 C=Cc1ccc(cc1)CCNCC(=O)N 2230a_100000711301_100000142037 [0,2,0,0,0,0|2,0,0]=4 18222 B15R1.4 C=Cc1ccc(cc1)CCNCC(=O)O 269956a_100016091260_100000142037 [0,2,0,0,0,0|1,0,0]=3 18223 B15R1.4 C=Cc1ccc(cc1)CCOCC(=O)C 34a_100000211253_100000142037 [0,2,0,0,0,0|2,0,0]=4 18224 B15R1.4 C=Cc1ccc(cc1)CCSCC(=O)N 62a_100000142037_100000747473 [0,2,0,0,0,0|2,0,0]=4 18225 B15R1.4 C=Cc1ccc(cc1)CCSCC(=O)N 62a_100000747473_100000142037 [0,2,0,0,0,0|2,0,0]=4 18226 B15R1.4 C=Cc1ccc(cc1)CCSCC(=O)[O-] 62a_100000142037_100020667443 [0,2,0,0,0,0|1,0,1]=4 18227 B15R1.4 C=Cc1ccc(cc1)CCSCC(=O)[O-] 62a_100020667443_100000142037 [0,2,0,0,0,0|1,0,1]=4 18228 B15R1.4 C=Cc1ccc(cc1)CNCCC(=O)N 34a_200011934891_100000731001 [0,2,0,0,0,0|2,0,0]=4 18229 B15R1.4 C=Cc1ccc(cc1)CNOCC(=O)O 269956a_100000106656_100000034074 [0,2,0,0,0,0|2,0,0]=4 18230 B15R1.4 C=Cc1ccc(cc1)COCCC(=O)C 34a_100000759926_100000034074 [0,2,0,0,0,0|2,0,0]=4 18231 B15R1.4 C=Cc1ccc(cc1)COCCC(=O)C 7a_100000073583_100000053229 [0,2,0,0,0,0|2,0,0]=4 18232 B15R1.4 C=Cc1ccc(cc1)COCCC(=O)C 7a_100000759926_100000034074 [0,2,0,0,0,0|2,0,0]=4 18233 B15R1.4 C=Cc1ccc(cc1)COCCC(=O)N 34a_100000073583_100000731001 [0,2,0,0,0,0|2,0,0]=4 18234 B15R1.4 C=Cc1ccc(cc1)COCCC(=O)N 34a_100000757172_100000034074 [0,2,0,0,0,0|2,0,0]=4 18235 B15R1.4 C=Cc1ccc(cc1)COCCC(=O)N 7a_100000073583_100000744528 [0,2,0,0,0,0|2,0,0]=4 18236 B15R1.4 C=Cc1ccc(cc1)COCCC(=O)N 7a_100000757172_100000034074 [0,2,0,0,0,0|2,0,0]=4 18237 B15R1.4 C=Cc1ccc(cc1)CSCCC(=O)C 62a_100000034074_100000053229 [0,2,0,0,0,0|2,0,0]=4 18238 B15R1.4 C=Cc1ccc(cc1)CSCCC(=O)C 62a_100000053229_100000034074 [0,2,0,0,0,0|2,0,0]=4 18239 B15R1.4 C=Cc1ccc(cc1)CSCCC(=O)N 62a_100000034074_100000744528 [0,2,0,0,0,0|2,0,0]=4 18240 B15R1.4 C=Cc1ccc(cc1)CSCCC(=O)N 62a_100000744528_100000034074 [0,2,0,0,0,0|2,0,0]=4 18241 B15R1.4 C=Cc1ccc(cc1)NCCCC(=O)C 34a_100011218248_100000685027 [0,2,0,0,0,0|2,0,0]=4 18242 B15R1.4 C=Cc1ccc(cc1)NCCCC(=O)N 34a_100011218248_100102525003 [0,2,0,0,0,0|2,0,0]=4 18243 B15R1.4 C=Cc1ccc(cc1)OCCCC(=O)C 34a_100000189437_100000685027 [0,2,0,0,0,0|2,0,0]=4 18244 B15R1.4 C=Cc1ccc(cc1)OCCCC(=O)C 7a_100000189437_100011215641 [0,2,0,0,0,0|2,0,0]=4 18245 B15R1.4 C=Cc1ccc(cc1)OCCCC(=O)N 34a_100000189437_100102525003 [0,2,0,0,0,0|2,0,0]=4 18246 B15R1.4 C=Cc1ccc(cc1)OCCCC(=O)N 7a_100000189437_100102525003 [0,2,0,0,0,0|2,0,0]=4 18247 B15R1.4 C=Cc1ccc(cc1)SCCCC(=O)C 62a_100000748128_100011215641 [0,2,0,0,0,0|2,0,0]=4 18248 B15R1.4 C=Cc1ccc(cc1)SCCCC(=O)C 62a_100011215641_100000748128 [0,2,0,0,0,0|2,0,0]=4 18249 B15R1.4 C=Cc1ccc(cc1)SCCCC(=O)N 62a_100000748128_100102525003 [0,2,0,0,0,0|2,0,0]=4 18250 B15R1.4 C=Cc1ccc(cc1)SCCCC(=O)N 62a_100102525003_100000748128 [0,2,0,0,0,0|2,0,0]=4 18251 B15R1.4 CC(=O)CCCNc1ccc(cc1)C#N 34a_100000185469_100000685027 [0,2,0,0,0,0|2,0,0]=4 18252 B15R1.4 CC(=O)CCCNc1ccc(cc1)CO 34a_100011215238_100000685027 [0,2,0,0,0,0|2,0,0]=4 18253 B15R1.4 CC(=O)CCCOc1ccc(cc1)C#N 1458a_100000070787_200000738573 [0,2,0,0,0,0|2,0,0]=4 18254 B15R1.4 CC(=O)CCCOc1ccc(cc1)C#N 34a_100000210344_100000685027 [0,2,0,0,0,0|2,0,0]=4 18255 B15R1.4 CC(=O)CCCOc1ccc(cc1)C#N 7a_100000210344_100011215641 [0,2,0,0,0,0|2,0,0]=4 18256 B15R1.4 CC(=O)CCCOc1ccc(cc1)CN 34a_100000185549_100000685027 [0,2,0,0,0,0|2,0,0]=4 18257 B15R1.4 CC(=O)CCCOc1ccc(cc1)CO 34a_100000211755_100000685027 [0,2,0,0,0,0|2,0,0]=4 18258 B15R1.4 CC(=O)CCCSc1ccc(cc1)C#N 62a_100011215641_100000184291 [0,2,0,0,0,0|2,0,0]=4 18259 B15R1.4 CC(=O)CCCSc1ccc(cc1)C=O 62a_100000188517_100011215641 [0,2,0,0,0,0|2,0,0]=4 18260 B15R1.4 CC(=O)CCCSc1ccc(cc1)C=O 62a_100011215641_100000188517 [0,2,0,0,0,0|2,0,0]=4 18261 B15R1.4 CC(=O)CCCSc1ccc(cc1)CF 62a_100010268989_100011215641 [0,2,0,0,0,0|2,0,0]=4 18262 B15R1.4 CC(=O)CCCSc1ccc(cc1)CF 62a_100011215641_100010268989 [0,2,0,0,0,0|2,0,0]=4 18263 B15R1.4 CC(=O)CCCSc1ccc(cc1)CN 62a_100011215641_100016989417 [0,2,0,0,0,0|2,0,0]=4 18264 B15R1.4 CC(=O)CCCSc1ccc(cc1)CN 62a_100016989417_100011215641 [0,2,0,0,0,0|2,0,0]=4 18265 B15R1.4 CC(=O)CCCSc1ccc(cc1)CO 62a_100000690907_100011215641 [0,2,0,0,0,0|2,0,0]=4 18266 B15R1.4 CC(=O)CCCSc1ccc(cc1)CO 62a_100011215641_100000690907 [0,2,0,0,0,0|2,0,0]=4 18267 B15R1.4 CC(=O)CCCSc1ccc(cc1)NN 62a_100011215641_100016988836 [0,2,0,0,0,0|2,0,0]=4 18268 B15R1.4 CC(=O)CCCSc1ccc(cc1)NN 62a_100016988836_100011215641 [0,2,0,0,0,0|2,0,0]=4 18269 B15R1.4 CC(=O)CCOCc1ccc(cc1)C#N 34a_100000759926_100000184898 [0,2,0,0,0,0|2,0,0]=4 18270 B15R1.4 CC(=O)CCOCc1ccc(cc1)C#N 7a_100000238739_100000053229 [0,2,0,0,0,0|2,0,0]=4 18271 B15R1.4 CC(=O)CCOCc1ccc(cc1)C#N 7a_100000759926_100000184898 [0,2,0,0,0,0|2,0,0]=4 18272 B15R1.4 CC(=O)CCOCc1ccc(cc1)C=O 34a_100000759926_100009816848 [0,2,0,0,0,0|2,0,0]=4 18273 B15R1.4 CC(=O)CCOCc1ccc(cc1)C=O 7a_100000759926_100009816848 [0,2,0,0,0,0|2,0,0]=4 18274 B15R1.4 CC(=O)CCOCc1ccc(cc1)CBr 7a_100012353999_100000053229 [0,2,0,0,0,0|2,0,0]=4 18275 B15R1.4 CC(=O)CCOCc1ccc(cc1)CCl 7a_100000067286_100000053229 [0,2,0,0,0,0|2,0,0]=4 18276 B15R1.4 CC(=O)CCOCc1ccc(cc1)CO 34a_100000759926_100000067286 [0,2,0,0,0,0|2,0,0]=4 18277 B15R1.4 CC(=O)CCOCc1ccc(cc1)CO 7a_100000759926_100000067286 [0,2,0,0,0,0|2,0,0]=4 18278 B15R1.4 CC(=O)CCSCc1ccc(cc1)C#N 62a_100000053229_100000184898 [0,2,0,0,0,0|2,0,0]=4 18279 B15R1.4 CC(=O)CCSCc1ccc(cc1)C=O 62a_100000053229_100009816848 [0,2,0,0,0,0|2,0,0]=4 18280 B15R1.4 CC(=O)CCSCc1ccc(cc1)C=O 62a_100009816848_100000053229 [0,2,0,0,0,0|2,0,0]=4 18281 B15R1.4 CC(=O)CCSCc1ccc(cc1)CO 62a_100000053229_100000067286 [0,2,0,0,0,0|2,0,0]=4 18282 B15R1.4 CC(=O)CCSCc1ccc(cc1)CO 62a_100000067286_100000053229 [0,2,0,0,0,0|2,0,0]=4 18283 B15R1.4 CC(=O)COCCc1ccc(cc1)C#N 34a_100000211253_100012161189 [0,2,0,0,0,0|2,0,0]=4 18284 B15R1.4 CCc1ccc(cc1)CCNCC(=O)N 2230a_100025712186_100000747473 [0,2,0,0,0,0|2,0,0]=4 18285 B15R1.4 CCc1ccc(cc1)CCNCC(=O)N 34a_100025712186_100000187820 [0,2,0,0,0,0|2,0,0]=4 18286 B15R1.4 CCc1ccc(cc1)CCNCC(=O)[O-] 34a_100025712186_100020667443 [0,2,0,0,0,0|1,0,1]=4 18287 B15R1.4 CCc1ccc(cc1)CNCCC(=O)N 207a_100000740010_100000211036 [0,2,0,0,0,0|2,0,0]=4 18288 B15R1.4 CCc1ccc(cc1)CNCCC(=O)N 2230a_100000721222_100000744528 [0,2,0,0,0,0|2,0,0]=4 18289 B15R1.4 CCc1ccc(cc1)CNCCC(=O)N 34a_100000721222_100000731001 [0,2,0,0,0,0|2,0,0]=4 18290 B15R1.4 CCc1ccc(cc1)CNOCC(=O)O 269956a_100000106656_100000757233 [0,2,0,0,0,0|2,0,0]=4 18291 B15R1.4 CCc1ccc(cc1)COCCC(=O)C 34a_100000759926_100000747183 [0,2,0,0,0,0|2,0,0]=4 18292 B15R1.4 CCc1ccc(cc1)COCCC(=O)C 7a_100000702245_100000053229 [0,2,0,0,0,0|2,0,0]=4 18293 B15R1.4 CCc1ccc(cc1)COCCC(=O)C 7a_100000759926_100000747183 [0,2,0,0,0,0|2,0,0]=4 18294 B15R1.4 CCc1ccc(cc1)COCCC(=O)N 34a_100000702245_100000731001 [0,2,0,0,0,0|2,0,0]=4 18295 B15R1.4 CCc1ccc(cc1)COCCC(=O)N 34a_100000757172_100000747183 [0,2,0,0,0,0|2,0,0]=4 18296 B15R1.4 CCc1ccc(cc1)COCCC(=O)N 7a_100000702245_100000744528 [0,2,0,0,0,0|2,0,0]=4 18297 B15R1.4 CCc1ccc(cc1)COCCC(=O)N 7a_100000757172_100000747183 [0,2,0,0,0,0|2,0,0]=4 18298 B15R1.4 CCc1ccc(cc1)CSCCC(=O)C 62a_100000053229_100000747183 [0,2,0,0,0,0|2,0,0]=4 18299 B15R1.4 CCc1ccc(cc1)CSCCC(=O)C 62a_100000757233_100000053229 [0,2,0,0,0,0|2,0,0]=4 18300 B15R1.4 CCc1ccc(cc1)CSCCC(=O)N 62a_100000744528_100000747183 [0,2,0,0,0,0|2,0,0]=4 18301 B15R1.4 CCc1ccc(cc1)CSCCC(=O)N 62a_100000757233_100000744528 [0,2,0,0,0,0|2,0,0]=4 18302 B15R1.4 CCc1ccc(cc1)NCCCC(=O)C 34a_100000211069_100000685027 [0,2,0,0,0,0|2,0,0]=4 18303 B15R1.4 CCc1ccc(cc1)NCCCC(=O)N 34a_100000211069_100102525003 [0,2,0,0,0,0|2,0,0]=4 18304 B15R1.4 CCc1ccc(cc1)OCCCC(=O)C 34a_100000211359_100000685027 [0,2,0,0,0,0|2,0,0]=4 18305 B15R1.4 CCc1ccc(cc1)OCCCC(=O)C 7a_100000211359_100011215641 [0,2,0,0,0,0|2,0,0]=4 18306 B15R1.4 CCc1ccc(cc1)OCCCC(=O)N 34a_100000211359_100102525003 [0,2,0,0,0,0|2,0,0]=4 18307 B15R1.4 CCc1ccc(cc1)OCCCC(=O)N 7a_100000211359_100102525003 [0,2,0,0,0,0|2,0,0]=4 18308 B15R1.4 CCc1ccc(cc1)SCCCC(=O)C 62a_100011215641_100011215824 [0,2,0,0,0,0|2,0,0]=4 18309 B15R1.4 CCc1ccc(cc1)SCCCC(=O)C 62a_100011215824_100011215641 [0,2,0,0,0,0|2,0,0]=4 18310 B15R1.4 CCc1ccc(cc1)SCCCC(=O)N 62a_100011215824_100102525003 [0,2,0,0,0,0|2,0,0]=4 18311 B15R1.4 CCc1ccc(cc1)SCCCC(=O)N 62a_100102525003_100011215824 [0,2,0,0,0,0|2,0,0]=4 18312 B15R1.4 CNc1ccc(cc1)OCCCC(=O)C 34a_100000182112_100000685027 [0,2,0,0,0,0|2,0,0]=4 18313 B15R1.4 CNc1ccc(cc1)OCCCC(=O)N 34a_100000182112_100102525003 [0,2,0,0,0,0|2,0,0]=4 18314 B15R1.4 CNc1ccc(cc1)SCCCC(=O)C 62a_100000743151_100011215641 [0,2,0,0,0,0|2,0,0]=4 18315 B15R1.4 CNc1ccc(cc1)SCCCC(=O)C 62a_100011215641_100000743151 [0,2,0,0,0,0|2,0,0]=4 18316 B15R1.4 CNc1ccc(cc1)SCCCC(=O)N 62a_100000743151_100102525003 [0,2,0,0,0,0|2,0,0]=4 18317 B15R1.4 CNc1ccc(cc1)SCCCC(=O)N 62a_100102525003_100000743151 [0,2,0,0,0,0|2,0,0]=4 18318 B15R1.4 COc1ccc(cc1)CCCCC(=O)C 1458a_100000070787_100012285823 [0,2,0,0,0,0|1,0,0]=3 18319 B15R1.4 COc1ccc(cc1)CCCCC(=O)C 1458a_100000744869_200000210301 [0,2,0,0,0,0|1,0,0]=3 18320 B15R1.4 COc1ccc(cc1)CCCCC(=O)[13CH3] 1458a_100000744869_200025704644 [0,2,0,0,0,0|1,0,0]=3 18321 B15R1.4 COc1ccc(cc1)CCCNC(=O)C 11a_100015185942_100015343762 [0,2,0,0,0,0|2,0,0]=4 18322 B15R1.4 COc1ccc(cc1)CCCNC(=O)C 1626a_100015185942_100015343762 [0,2,0,0,0,0|2,0,0]=4 18323 B15R1.4 COc1ccc(cc1)CCCNC(=O)C 240690a_100015185942_100015343762 [0,2,0,0,0,0|2,0,0]=4 18324 B15R1.4 COc1ccc(cc1)CCCNC(=O)C 527a_100015185942_100103153847 [0,2,0,0,0,0|2,0,0]=4 18325 B15R1.4 COc1ccc(cc1)CCNCC(=O)N 2230a_100000210796_100000747473 [0,2,0,0,0,0|2,0,0]=4 18326 B15R1.4 COc1ccc(cc1)CCNCC(=O)N 2230a_100000711301_100011713689 [0,2,0,0,0,0|2,0,0]=4 18327 B15R1.4 COc1ccc(cc1)CCNCC(=O)N 34a_100000210796_100000187820 [0,2,0,0,0,0|2,0,0]=4 18328 B15R1.4 COc1ccc(cc1)CCNCC(=O)O 269956a_100016091260_100000184700 [0,2,0,0,0,0|1,0,0]=3 18329 B15R1.4 COc1ccc(cc1)CCNCC(=O)[O-] 34a_100000210796_100020667443 [0,2,0,0,0,0|1,0,1]=4 18330 B15R1.4 COc1ccc(cc1)CCOCC(=O)C 34a_100000211253_100000184700 [0,2,0,0,0,0|2,0,0]=4 18331 B15R1.4 COc1ccc(cc1)CCOCC(=O)N 34a_100011219623_100000187820 [0,2,0,0,0,0|2,0,0]=4 18332 B15R1.4 COc1ccc(cc1)CCOCC(=O)N 7a_100011219623_100000187820 [0,2,0,0,0,0|2,0,0]=4 18333 B15R1.4 COc1ccc(cc1)CCOCC(=O)[O-] 34a_100011219623_100020667443 [0,2,0,0,0,0|1,0,1]=4 18334 B15R1.4 COc1ccc(cc1)CCSCC(=O)N 62a_100000747473_100011713689 [0,2,0,0,0,0|2,0,0]=4 18335 B15R1.4 COc1ccc(cc1)CCSCC(=O)N 62a_100011713689_100000747473 [0,2,0,0,0,0|2,0,0]=4 18336 B15R1.4 COc1ccc(cc1)CCSCC(=O)[O-] 62a_100011713689_100020667443 [0,2,0,0,0,0|1,0,1]=4 18337 B15R1.4 COc1ccc(cc1)CCSCC(=O)[O-] 62a_100020667443_100011713689 [0,2,0,0,0,0|1,0,1]=4 18338 B15R1.4 COc1ccc(cc1)CNCCC(=O)N 207a_100000740010_100000169835 [0,2,0,0,0,0|2,0,0]=4 18339 B15R1.4 COc1ccc(cc1)CNCCC(=O)N 34a_100000185587_100000731001 [0,2,0,0,0,0|2,0,0]=4 18340 B15R1.4 COc1ccc(cc1)CNOCC(=O)O 269956a_100000106656_100000742318 [0,2,0,0,0,0|2,0,0]=4 18341 B15R1.4 COc1ccc(cc1)COCCC(=O)C 34a_100000759926_100000742318 [0,2,0,0,0,0|2,0,0]=4 18342 B15R1.4 COc1ccc(cc1)COCCC(=O)C 7a_100000759926_100000742318 [0,2,0,0,0,0|2,0,0]=4 18343 B15R1.4 COc1ccc(cc1)COCCC(=O)N 34a_100000173359_100000731001 [0,2,0,0,0,0|2,0,0]=4 18344 B15R1.4 COc1ccc(cc1)COCCC(=O)N 34a_100000757172_100000742318 [0,2,0,0,0,0|2,0,0]=4 18345 B15R1.4 COc1ccc(cc1)COCCC(=O)N 7a_100000757172_100000742318 [0,2,0,0,0,0|2,0,0]=4 18346 B15R1.4 COc1ccc(cc1)CSCCC(=O)C 62a_100000053229_100000742318 [0,2,0,0,0,0|2,0,0]=4 18347 B15R1.4 COc1ccc(cc1)CSCCC(=O)N 62a_100000744528_100000742318 [0,2,0,0,0,0|2,0,0]=4 18348 B15R1.4 COc1ccc(cc1)NCCCC(=O)C 34a_100000184247_100000685027 [0,2,0,0,0,0|2,0,0]=4 18349 B15R1.4 COc1ccc(cc1)NCCCC(=O)N 34a_100000184247_100102525003 [0,2,0,0,0,0|2,0,0]=4 18350 B15R1.4 COc1ccc(cc1)OCCCC(=O)C 1458a_100000070787_100000212274 [0,2,0,0,0,0|2,0,0]=4 18351 B15R1.4 COc1ccc(cc1)OCCCC(=O)C 34a_100000210503_100000685027 [0,2,0,0,0,0|2,0,0]=4 18352 B15R1.4 COc1ccc(cc1)OCCCC(=O)N 34a_100000210503_100102525003 [0,2,0,0,0,0|2,0,0]=4 18353 B15R1.4 COc1ccc(cc1)SCCCC(=O)C 62a_100011215641_100000171711 [0,2,0,0,0,0|2,0,0]=4 18354 B15R1.4 COc1ccc(cc1)SCCCC(=O)N 62a_100102525003_100000171711 [0,2,0,0,0,0|2,0,0]=4 18355 B15R1.4 CSc1ccc(cc1)CNCCC(=O)N 207a_100000740010_100000211154 [0,2,0,0,0,0|2,0,0]=4 18356 B15R1.4 CSc1ccc(cc1)CNCCC(=O)N 2230a_100000174980_100000744528 [0,2,0,0,0,0|2,0,0]=4 18357 B15R1.4 CSc1ccc(cc1)CNCCC(=O)N 34a_100000174980_100000731001 [0,2,0,0,0,0|2,0,0]=4 18358 B15R1.4 CSc1ccc(cc1)CNOCC(=O)O 269956a_100000106656_100000181263 [0,2,0,0,0,0|2,0,0]=4 18359 B15R1.4 CSc1ccc(cc1)COCCC(=O)C 34a_100000759926_100000181263 [0,2,0,0,0,0|2,0,0]=4 18360 B15R1.4 CSc1ccc(cc1)COCCC(=O)C 7a_100000759926_100000181263 [0,2,0,0,0,0|2,0,0]=4 18361 B15R1.4 CSc1ccc(cc1)COCCC(=O)C 7a_100011215404_100000053229 [0,2,0,0,0,0|2,0,0]=4 18362 B15R1.4 CSc1ccc(cc1)COCCC(=O)N 34a_100000757172_100000181263 [0,2,0,0,0,0|2,0,0]=4 18363 B15R1.4 CSc1ccc(cc1)COCCC(=O)N 34a_100011215404_100000731001 [0,2,0,0,0,0|2,0,0]=4 18364 B15R1.4 CSc1ccc(cc1)COCCC(=O)N 7a_100000757172_100000181263 [0,2,0,0,0,0|2,0,0]=4 18365 B15R1.4 CSc1ccc(cc1)COCCC(=O)N 7a_100011215404_100000744528 [0,2,0,0,0,0|2,0,0]=4 18366 B15R1.4 CSc1ccc(cc1)CSCCC(=O)C 62a_100000053229_100000181263 [0,2,0,0,0,0|2,0,0]=4 18367 B15R1.4 CSc1ccc(cc1)CSCCC(=O)C 62a_100000181263_100000053229 [0,2,0,0,0,0|2,0,0]=4 18368 B15R1.4 CSc1ccc(cc1)CSCCC(=O)N 62a_100000181263_100000744528 [0,2,0,0,0,0|2,0,0]=4 18369 B15R1.4 CSc1ccc(cc1)CSCCC(=O)N 62a_100000744528_100000181263 [0,2,0,0,0,0|2,0,0]=4 18370 B15R1.4 CSc1ccc(cc1)NCCCC(=O)C 34a_100000212337_100000685027 [0,2,0,0,0,0|2,0,0]=4 18371 B15R1.4 CSc1ccc(cc1)NCCCC(=O)N 34a_100000212337_100102525003 [0,2,0,0,0,0|2,0,0]=4 18372 B15R1.4 CSc1ccc(cc1)OCCCC(=O)C 34a_100000211864_100000685027 [0,2,0,0,0,0|2,0,0]=4 18373 B15R1.4 CSc1ccc(cc1)OCCCC(=O)N 34a_100000211864_100102525003 [0,2,0,0,0,0|2,0,0]=4 18374 B15R1.4 CSc1ccc(cc1)SCCCC(=O)C 62a_100011215641_100011263217 [0,2,0,0,0,0|2,0,0]=4 18375 B15R1.4 CSc1ccc(cc1)SCCCC(=O)C 62a_100011263217_100011215641 [0,2,0,0,0,0|2,0,0]=4 18376 B15R1.4 CSc1ccc(cc1)SCCCC(=O)N 62a_100011263217_100102525003 [0,2,0,0,0,0|2,0,0]=4 18377 B15R1.4 CSc1ccc(cc1)SCCCC(=O)N 62a_100102525003_100011263217 [0,2,0,0,0,0|2,0,0]=4 18378 B15R1.4 N#Cc1ccc(cc1)CCNCC(=O)N 2230a_100000711301_100012161189 [0,2,0,0,0,0|2,0,0]=4 18379 B15R1.4 N#Cc1ccc(cc1)CCNCC(=O)N 2230a_100015189369_100000747473 [0,2,0,0,0,0|2,0,0]=4 18380 B15R1.4 N#Cc1ccc(cc1)CCNCC(=O)N 34a_100015189369_100000187820 [0,2,0,0,0,0|2,0,0]=4 18381 B15R1.4 N#Cc1ccc(cc1)CCNCC(=O)O 269956a_100016091260_100012161189 [0,2,0,0,0,0|1,0,0]=3 18382 B15R1.4 N#Cc1ccc(cc1)CCNCC(=O)[O-] 34a_100015189369_100020667443 [0,2,0,0,0,0|1,0,1]=4 18383 B15R1.4 N#Cc1ccc(cc1)CCOCC(=O)N 34a_100011219507_100000187820 [0,2,0,0,0,0|2,0,0]=4 18384 B15R1.4 N#Cc1ccc(cc1)CCOCC(=O)N 7a_100011219507_100000187820 [0,2,0,0,0,0|2,0,0]=4 18385 B15R1.4 N#Cc1ccc(cc1)CCOCC(=O)[O-] 34a_100011219507_100020667443 [0,2,0,0,0,0|1,0,1]=4 18386 B15R1.4 N#Cc1ccc(cc1)CCSCC(=O)N 62a_100000747473_100012161189 [0,2,0,0,0,0|2,0,0]=4 18387 B15R1.4 N#Cc1ccc(cc1)CCSCC(=O)[O-] 62a_100020667443_100012161189 [0,2,0,0,0,0|1,0,1]=4 18388 B15R1.4 N#Cc1ccc(cc1)CNCCC(=O)N 207a_100000740010_100000211122 [0,2,0,0,0,0|2,0,0]=4 18389 B15R1.4 N#Cc1ccc(cc1)CNCCC(=O)N 34a_100015207190_100000731001 [0,2,0,0,0,0|2,0,0]=4 18390 B15R1.4 N#Cc1ccc(cc1)CNOCC(=O)O 269956a_100000106656_100000184898 [0,2,0,0,0,0|2,0,0]=4 18391 B15R1.4 N#Cc1ccc(cc1)COCCC(=O)N 34a_100000238739_100000731001 [0,2,0,0,0,0|2,0,0]=4 18392 B15R1.4 N#Cc1ccc(cc1)COCCC(=O)N 34a_100000757172_100000184898 [0,2,0,0,0,0|2,0,0]=4 18393 B15R1.4 N#Cc1ccc(cc1)COCCC(=O)N 7a_100000238739_100000744528 [0,2,0,0,0,0|2,0,0]=4 18394 B15R1.4 N#Cc1ccc(cc1)COCCC(=O)N 7a_100000757172_100000184898 [0,2,0,0,0,0|2,0,0]=4 18395 B15R1.4 N#Cc1ccc(cc1)CSCCC(=O)N 62a_100000744528_100000184898 [0,2,0,0,0,0|2,0,0]=4 18396 B15R1.4 N#Cc1ccc(cc1)NCCCC(=O)N 34a_100000185469_100102525003 [0,2,0,0,0,0|2,0,0]=4 18397 B15R1.4 N#Cc1ccc(cc1)OCCCC(=O)N 34a_100000210344_100102525003 [0,2,0,0,0,0|2,0,0]=4 18398 B15R1.4 N#Cc1ccc(cc1)OCCCC(=O)N 7a_100000210344_100102525003 [0,2,0,0,0,0|2,0,0]=4 18399 B15R1.4 N#Cc1ccc(cc1)SCCCC(=O)N 62a_100102525003_100000184291 [0,2,0,0,0,0|2,0,0]=4 18400 B15R1.4 NC(=O)CCCNc1ccc(cc1)CO 34a_100011215238_100102525003 [0,2,0,0,0,0|2,0,0]=4 18401 B15R1.4 NC(=O)CCCOc1ccc(cc1)CO 34a_100000211755_100102525003 [0,2,0,0,0,0|2,0,0]=4 18402 B15R1.4 NC(=O)CCCSc1ccc(cc1)C=O 62a_100000188517_100102525003 [0,2,0,0,0,0|2,0,0]=4 18403 B15R1.4 NC(=O)CCCSc1ccc(cc1)C=O 62a_100102525003_100000188517 [0,2,0,0,0,0|2,0,0]=4 18404 B15R1.4 NC(=O)CCCSc1ccc(cc1)CF 62a_100010268989_100102525003 [0,2,0,0,0,0|2,0,0]=4 18405 B15R1.4 NC(=O)CCCSc1ccc(cc1)CF 62a_100102525003_100010268989 [0,2,0,0,0,0|2,0,0]=4 18406 B15R1.4 NC(=O)CCCSc1ccc(cc1)CO 62a_100000690907_100102525003 [0,2,0,0,0,0|2,0,0]=4 18407 B15R1.4 NC(=O)CCCSc1ccc(cc1)CO 62a_100102525003_100000690907 [0,2,0,0,0,0|2,0,0]=4 18408 B15R1.4 NC(=O)CCNCc1ccc(cc1)CO 207a_100000740010_100009832023 [0,2,0,0,0,0|2,0,0]=4 18409 B15R1.4 NC(=O)CCNCc1ccc(cc1)CO 2230a_100015189231_100000744528 [0,2,0,0,0,0|2,0,0]=4 18410 B15R1.4 NC(=O)CCNCc1ccc(cc1)CO 34a_100015189231_100000731001 [0,2,0,0,0,0|2,0,0]=4 18411 B15R1.4 NC(=O)CCOCc1ccc(cc1)C=O 34a_100000757172_100009816848 [0,2,0,0,0,0|2,0,0]=4 18412 B15R1.4 NC(=O)CCOCc1ccc(cc1)C=O 7a_100000757172_100009816848 [0,2,0,0,0,0|2,0,0]=4 18413 B15R1.4 NC(=O)CCOCc1ccc(cc1)CBr 34a_100012353999_100000731001 [0,2,0,0,0,0|2,0,0]=4 18414 B15R1.4 NC(=O)CCOCc1ccc(cc1)CBr 7a_100012353999_100000744528 [0,2,0,0,0,0|2,0,0]=4 18415 B15R1.4 NC(=O)CCOCc1ccc(cc1)CCl 34a_100000067286_100000731001 [0,2,0,0,0,0|2,0,0]=4 18416 B15R1.4 NC(=O)CCOCc1ccc(cc1)CCl 7a_100000067286_100000744528 [0,2,0,0,0,0|2,0,0]=4 18417 B15R1.4 NC(=O)CCOCc1ccc(cc1)CO 34a_100000757172_100000067286 [0,2,0,0,0,0|2,0,0]=4 18418 B15R1.4 NC(=O)CCOCc1ccc(cc1)CO 7a_100000757172_100000067286 [0,2,0,0,0,0|2,0,0]=4 18419 B15R1.4 NC(=O)CCSCc1ccc(cc1)C=O 62a_100000744528_100009816848 [0,2,0,0,0,0|2,0,0]=4 18420 B15R1.4 NC(=O)CCSCc1ccc(cc1)C=O 62a_100009816848_100000744528 [0,2,0,0,0,0|2,0,0]=4 18421 B15R1.4 NC(=O)CCSCc1ccc(cc1)CO 62a_100000067286_100000744528 [0,2,0,0,0,0|2,0,0]=4 18422 B15R1.4 NC(=O)CCSCc1ccc(cc1)CO 62a_100000744528_100000067286 [0,2,0,0,0,0|2,0,0]=4 18423 B15R1.4 NCc1ccc(cc1)COCCC(=O)N 34a_100015189231_100000731001 [0,2,0,0,0,0|2,0,0]=4 18424 B15R1.4 NCc1ccc(cc1)OCCCC(=O)N 34a_100000185549_100102525003 [0,2,0,0,0,0|2,0,0]=4 18425 B15R1.4 NCc1ccc(cc1)SCCCC(=O)N 62a_100016989417_100102525003 [0,2,0,0,0,0|2,0,0]=4 18426 B15R1.4 NCc1ccc(cc1)SCCCC(=O)N 62a_100102525003_100016989417 [0,2,0,0,0,0|2,0,0]=4 18427 B15R1.4 NNc1ccc(cc1)SCCCC(=O)N 62a_100016988836_100102525003 [0,2,0,0,0,0|2,0,0]=4 18428 B15R1.4 NNc1ccc(cc1)SCCCC(=O)N 62a_100102525003_100016988836 [0,2,0,0,0,0|2,0,0]=4 18429 B15R1.4 O=C(O)CONCc1ccc(cc1)CO 269956a_100000106656_100000067286 [0,2,0,0,0,0|2,0,0]=4 18430 B15R1.4 O=Cc1ccc(cc1)CNOCC(=O)O 269956a_100000106656_100009816848 [0,2,0,0,0,0|2,0,0]=4 18431 B15R1.26 C#CC(=O)CCCCc1ccc(cc1)Br 1458a_100000211873_200012094861 [0,2,0,0,0,0|1,0,0]=3 18432 B15R1.26 C#CC(=O)CCCCc1ccc(cc1)F 1458a_100000211873_100012093538 [0,2,0,0,0,0|1,0,0]=3 18433 B15R1.26 C#CC(=O)CCCOc1ccc(cc1)Br 1458a_100000211873_100011259224 [0,2,0,0,0,0|2,0,0]=4 18434 B15R1.26 C#CC(=O)CCCOc1ccc(cc1)F 1458a_100000211873_100000181347 [0,2,0,0,0,0|2,0,0]=4 18435 B15R1.26 C=CC(=O)CCCCc1ccc(cc1)Br 1458a_100000185746_200012094861 [0,2,0,0,0,0|1,0,0]=3 18436 B15R1.26 C=CC(=O)CCCCc1ccc(cc1)F 1458a_100000185746_100012093538 [0,2,0,0,0,0|1,0,0]=3 18437 B15R1.26 C=CC(=O)CCCOc1ccc(cc1)Br 1458a_100000185746_100011259224 [0,2,0,0,0,0|2,0,0]=4 18438 B15R1.26 C=CC(=O)CCCOc1ccc(cc1)F 1458a_100000185746_100000181347 [0,2,0,0,0,0|2,0,0]=4 18439 B15R1.26 C=CC(=O)NCCCc1ccc(cc1)Br 1626a_100011297623_100000185746 [0,2,0,0,0,0|2,0,0]=4 18440 B15R1.26 C=CC(=O)NCCCc1ccc(cc1)Br 240690a_100011297623_200121576911 [0,2,0,0,0,0|2,0,0]=4 18441 B15R1.26 C=CC(=O)NCCCc1ccc(cc1)C 1626a_100011236272_100000185746 [0,2,0,0,0,0|2,0,0]=4 18442 B15R1.26 C=CC(=O)NCCCc1ccc(cc1)C 240690a_100011236272_200121576911 [0,2,0,0,0,0|2,0,0]=4 18443 B15R1.26 C=CC(=O)NCCCc1ccc(cc1)Cl 1626a_100000748451_100000185746 [0,2,0,0,0,0|2,0,0]=4 18444 B15R1.26 C=CC(=O)NCCCc1ccc(cc1)Cl 240690a_100000748451_200121576911 [0,2,0,0,0,0|2,0,0]=4 18445 B15R1.26 C=CC(=O)NCCCc1ccc(cc1)F 1626a_100025745824_100000185746 [0,2,0,0,0,0|2,0,0]=4 18446 B15R1.26 C=CC(=O)NCCCc1ccc(cc1)F 240690a_100025745824_200121576911 [0,2,0,0,0,0|2,0,0]=4 18447 B15R1.26 CCC(=O)CCCCc1ccc(cc1)Br 1458a_100000210414_200012094861 [0,2,0,0,0,0|1,0,0]=3 18448 B15R1.26 CCC(=O)CCCCc1ccc(cc1)Br 1458a_100000741018_100000210202 [0,2,0,0,0,0|1,0,0]=3 18449 B15R1.26 CCC(=O)CCCCc1ccc(cc1)Cl 1458a_100000684701_100000210202 [0,2,0,0,0,0|1,0,0]=3 18450 B15R1.26 CCC(=O)CCCCc1ccc(cc1)F 1458a_100000210414_100012093538 [0,2,0,0,0,0|1,0,0]=3 18451 B15R1.26 CCC(=O)CCCCc1ccc(cc1)F 1458a_100000703604_100000210202 [0,2,0,0,0,0|1,0,0]=3 18452 B15R1.26 CCC(=O)CCCCc1ccc(cc1)I 1458a_100000749853_100000210202 [0,2,0,0,0,0|1,0,0]=3 18453 B15R1.26 CCC(=O)CCCCc1ccc(cc1)O 1458a_100000047048_100000210202 [0,2,0,0,0,0|1,0,0]=3 18454 B15R1.26 CCC(=O)CCCOc1ccc(cc1)Br 1458a_100000183208_100000210202 [0,2,0,0,0,0|2,0,0]=4 18455 B15R1.26 CCC(=O)CCCOc1ccc(cc1)Br 1458a_100000210414_100011259224 [0,2,0,0,0,0|2,0,0]=4 18456 B15R1.26 CCC(=O)CCCOc1ccc(cc1)C 1458a_100000182836_100000210202 [0,2,0,0,0,0|2,0,0]=4 18457 B15R1.26 CCC(=O)CCCOc1ccc(cc1)Cl 1458a_100000741531_100000210202 [0,2,0,0,0,0|2,0,0]=4 18458 B15R1.26 CCC(=O)CCCOc1ccc(cc1)F 1458a_100000210414_100000181347 [0,2,0,0,0,0|2,0,0]=4 18459 B15R1.26 CCC(=O)CCCOc1ccc(cc1)F 1458a_100000735736_100000210202 [0,2,0,0,0,0|2,0,0]=4 18460 B15R1.26 CCC(=O)CCCOc1ccc(cc1)I 1458a_100000744034_100000210202 [0,2,0,0,0,0|2,0,0]=4 18461 B15R1.26 CCC(=O)CCCSc1ccc(cc1)Br 1458a_100000753536_100000210202 [0,2,0,0,0,0|2,0,0]=4 18462 B15R1.26 CCC(=O)CCCSc1ccc(cc1)Cl 1458a_100000182790_100000210202 [0,2,0,0,0,0|2,0,0]=4 18463 B15R1.26 CCC(=O)CCSCc1ccc(cc1)C 1458a_200000173737_100000210202 [0,2,0,0,0,0|2,0,0]=4 18464 B15R1.26 CCC(=O)COCCc1ccc(cc1)Br 34a_100000725409_100011740612 [0,2,0,0,0,0|2,0,0]=4 18465 B15R1.26 CCC(=O)COCCc1ccc(cc1)Br 7a_100000766406_100000747405 [0,2,0,0,0,0|2,0,0]=4 18466 B15R1.26 CCC(=O)COCCc1ccc(cc1)C 34a_100000725409_100011713686 [0,2,0,0,0,0|2,0,0]=4 18467 B15R1.26 CCC(=O)COCCc1ccc(cc1)C 7a_100000756670_100000747405 [0,2,0,0,0,0|2,0,0]=4 18468 B15R1.26 CCC(=O)COCCc1ccc(cc1)Cl 34a_100000725409_100011713675 [0,2,0,0,0,0|2,0,0]=4 18469 B15R1.26 CCC(=O)COCCc1ccc(cc1)Cl 7a_100011219627_100000747405 [0,2,0,0,0,0|2,0,0]=4 18470 B15R1.26 CCC(=O)COCCc1ccc(cc1)F 34a_100000725409_100011217392 [0,2,0,0,0,0|2,0,0]=4 18471 B15R1.26 CCC(=O)COCCc1ccc(cc1)F 7a_100000754732_100000747405 [0,2,0,0,0,0|2,0,0]=4 18472 B15R1.26 CCC(=O)COCCc1ccc(cc1)I 7a_100012291149_100000747405 [0,2,0,0,0,0|2,0,0]=4 18473 B15R1.26 CCC(=O)CSCCc1ccc(cc1)Br 62a_100000747405_100011740612 [0,2,0,0,0,0|2,0,0]=4 18474 B15R1.26 CCC(=O)CSCCc1ccc(cc1)Br 62a_100011740612_100000747405 [0,2,0,0,0,0|2,0,0]=4 18475 B15R1.26 CCC(=O)CSCCc1ccc(cc1)C 62a_100000747405_100011713686 [0,2,0,0,0,0|2,0,0]=4 18476 B15R1.26 CCC(=O)CSCCc1ccc(cc1)C 62a_100011713686_100000747405 [0,2,0,0,0,0|2,0,0]=4 18477 B15R1.26 CCC(=O)CSCCc1ccc(cc1)Cl 62a_100000747405_100011713675 [0,2,0,0,0,0|2,0,0]=4 18478 B15R1.26 CCC(=O)CSCCc1ccc(cc1)Cl 62a_100011713675_100000747405 [0,2,0,0,0,0|2,0,0]=4 18479 B15R1.26 CCC(=O)CSCCc1ccc(cc1)F 62a_100000747405_100011217392 [0,2,0,0,0,0|2,0,0]=4 18480 B15R1.26 CCC(=O)CSCCc1ccc(cc1)F 62a_100011217392_100000747405 [0,2,0,0,0,0|2,0,0]=4 18481 B15R1.26 CCC(=O)CSCCc1ccc(cc1)O 62a_100000747405_100009816426 [0,2,0,0,0,0|2,0,0]=4 18482 B15R1.26 CCC(=O)CSCCc1ccc(cc1)O 62a_100009816426_100000747405 [0,2,0,0,0,0|2,0,0]=4 18483 B15R1.26 CCC(=O)NCCCc1ccc(cc1)Br 11a_100011297623_100000210414 [0,2,0,0,0,0|2,0,0]=4 18484 B15R1.26 CCC(=O)NCCCc1ccc(cc1)Br 1626a_100011297623_100000210414 [0,2,0,0,0,0|2,0,0]=4 18485 B15R1.26 CCC(=O)NCCCc1ccc(cc1)Br 240690a_100011297623_100000210414 [0,2,0,0,0,0|2,0,0]=4 18486 B15R1.26 CCC(=O)NCCCc1ccc(cc1)Br 527a_100011297623_100000210414 [0,2,0,0,0,0|2,0,0]=4 18487 B15R1.26 CCC(=O)NCCCc1ccc(cc1)C 11a_100011236272_100000210414 [0,2,0,0,0,0|2,0,0]=4 18488 B15R1.26 CCC(=O)NCCCc1ccc(cc1)C 1626a_100011236272_100000210414 [0,2,0,0,0,0|2,0,0]=4 18489 B15R1.26 CCC(=O)NCCCc1ccc(cc1)C 240690a_100011236272_100000210414 [0,2,0,0,0,0|2,0,0]=4 18490 B15R1.26 CCC(=O)NCCCc1ccc(cc1)C 527a_100011236272_100000210414 [0,2,0,0,0,0|2,0,0]=4 18491 B15R1.26 CCC(=O)NCCCc1ccc(cc1)Cl 11a_100000748451_100000210414 [0,2,0,0,0,0|2,0,0]=4 18492 B15R1.26 CCC(=O)NCCCc1ccc(cc1)Cl 1626a_100000748451_100000210414 [0,2,0,0,0,0|2,0,0]=4 18493 B15R1.26 CCC(=O)NCCCc1ccc(cc1)Cl 240690a_100000748451_100000210414 [0,2,0,0,0,0|2,0,0]=4 18494 B15R1.26 CCC(=O)NCCCc1ccc(cc1)Cl 527a_100000748451_100000210414 [0,2,0,0,0,0|2,0,0]=4 18495 B15R1.26 CCC(=O)NCCCc1ccc(cc1)F 11a_100025745824_100000210414 [0,2,0,0,0,0|2,0,0]=4 18496 B15R1.26 CCC(=O)NCCCc1ccc(cc1)F 1626a_100025745824_100000210414 [0,2,0,0,0,0|2,0,0]=4 18497 B15R1.26 CCC(=O)NCCCc1ccc(cc1)F 240690a_100025745824_100000210414 [0,2,0,0,0,0|2,0,0]=4 18498 B15R1.26 CCC(=O)NCCCc1ccc(cc1)F 527a_100025745824_100000210414 [0,2,0,0,0,0|2,0,0]=4 18499 B15R1.26 CNC(=O)CCCCc1ccc(cc1)Br 11a_106832991635_100000741018 [0,2,0,0,0,0|1,0,0]=3 18500 B15R1.26 CNC(=O)CCCCc1ccc(cc1)Br 1626a_100102657272_100000741018 [0,2,0,0,0,0|1,0,0]=3 18501 B15R1.26 CNC(=O)CCCCc1ccc(cc1)Br 240690a_100102657272_100000741018 [0,2,0,0,0,0|1,0,0]=3 18502 B15R1.26 CNC(=O)CCCCc1ccc(cc1)Br 527a_100102657272_100000741018 [0,2,0,0,0,0|1,0,0]=3 18503 B15R1.26 CNC(=O)CCCCc1ccc(cc1)Cl 11a_106832991635_100000684701 [0,2,0,0,0,0|1,0,0]=3 18504 B15R1.26 CNC(=O)CCCCc1ccc(cc1)Cl 1626a_100102657272_100000684701 [0,2,0,0,0,0|1,0,0]=3 18505 B15R1.26 CNC(=O)CCCCc1ccc(cc1)Cl 240690a_100102657272_100000684701 [0,2,0,0,0,0|1,0,0]=3 18506 B15R1.26 CNC(=O)CCCCc1ccc(cc1)Cl 527a_100102657272_100000684701 [0,2,0,0,0,0|1,0,0]=3 18507 B15R1.26 CNC(=O)CCCCc1ccc(cc1)F 11a_106832991635_100000703604 [0,2,0,0,0,0|1,0,0]=3 18508 B15R1.26 CNC(=O)CCCCc1ccc(cc1)F 1626a_100102657272_100000703604 [0,2,0,0,0,0|1,0,0]=3 18509 B15R1.26 CNC(=O)CCCCc1ccc(cc1)F 240690a_100102657272_100000703604 [0,2,0,0,0,0|1,0,0]=3 18510 B15R1.26 CNC(=O)CCCCc1ccc(cc1)F 527a_100102657272_100000703604 [0,2,0,0,0,0|1,0,0]=3 18511 B15R1.26 CNC(=O)CCCCc1ccc(cc1)I 11a_106832991635_100000749853 [0,2,0,0,0,0|1,0,0]=3 18512 B15R1.26 CNC(=O)CCCCc1ccc(cc1)I 1626a_100102657272_100000749853 [0,2,0,0,0,0|1,0,0]=3 18513 B15R1.26 CNC(=O)CCCCc1ccc(cc1)I 240690a_100102657272_100000749853 [0,2,0,0,0,0|1,0,0]=3 18514 B15R1.26 CNC(=O)CCCCc1ccc(cc1)I 527a_100102657272_100000749853 [0,2,0,0,0,0|1,0,0]=3 18515 B15R1.26 CNC(=O)CCCCc1ccc(cc1)O 240690a_100102657272_100000047048 [0,2,0,0,0,0|1,0,0]=3 18516 B15R1.26 CNC(=O)CCCCc1ccc(cc1)O 527a_100102657272_100000047048 [0,2,0,0,0,0|1,0,0]=3 18517 B15R1.26 CNC(=O)CCCNc1ccc(cc1)Br 2230a_100000210018_100000741757 [0,2,0,0,0,0|2,0,0]=4 18518 B15R1.26 CNC(=O)CCCNc1ccc(cc1)Br 34a_100000210018_100000741757 [0,2,0,0,0,0|2,0,0]=4 18519 B15R1.26 CNC(=O)CCCNc1ccc(cc1)C 34a_100000124888_100000741757 [0,2,0,0,0,0|2,0,0]=4 18520 B15R1.26 CNC(=O)CCCNc1ccc(cc1)Cl 2230a_100000210052_100000741757 [0,2,0,0,0,0|2,0,0]=4 18521 B15R1.26 CNC(=O)CCCNc1ccc(cc1)Cl 34a_100000210052_100000741757 [0,2,0,0,0,0|2,0,0]=4 18522 B15R1.26 CNC(=O)CCCNc1ccc(cc1)F 34a_100000185862_100000741757 [0,2,0,0,0,0|2,0,0]=4 18523 B15R1.26 CNC(=O)CCCNc1ccc(cc1)I 34a_100000185761_100000741757 [0,2,0,0,0,0|2,0,0]=4 18524 B15R1.26 CNC(=O)CCCNc1ccc(cc1)O 34a_100000185829_100000741757 [0,2,0,0,0,0|2,0,0]=4 18525 B15R1.26 CNC(=O)CCCOc1ccc(cc1)Br 11a_106832991635_100000183208 [0,2,0,0,0,0|2,0,0]=4 18526 B15R1.26 CNC(=O)CCCOc1ccc(cc1)Br 1626a_100102657272_100000183208 [0,2,0,0,0,0|2,0,0]=4 18527 B15R1.26 CNC(=O)CCCOc1ccc(cc1)Br 240690a_100102657272_100000183208 [0,2,0,0,0,0|2,0,0]=4 18528 B15R1.26 CNC(=O)CCCOc1ccc(cc1)Br 34a_100000185759_100000741757 [0,2,0,0,0,0|2,0,0]=4 18529 B15R1.26 CNC(=O)CCCOc1ccc(cc1)Br 527a_100102657272_100000183208 [0,2,0,0,0,0|2,0,0]=4 18530 B15R1.26 CNC(=O)CCCOc1ccc(cc1)Br 7a_100000185759_100000741757 [0,2,0,0,0,0|2,0,0]=4 18531 B15R1.26 CNC(=O)CCCOc1ccc(cc1)C 11a_106832991635_100000182836 [0,2,0,0,0,0|2,0,0]=4 18532 B15R1.26 CNC(=O)CCCOc1ccc(cc1)C 1626a_100102657272_100000182836 [0,2,0,0,0,0|2,0,0]=4 18533 B15R1.26 CNC(=O)CCCOc1ccc(cc1)C 240690a_100102657272_100000182836 [0,2,0,0,0,0|2,0,0]=4 18534 B15R1.26 CNC(=O)CCCOc1ccc(cc1)C 34a_100000210336_100000741757 [0,2,0,0,0,0|2,0,0]=4 18535 B15R1.26 CNC(=O)CCCOc1ccc(cc1)C 527a_100102657272_100000182836 [0,2,0,0,0,0|2,0,0]=4 18536 B15R1.26 CNC(=O)CCCOc1ccc(cc1)C 7a_100000210336_100000741757 [0,2,0,0,0,0|2,0,0]=4 18537 B15R1.26 CNC(=O)CCCOc1ccc(cc1)Cl 11a_106832991635_100000741531 [0,2,0,0,0,0|2,0,0]=4 18538 B15R1.26 CNC(=O)CCCOc1ccc(cc1)Cl 1626a_100102657272_100000741531 [0,2,0,0,0,0|2,0,0]=4 18539 B15R1.26 CNC(=O)CCCOc1ccc(cc1)Cl 240690a_100102657272_100000741531 [0,2,0,0,0,0|2,0,0]=4 18540 B15R1.26 CNC(=O)CCCOc1ccc(cc1)Cl 34a_100000210216_100000741757 [0,2,0,0,0,0|2,0,0]=4 18541 B15R1.26 CNC(=O)CCCOc1ccc(cc1)Cl 527a_100102657272_100000741531 [0,2,0,0,0,0|2,0,0]=4 18542 B15R1.26 CNC(=O)CCCOc1ccc(cc1)Cl 7a_100000210216_100000741757 [0,2,0,0,0,0|2,0,0]=4 18543 B15R1.26 CNC(=O)CCCOc1ccc(cc1)F 11a_106832991635_100000735736 [0,2,0,0,0,0|2,0,0]=4 18544 B15R1.26 CNC(=O)CCCOc1ccc(cc1)F 1626a_100102657272_100000735736 [0,2,0,0,0,0|2,0,0]=4 18545 B15R1.26 CNC(=O)CCCOc1ccc(cc1)F 240690a_100102657272_100000735736 [0,2,0,0,0,0|2,0,0]=4 18546 B15R1.26 CNC(=O)CCCOc1ccc(cc1)F 34a_100000210339_100000741757 [0,2,0,0,0,0|2,0,0]=4 18547 B15R1.26 CNC(=O)CCCOc1ccc(cc1)F 527a_100102657272_100000735736 [0,2,0,0,0,0|2,0,0]=4 18548 B15R1.26 CNC(=O)CCCOc1ccc(cc1)I 11a_106832991635_100000744034 [0,2,0,0,0,0|2,0,0]=4 18549 B15R1.26 CNC(=O)CCCOc1ccc(cc1)I 1626a_100102657272_100000744034 [0,2,0,0,0,0|2,0,0]=4 18550 B15R1.26 CNC(=O)CCCOc1ccc(cc1)I 240690a_100102657272_100000744034 [0,2,0,0,0,0|2,0,0]=4 18551 B15R1.26 CNC(=O)CCCOc1ccc(cc1)I 34a_100000212066_100000741757 [0,2,0,0,0,0|2,0,0]=4 18552 B15R1.26 CNC(=O)CCCOc1ccc(cc1)I 527a_100102657272_100000744034 [0,2,0,0,0,0|2,0,0]=4 18553 B15R1.26 CNC(=O)CCCOc1ccc(cc1)I 7a_100000212066_100000741757 [0,2,0,0,0,0|2,0,0]=4 18554 B15R1.26 CNC(=O)CCCOc1ccc(cc1)N 34a_100000185829_100000741757 [0,2,0,0,0,0|2,0,0]=4 18555 B15R1.26 CNC(=O)CCCSc1ccc(cc1)Br 11a_106832991635_100000753536 [0,2,0,0,0,0|2,0,0]=4 18556 B15R1.26 CNC(=O)CCCSc1ccc(cc1)Br 1626a_100102657272_100000753536 [0,2,0,0,0,0|2,0,0]=4 18557 B15R1.26 CNC(=O)CCCSc1ccc(cc1)Br 240690a_100102657272_100000753536 [0,2,0,0,0,0|2,0,0]=4 18558 B15R1.26 CNC(=O)CCCSc1ccc(cc1)Br 527a_100102657272_100000753536 [0,2,0,0,0,0|2,0,0]=4 18559 B15R1.26 CNC(=O)CCCSc1ccc(cc1)Br 62a_100000741757_100000752885 [0,2,0,0,0,0|2,0,0]=4 18560 B15R1.26 CNC(=O)CCCSc1ccc(cc1)Br 62a_100000752885_100000741757 [0,2,0,0,0,0|2,0,0]=4 18561 B15R1.26 CNC(=O)CCCSc1ccc(cc1)C 62a_100000186775_100000741757 [0,2,0,0,0,0|2,0,0]=4 18562 B15R1.26 CNC(=O)CCCSc1ccc(cc1)C 62a_100000741757_100000186775 [0,2,0,0,0,0|2,0,0]=4 18563 B15R1.26 CNC(=O)CCCSc1ccc(cc1)Cl 11a_106832991635_100000182790 [0,2,0,0,0,0|2,0,0]=4 18564 B15R1.26 CNC(=O)CCCSc1ccc(cc1)Cl 1626a_100102657272_100000182790 [0,2,0,0,0,0|2,0,0]=4 18565 B15R1.26 CNC(=O)CCCSc1ccc(cc1)Cl 240690a_100102657272_100000182790 [0,2,0,0,0,0|2,0,0]=4 18566 B15R1.26 CNC(=O)CCCSc1ccc(cc1)Cl 527a_100102657272_100000182790 [0,2,0,0,0,0|2,0,0]=4 18567 B15R1.26 CNC(=O)CCCSc1ccc(cc1)Cl 62a_100000741757_100000755918 [0,2,0,0,0,0|2,0,0]=4 18568 B15R1.26 CNC(=O)CCCSc1ccc(cc1)Cl 62a_100000755918_100000741757 [0,2,0,0,0,0|2,0,0]=4 18569 B15R1.26 CNC(=O)CCCSc1ccc(cc1)F 62a_100000211213_100000741757 [0,2,0,0,0,0|2,0,0]=4 18570 B15R1.26 CNC(=O)CCCSc1ccc(cc1)F 62a_100000741757_100000211213 [0,2,0,0,0,0|2,0,0]=4 18571 B15R1.26 CNC(=O)CCCSc1ccc(cc1)N 62a_100000185761_100000741757 [0,2,0,0,0,0|2,0,0]=4 18572 B15R1.26 CNC(=O)CCCSc1ccc(cc1)N 62a_100000741757_100000185761 [0,2,0,0,0,0|2,0,0]=4 18573 B15R1.26 CNC(=O)CCCSc1ccc(cc1)O 62a_100000741757_100000185759 [0,2,0,0,0,0|2,0,0]=4 18574 B15R1.26 CNC(=O)CCNCc1ccc(cc1)Br 207a_100000738227_100000186029 [0,2,0,0,0,0|2,0,0]=4 18575 B15R1.26 CNC(=O)CCNCc1ccc(cc1)Br 2230a_100000174875_100000737683 [0,2,0,0,0,0|2,0,0]=4 18576 B15R1.26 CNC(=O)CCNCc1ccc(cc1)Br 2230a_100000738227_100011217064 [0,2,0,0,0,0|2,0,0]=4 18577 B15R1.26 CNC(=O)CCNCc1ccc(cc1)Br 270004a_100000738227_100000186029 [0,2,0,0,0,0|2,0,0]=4 18578 B15R1.26 CNC(=O)CCNCc1ccc(cc1)Br 34a_100000174875_100012179268 [0,2,0,0,0,0|2,0,0]=4 18579 B15R1.26 CNC(=O)CCNCc1ccc(cc1)Br 34a_100000738227_100000189115 [0,2,0,0,0,0|2,0,0]=4 18580 B15R1.26 CNC(=O)CCNCc1ccc(cc1)C 207a_100000738227_100000211033 [0,2,0,0,0,0|2,0,0]=4 18581 B15R1.26 CNC(=O)CCNCc1ccc(cc1)C 2230a_100000174908_100000737683 [0,2,0,0,0,0|2,0,0]=4 18582 B15R1.26 CNC(=O)CCNCc1ccc(cc1)C 2230a_100000738227_100000210814 [0,2,0,0,0,0|2,0,0]=4 18583 B15R1.26 CNC(=O)CCNCc1ccc(cc1)C 270004a_100000738227_100000211033 [0,2,0,0,0,0|2,0,0]=4 18584 B15R1.26 CNC(=O)CCNCc1ccc(cc1)C 34a_100000174908_100012179268 [0,2,0,0,0,0|2,0,0]=4 18585 B15R1.26 CNC(=O)CCNCc1ccc(cc1)C 34a_100000738227_100000210814 [0,2,0,0,0,0|2,0,0]=4 18586 B15R1.26 CNC(=O)CCNCc1ccc(cc1)Cl 207a_100000738227_100000189385 [0,2,0,0,0,0|2,0,0]=4 18587 B15R1.26 CNC(=O)CCNCc1ccc(cc1)Cl 2230a_100000174871_100000737683 [0,2,0,0,0,0|2,0,0]=4 18588 B15R1.26 CNC(=O)CCNCc1ccc(cc1)Cl 2230a_100000738227_100000694040 [0,2,0,0,0,0|2,0,0]=4 18589 B15R1.26 CNC(=O)CCNCc1ccc(cc1)Cl 270004a_100000738227_100000189385 [0,2,0,0,0,0|2,0,0]=4 18590 B15R1.26 CNC(=O)CCNCc1ccc(cc1)Cl 34a_100000174871_100012179268 [0,2,0,0,0,0|2,0,0]=4 18591 B15R1.26 CNC(=O)CCNCc1ccc(cc1)Cl 34a_100000738227_100000694040 [0,2,0,0,0,0|2,0,0]=4 18592 B15R1.26 CNC(=O)CCNCc1ccc(cc1)F 207a_100000738227_100000210084 [0,2,0,0,0,0|2,0,0]=4 18593 B15R1.26 CNC(=O)CCNCc1ccc(cc1)F 2230a_100000174882_100000737683 [0,2,0,0,0,0|2,0,0]=4 18594 B15R1.26 CNC(=O)CCNCc1ccc(cc1)F 2230a_100000738227_100000198546 [0,2,0,0,0,0|2,0,0]=4 18595 B15R1.26 CNC(=O)CCNCc1ccc(cc1)F 270004a_100000738227_100000210084 [0,2,0,0,0,0|2,0,0]=4 18596 B15R1.26 CNC(=O)CCNCc1ccc(cc1)F 34a_100000174882_100012179268 [0,2,0,0,0,0|2,0,0]=4 18597 B15R1.26 CNC(=O)CCNCc1ccc(cc1)F 34a_100000738227_100000198546 [0,2,0,0,0,0|2,0,0]=4 18598 B15R1.26 CNC(=O)CCNCc1ccc(cc1)I 207a_100000738227_100000188517 [0,2,0,0,0,0|2,0,0]=4 18599 B15R1.26 CNC(=O)CCNCc1ccc(cc1)I 2230a_100000738227_100000189116 [0,2,0,0,0,0|2,0,0]=4 18600 B15R1.26 CNC(=O)CCNCc1ccc(cc1)I 2230a_100016989417_100000737683 [0,2,0,0,0,0|2,0,0]=4 18601 B15R1.26 CNC(=O)CCNCc1ccc(cc1)I 34a_100000738227_100000189116 [0,2,0,0,0,0|2,0,0]=4 18602 B15R1.26 CNC(=O)CCNCc1ccc(cc1)I 34a_100016989417_100012179268 [0,2,0,0,0,0|2,0,0]=4 18603 B15R1.26 CNC(=O)CCNCc1ccc(cc1)O 34a_100000185549_100012179268 [0,2,0,0,0,0|2,0,0]=4 18604 B15R1.26 CNC(=O)CCOCc1ccc(cc1)Br 34a_100000695286_100012179268 [0,2,0,0,0,0|2,0,0]=4 18605 B15R1.26 CNC(=O)CCOCc1ccc(cc1)Br 34a_100000754576_100000189115 [0,2,0,0,0,0|2,0,0]=4 18606 B15R1.26 CNC(=O)CCOCc1ccc(cc1)C 34a_100000754576_100000210814 [0,2,0,0,0,0|2,0,0]=4 18607 B15R1.26 CNC(=O)CCOCc1ccc(cc1)C 34a_100011215236_100012179268 [0,2,0,0,0,0|2,0,0]=4 18608 B15R1.26 CNC(=O)CCOCc1ccc(cc1)C 7a_100011215236_100000737683 [0,2,0,0,0,0|2,0,0]=4 18609 B15R1.26 CNC(=O)CCOCc1ccc(cc1)Cl 34a_100000211118_100012179268 [0,2,0,0,0,0|2,0,0]=4 18610 B15R1.26 CNC(=O)CCOCc1ccc(cc1)Cl 34a_100000754576_100000694040 [0,2,0,0,0,0|2,0,0]=4 18611 B15R1.26 CNC(=O)CCOCc1ccc(cc1)Cl 7a_100000211118_100000737683 [0,2,0,0,0,0|2,0,0]=4 18612 B15R1.26 CNC(=O)CCOCc1ccc(cc1)F 34a_100000210977_100012179268 [0,2,0,0,0,0|2,0,0]=4 18613 B15R1.26 CNC(=O)CCOCc1ccc(cc1)F 34a_100000754576_100000198546 [0,2,0,0,0,0|2,0,0]=4 18614 B15R1.26 CNC(=O)CCOCc1ccc(cc1)F 7a_100000210977_100000737683 [0,2,0,0,0,0|2,0,0]=4 18615 B15R1.26 CNC(=O)CCOCc1ccc(cc1)I 34a_100000690907_100012179268 [0,2,0,0,0,0|2,0,0]=4 18616 B15R1.26 CNC(=O)CCOCc1ccc(cc1)I 34a_100000754576_100000189116 [0,2,0,0,0,0|2,0,0]=4 18617 B15R1.26 CNC(=O)CCOCc1ccc(cc1)I 7a_100000690907_100000737683 [0,2,0,0,0,0|2,0,0]=4 18618 B15R1.26 CNC(=O)CCOCc1ccc(cc1)N 34a_100011215238_100012179268 [0,2,0,0,0,0|2,0,0]=4 18619 B15R1.26 CNC(=O)CCSCc1ccc(cc1)Br 62a_100000189115_100000737683 [0,2,0,0,0,0|2,0,0]=4 18620 B15R1.26 CNC(=O)CCSCc1ccc(cc1)Br 62a_100000737683_100000189115 [0,2,0,0,0,0|2,0,0]=4 18621 B15R1.26 CNC(=O)CCSCc1ccc(cc1)C 11a_106832991635_200000173737 [0,2,0,0,0,0|2,0,0]=4 18622 B15R1.26 CNC(=O)CCSCc1ccc(cc1)C 1626a_100102657272_200000173737 [0,2,0,0,0,0|2,0,0]=4 18623 B15R1.26 CNC(=O)CCSCc1ccc(cc1)C 240690a_100102657272_200000173737 [0,2,0,0,0,0|2,0,0]=4 18624 B15R1.26 CNC(=O)CCSCc1ccc(cc1)C 527a_100102657272_200000173737 [0,2,0,0,0,0|2,0,0]=4 18625 B15R1.26 CNC(=O)CCSCc1ccc(cc1)C 62a_100000210814_100000737683 [0,2,0,0,0,0|2,0,0]=4 18626 B15R1.26 CNC(=O)CCSCc1ccc(cc1)C 62a_100000737683_100000210814 [0,2,0,0,0,0|2,0,0]=4 18627 B15R1.26 CNC(=O)CCSCc1ccc(cc1)Cl 62a_100000187161_100000737683 [0,2,0,0,0,0|2,0,0]=4 18628 B15R1.26 CNC(=O)CCSCc1ccc(cc1)Cl 62a_100000737683_100000187161 [0,2,0,0,0,0|2,0,0]=4 18629 B15R1.26 CNC(=O)CCSCc1ccc(cc1)F 62a_100000198546_100000737683 [0,2,0,0,0,0|2,0,0]=4 18630 B15R1.26 CNC(=O)CCSCc1ccc(cc1)F 62a_100000737683_100000187164 [0,2,0,0,0,0|2,0,0]=4 18631 B15R1.26 CNC(=O)CCSCc1ccc(cc1)I 62a_100000189116_100000737683 [0,2,0,0,0,0|2,0,0]=4 18632 B15R1.26 CNC(=O)CCSCc1ccc(cc1)I 62a_100000737683_100000189116 [0,2,0,0,0,0|2,0,0]=4 18633 B15R1.26 CNC(=O)CNCCc1ccc(cc1)Br 2230a_100000693194_100011740612 [0,2,0,0,0,0|2,0,0]=4 18634 B15R1.26 CNC(=O)CNCCc1ccc(cc1)Br 2230a_100000755846_100000183359 [0,2,0,0,0,0|2,0,0]=4 18635 B15R1.26 CNC(=O)CNCCc1ccc(cc1)Br 34a_100000755846_100000183359 [0,2,0,0,0,0|2,0,0]=4 18636 B15R1.26 CNC(=O)CNCCc1ccc(cc1)C 2230a_100000693194_100011713686 [0,2,0,0,0,0|2,0,0]=4 18637 B15R1.26 CNC(=O)CNCCc1ccc(cc1)C 2230a_100000705350_100000183359 [0,2,0,0,0,0|2,0,0]=4 18638 B15R1.26 CNC(=O)CNCCc1ccc(cc1)C 34a_100000705350_100000183359 [0,2,0,0,0,0|2,0,0]=4 18639 B15R1.26 CNC(=O)CNCCc1ccc(cc1)Cl 2230a_100000185265_100000183359 [0,2,0,0,0,0|2,0,0]=4 18640 B15R1.26 CNC(=O)CNCCc1ccc(cc1)Cl 2230a_100000693194_100011713675 [0,2,0,0,0,0|2,0,0]=4 18641 B15R1.26 CNC(=O)CNCCc1ccc(cc1)Cl 34a_100000185265_100000183359 [0,2,0,0,0,0|2,0,0]=4 18642 B15R1.26 CNC(=O)CNCCc1ccc(cc1)F 2230a_100000199005_100000183359 [0,2,0,0,0,0|2,0,0]=4 18643 B15R1.26 CNC(=O)CNCCc1ccc(cc1)F 2230a_100000693194_100011217392 [0,2,0,0,0,0|2,0,0]=4 18644 B15R1.26 CNC(=O)CNCCc1ccc(cc1)F 34a_100000199005_100000183359 [0,2,0,0,0,0|2,0,0]=4 18645 B15R1.26 CNC(=O)CNCCc1ccc(cc1)O 2230a_100000693194_100009816426 [0,2,0,0,0,0|2,0,0]=4 18646 B15R1.26 CNC(=O)CNCCc1ccc(cc1)O 34a_100000743037_100000183359 [0,2,0,0,0,0|2,0,0]=4 18647 B15R1.26 CNC(=O)COCCc1ccc(cc1)Br 34a_100000750040_100011740612 [0,2,0,0,0,0|2,0,0]=4 18648 B15R1.26 CNC(=O)COCCc1ccc(cc1)Br 34a_100000766406_100000183359 [0,2,0,0,0,0|2,0,0]=4 18649 B15R1.26 CNC(=O)COCCc1ccc(cc1)Br 7a_100000766406_100000183359 [0,2,0,0,0,0|2,0,0]=4 18650 B15R1.26 CNC(=O)COCCc1ccc(cc1)C 34a_100000750040_100011713686 [0,2,0,0,0,0|2,0,0]=4 18651 B15R1.26 CNC(=O)COCCc1ccc(cc1)C 34a_100000756670_100000183359 [0,2,0,0,0,0|2,0,0]=4 18652 B15R1.26 CNC(=O)COCCc1ccc(cc1)C 7a_100000756670_100000183359 [0,2,0,0,0,0|2,0,0]=4 18653 B15R1.26 CNC(=O)COCCc1ccc(cc1)Cl 34a_100000750040_100011713675 [0,2,0,0,0,0|2,0,0]=4 18654 B15R1.26 CNC(=O)COCCc1ccc(cc1)Cl 34a_100011219627_100000183359 [0,2,0,0,0,0|2,0,0]=4 18655 B15R1.26 CNC(=O)COCCc1ccc(cc1)Cl 7a_100011219627_100000183359 [0,2,0,0,0,0|2,0,0]=4 18656 B15R1.26 CNC(=O)COCCc1ccc(cc1)F 34a_100000750040_100011217392 [0,2,0,0,0,0|2,0,0]=4 18657 B15R1.26 CNC(=O)COCCc1ccc(cc1)F 34a_100000754732_100000183359 [0,2,0,0,0,0|2,0,0]=4 18658 B15R1.26 CNC(=O)COCCc1ccc(cc1)F 7a_100000754732_100000183359 [0,2,0,0,0,0|2,0,0]=4 18659 B15R1.26 CNC(=O)COCCc1ccc(cc1)I 34a_100012291149_100000183359 [0,2,0,0,0,0|2,0,0]=4 18660 B15R1.26 CNC(=O)COCCc1ccc(cc1)I 7a_100012291149_100000183359 [0,2,0,0,0,0|2,0,0]=4 18661 B15R1.26 CNC(=O)COCCc1ccc(cc1)N 34a_100011204434_100000183359 [0,2,0,0,0,0|2,0,0]=4 18662 B15R1.26 CNC(=O)CSCCc1ccc(cc1)Br 62a_100000183359_100011740612 [0,2,0,0,0,0|2,0,0]=4 18663 B15R1.26 CNC(=O)CSCCc1ccc(cc1)Br 62a_100011740612_100000183359 [0,2,0,0,0,0|2,0,0]=4 18664 B15R1.26 CNC(=O)CSCCc1ccc(cc1)C 62a_100000183359_100011713686 [0,2,0,0,0,0|2,0,0]=4 18665 B15R1.26 CNC(=O)CSCCc1ccc(cc1)C 62a_100011713686_100000183359 [0,2,0,0,0,0|2,0,0]=4 18666 B15R1.26 CNC(=O)CSCCc1ccc(cc1)Cl 62a_100000183359_100011713675 [0,2,0,0,0,0|2,0,0]=4 18667 B15R1.26 CNC(=O)CSCCc1ccc(cc1)Cl 62a_100011713675_100000183359 [0,2,0,0,0,0|2,0,0]=4 18668 B15R1.26 CNC(=O)CSCCc1ccc(cc1)F 62a_100000183359_100011217392 [0,2,0,0,0,0|2,0,0]=4 18669 B15R1.26 CNC(=O)CSCCc1ccc(cc1)F 62a_100011217392_100000183359 [0,2,0,0,0,0|2,0,0]=4 18670 B15R1.26 CNC(=O)CSCCc1ccc(cc1)O 62a_100000183359_100009816426 [0,2,0,0,0,0|2,0,0]=4 18671 B15R1.26 CNC(=O)CSCCc1ccc(cc1)O 62a_100009816426_100000183359 [0,2,0,0,0,0|2,0,0]=4 18672 B15R1.26 CNC(=O)NCCCc1ccc(cc1)Br 2708a_100011297623_106832991635 [0,2,0,0,0,0|2,0,0]=4 18673 B15R1.26 CNC(=O)NCCCc1ccc(cc1)Br 2708a_100102657272_100011297623 [0,2,0,0,0,0|2,0,0]=4 18674 B15R1.26 CNC(=O)NCCCc1ccc(cc1)Br 273464a_100011297623_100102657272 [0,2,0,0,0,0|2,0,0]=4 18675 B15R1.26 CNC(=O)NCCCc1ccc(cc1)Br 273464a_100102657272_100011297623 [0,2,0,0,0,0|2,0,0]=4 18676 B15R1.26 CNC(=O)NCCCc1ccc(cc1)Br 512a_100011297623_100102657272 [0,2,0,0,0,0|2,0,0]=4 18677 B15R1.26 CNC(=O)NCCCc1ccc(cc1)Br 512a_106832991638_100011297623 [0,2,0,0,0,0|2,0,0]=4 18678 B15R1.26 CNC(=O)NCCCc1ccc(cc1)C 2708a_100011236272_106832991635 [0,2,0,0,0,0|2,0,0]=4 18679 B15R1.26 CNC(=O)NCCCc1ccc(cc1)C 2708a_100102657272_100011236272 [0,2,0,0,0,0|2,0,0]=4 18680 B15R1.26 CNC(=O)NCCCc1ccc(cc1)C 273464a_100011236272_100102657272 [0,2,0,0,0,0|2,0,0]=4 18681 B15R1.26 CNC(=O)NCCCc1ccc(cc1)C 273464a_100102657272_100011236272 [0,2,0,0,0,0|2,0,0]=4 18682 B15R1.26 CNC(=O)NCCCc1ccc(cc1)C 512a_100011236272_100102657272 [0,2,0,0,0,0|2,0,0]=4 18683 B15R1.26 CNC(=O)NCCCc1ccc(cc1)C 512a_106832991638_100011236272 [0,2,0,0,0,0|2,0,0]=4 18684 B15R1.26 CNC(=O)NCCCc1ccc(cc1)Cl 2708a_100000748451_106832991635 [0,2,0,0,0,0|2,0,0]=4 18685 B15R1.26 CNC(=O)NCCCc1ccc(cc1)Cl 2708a_100102657272_100000748451 [0,2,0,0,0,0|2,0,0]=4 18686 B15R1.26 CNC(=O)NCCCc1ccc(cc1)Cl 273464a_100000748451_100102657272 [0,2,0,0,0,0|2,0,0]=4 18687 B15R1.26 CNC(=O)NCCCc1ccc(cc1)Cl 273464a_100102657272_100000748451 [0,2,0,0,0,0|2,0,0]=4 18688 B15R1.26 CNC(=O)NCCCc1ccc(cc1)Cl 512a_100000748451_100102657272 [0,2,0,0,0,0|2,0,0]=4 18689 B15R1.26 CNC(=O)NCCCc1ccc(cc1)Cl 512a_106832991638_100000748451 [0,2,0,0,0,0|2,0,0]=4 18690 B15R1.26 CNC(=O)NCCCc1ccc(cc1)F 2708a_100025745824_106832991635 [0,2,0,0,0,0|2,0,0]=4 18691 B15R1.26 CNC(=O)NCCCc1ccc(cc1)F 2708a_100102657272_100025745824 [0,2,0,0,0,0|2,0,0]=4 18692 B15R1.26 CNC(=O)NCCCc1ccc(cc1)F 273464a_100025745824_100102657272 [0,2,0,0,0,0|2,0,0]=4 18693 B15R1.26 CNC(=O)NCCCc1ccc(cc1)F 273464a_100102657272_100025745824 [0,2,0,0,0,0|2,0,0]=4 18694 B15R1.26 CNC(=O)NCCCc1ccc(cc1)F 512a_100025745824_100102657272 [0,2,0,0,0,0|2,0,0]=4 18695 B15R1.26 CNC(=O)NCCCc1ccc(cc1)F 512a_106832991638_100025745824 [0,2,0,0,0,0|2,0,0]=4 18696 B15R1.26 COC(=O)CCCNc1ccc(cc1)Br 2230a_100000210018_100011218270 [0,2,0,0,0,0|1,0,0]=3 18697 B15R1.26 COC(=O)CCCNc1ccc(cc1)Br 34a_100000210018_100000742333 [0,2,0,0,0,0|1,0,0]=3 18698 B15R1.26 COC(=O)CCCNc1ccc(cc1)C 34a_100000124888_100000742333 [0,2,0,0,0,0|1,0,0]=3 18699 B15R1.26 COC(=O)CCCNc1ccc(cc1)Cl 2230a_100000210052_100011218270 [0,2,0,0,0,0|1,0,0]=3 18700 B15R1.26 COC(=O)CCCNc1ccc(cc1)Cl 34a_100000210052_100000742333 [0,2,0,0,0,0|1,0,0]=3 18701 B15R1.26 COC(=O)CCCNc1ccc(cc1)F 34a_100000185862_100000742333 [0,2,0,0,0,0|1,0,0]=3 18702 B15R1.26 COC(=O)CCCNc1ccc(cc1)I 34a_100000185761_100000742333 [0,2,0,0,0,0|1,0,0]=3 18703 B15R1.26 COC(=O)CCCNc1ccc(cc1)O 34a_100000185829_100000742333 [0,2,0,0,0,0|1,0,0]=3 18704 B15R1.26 COC(=O)CCCOc1ccc(=O)[nH]c1 34a_100000075641_100000742333 [0,2,0,0,0,0|2,0,0]=4 18705 B15R1.26 COC(=O)CCCOc1ccc(cc1)Br 34a_100000185759_100000742333 [0,2,0,0,0,0|1,0,0]=3 18706 B15R1.26 COC(=O)CCCOc1ccc(cc1)Br 7a_100000185759_100011218270 [0,2,0,0,0,0|1,0,0]=3 18707 B15R1.26 COC(=O)CCCOc1ccc(cc1)C 34a_100000210336_100000742333 [0,2,0,0,0,0|1,0,0]=3 18708 B15R1.26 COC(=O)CCCOc1ccc(cc1)C 7a_100000210336_100011218270 [0,2,0,0,0,0|1,0,0]=3 18709 B15R1.26 COC(=O)CCCOc1ccc(cc1)Cl 34a_100000210216_100000742333 [0,2,0,0,0,0|1,0,0]=3 18710 B15R1.26 COC(=O)CCCOc1ccc(cc1)Cl 7a_100000210216_100011218270 [0,2,0,0,0,0|1,0,0]=3 18711 B15R1.26 COC(=O)CCCOc1ccc(cc1)F 34a_100000210339_100000742333 [0,2,0,0,0,0|1,0,0]=3 18712 B15R1.26 COC(=O)CCCOc1ccc(cc1)I 34a_100000212066_100000742333 [0,2,0,0,0,0|1,0,0]=3 18713 B15R1.26 COC(=O)CCCOc1ccc(cc1)I 7a_100000212066_100011218270 [0,2,0,0,0,0|1,0,0]=3 18714 B15R1.26 COC(=O)CCCOc1ccc(cc1)N 34a_100000185829_100000742333 [0,2,0,0,0,0|1,0,0]=3 18715 B15R1.26 COC(=O)CCCOc1ccc(cn1)C 34a_100000759353_100000742333 [0,2,0,0,0,0|2,0,0]=4 18716 B15R1.26 COC(=O)CCCOc1ccc(cn1)Cl 34a_100011215309_100000742333 [0,2,0,0,0,0|2,0,0]=4 18717 B15R1.26 COC(=O)CCCOc1ccc(cn1)F 34a_100000742473_100000742333 [0,2,0,0,0,0|2,0,0]=4 18718 B15R1.26 COC(=O)CCCOc1ccc(cn1)N 34a_100000729260_100000742333 [0,2,0,0,0,0|2,0,0]=4 18719 B15R1.26 COC(=O)CCCOc1ccc(nc1)Br 34a_100000685995_100000742333 [0,2,0,0,0,0|2,0,0]=4 18720 B15R1.26 COC(=O)CCCOc1ccc(nc1)Br 7a_100000685995_100011218270 [0,2,0,0,0,0|2,0,0]=4 18721 B15R1.26 COC(=O)CCCOc1ccc(nc1)C 34a_100000745506_100000742333 [0,2,0,0,0,0|2,0,0]=4 18722 B15R1.26 COC(=O)CCCOc1ccc(nc1)C 7a_100000745506_100011218270 [0,2,0,0,0,0|2,0,0]=4 18723 B15R1.26 COC(=O)CCCOc1ccc(nc1)Cl 34a_100000744096_100000742333 [0,2,0,0,0,0|2,0,0]=4 18724 B15R1.26 COC(=O)CCCOc1ccc(nc1)Cl 7a_100000744096_100011218270 [0,2,0,0,0,0|2,0,0]=4 18725 B15R1.26 COC(=O)CCCOc1ccc(nc1)F 34a_100000688820_100000742333 [0,2,0,0,0,0|2,0,0]=4 18726 B15R1.26 COC(=O)CCCOc1ccc(nc1)F 7a_100000688820_100011218270 [0,2,0,0,0,0|2,0,0]=4 18727 B15R1.26 COC(=O)CCCOc1ccc(nc1)I 34a_100000687607_100000742333 [0,2,0,0,0,0|2,0,0]=4 18728 B15R1.26 COC(=O)CCCOc1ccc(nc1)I 7a_100000687607_100011218270 [0,2,0,0,0,0|2,0,0]=4 18729 B15R1.26 COC(=O)CCCOc1ccc(nc1)N 34a_100015188713_100000742333 [0,2,0,0,0,0|2,0,0]=4 18730 B15R1.26 COC(=O)CCCOc1ccc(nc1)N 7a_100015188713_100011218270 [0,2,0,0,0,0|2,0,0]=4 18731 B15R1.26 COC(=O)CCCSc1cc[n+](cc1)[O-] 62a_100011218270_100000039755 [0,2,0,0,0,0|2,0,0]=4 18732 B15R1.26 COC(=O)CCCSc1ccc(=O)[nH]c1 62a_100000212171_100011218270 [0,2,0,0,0,0|2,0,0]=4 18733 B15R1.26 COC(=O)CCCSc1ccc(=O)[nH]c1 62a_100011218270_100000212171 [0,2,0,0,0,0|2,0,0]=4 18734 B15R1.26 COC(=O)CCCSc1ccc(cc1)Br 62a_100000752885_100011218270 [0,2,0,0,0,0|1,0,0]=3 18735 B15R1.26 COC(=O)CCCSc1ccc(cc1)Br 62a_100011218270_100000752885 [0,2,0,0,0,0|1,0,0]=3 18736 B15R1.26 COC(=O)CCCSc1ccc(cc1)C 62a_100000186775_100011218270 [0,2,0,0,0,0|1,0,0]=3 18737 B15R1.26 COC(=O)CCCSc1ccc(cc1)C 62a_100011218270_100000186775 [0,2,0,0,0,0|1,0,0]=3 18738 B15R1.26 COC(=O)CCCSc1ccc(cc1)Cl 62a_100000755918_100011218270 [0,2,0,0,0,0|1,0,0]=3 18739 B15R1.26 COC(=O)CCCSc1ccc(cc1)Cl 62a_100011218270_100000755918 [0,2,0,0,0,0|1,0,0]=3 18740 B15R1.26 COC(=O)CCCSc1ccc(cc1)F 62a_100000211213_100011218270 [0,2,0,0,0,0|1,0,0]=3 18741 B15R1.26 COC(=O)CCCSc1ccc(cc1)F 62a_100011218270_100000211213 [0,2,0,0,0,0|1,0,0]=3 18742 B15R1.26 COC(=O)CCCSc1ccc(cc1)N 62a_100000185761_100011218270 [0,2,0,0,0,0|1,0,0]=3 18743 B15R1.26 COC(=O)CCCSc1ccc(cc1)N 62a_100011218270_100000185761 [0,2,0,0,0,0|1,0,0]=3 18744 B15R1.26 COC(=O)CCCSc1ccc(cc1)O 271570a_203496583355_100000753596 [0,2,0,0,0,0|1,0,0]=3 18745 B15R1.26 COC(=O)CCCSc1ccc(cc1)O 62a_100011218270_100000185759 [0,2,0,0,0,0|1,0,0]=3 18746 B15R1.26 COC(=O)CCCSc1ccc(cn1)Br 62a_100000686858_100011218270 [0,2,0,0,0,0|2,0,0]=4 18747 B15R1.26 COC(=O)CCCSc1ccc(cn1)Br 62a_100011218270_100000686858 [0,2,0,0,0,0|2,0,0]=4 18748 B15R1.26 COC(=O)CCCSc1ccc(cn1)C 62a_100011192072_100011218270 [0,2,0,0,0,0|2,0,0]=4 18749 B15R1.26 COC(=O)CCCSc1ccc(cn1)C 62a_100011218270_100000754016 [0,2,0,0,0,0|2,0,0]=4 18750 B15R1.26 COC(=O)CCCSc1ccc(cn1)Cl 62a_100011218270_100011356976 [0,2,0,0,0,0|2,0,0]=4 18751 B15R1.26 COC(=O)CCCSc1ccc(cn1)Cl 62a_100011356976_100011218270 [0,2,0,0,0,0|2,0,0]=4 18752 B15R1.26 COC(=O)CCCSc1ccc(cn1)F 62a_100000744514_100011218270 [0,2,0,0,0,0|2,0,0]=4 18753 B15R1.26 COC(=O)CCCSc1ccc(cn1)F 62a_100011218270_100000744514 [0,2,0,0,0,0|2,0,0]=4 18754 B15R1.26 COC(=O)CCCSc1ccc(cn1)N 62a_100000737798_100011218270 [0,2,0,0,0,0|2,0,0]=4 18755 B15R1.26 COC(=O)CCCSc1ccc(cn1)N 62a_100011218270_100000737798 [0,2,0,0,0,0|2,0,0]=4 18756 B15R1.26 COC(=O)CCCSc1ccc(cn1)O 62a_100000685995_100011218270 [0,2,0,0,0,0|2,0,0]=4 18757 B15R1.26 COC(=O)CCCSc1ccc(cn1)O 62a_100011218270_100000744096 [0,2,0,0,0,0|2,0,0]=4 18758 B15R1.26 COC(=O)CCCSc1ccc(nc1)Br 62a_100009814638_100011218270 [0,2,0,0,0,0|2,0,0]=4 18759 B15R1.26 COC(=O)CCCSc1ccc(nc1)Br 62a_100011218270_100009814638 [0,2,0,0,0,0|2,0,0]=4 18760 B15R1.26 COC(=O)CCCSc1ccc(nc1)C 62a_100000751577_100011218270 [0,2,0,0,0,0|2,0,0]=4 18761 B15R1.26 COC(=O)CCCSc1ccc(nc1)C 62a_100011218270_100000751577 [0,2,0,0,0,0|2,0,0]=4 18762 B15R1.26 COC(=O)CCCSc1ccc(nc1)Cl 62a_100000034144_100011218270 [0,2,0,0,0,0|2,0,0]=4 18763 B15R1.26 COC(=O)CCCSc1ccc(nc1)Cl 62a_100011218270_100000034144 [0,2,0,0,0,0|2,0,0]=4 18764 B15R1.26 COC(=O)CCCSc1ccc(nc1)F 62a_100000042367_100011218270 [0,2,0,0,0,0|2,0,0]=4 18765 B15R1.26 COC(=O)CCCSc1ccc(nc1)F 62a_100011218270_100000042367 [0,2,0,0,0,0|2,0,0]=4 18766 B15R1.26 COC(=O)CCCSc1ccc(nc1)N 62a_100000187370_100011218270 [0,2,0,0,0,0|2,0,0]=4 18767 B15R1.26 COC(=O)CCCSc1ccc(nc1)N 62a_100011218270_100000187370 [0,2,0,0,0,0|2,0,0]=4 18768 B15R1.26 COC(=O)CCNCc1ccc(cc1)Br 2230a_100000174875_100000204255 [0,2,0,0,0,0|1,0,0]=3 18769 B15R1.26 COC(=O)CCNCc1ccc(cc1)Br 34a_100000174875_100000742370 [0,2,0,0,0,0|1,0,0]=3 18770 B15R1.26 COC(=O)CCNCc1ccc(cc1)C 2230a_100000174908_100000204255 [0,2,0,0,0,0|1,0,0]=3 18771 B15R1.26 COC(=O)CCNCc1ccc(cc1)C 34a_100000174908_100000742370 [0,2,0,0,0,0|1,0,0]=3 18772 B15R1.26 COC(=O)CCNCc1ccc(cc1)Cl 2230a_100000174871_100000204255 [0,2,0,0,0,0|1,0,0]=3 18773 B15R1.26 COC(=O)CCNCc1ccc(cc1)Cl 34a_100000174871_100000742370 [0,2,0,0,0,0|1,0,0]=3 18774 B15R1.26 COC(=O)CCNCc1ccc(cc1)F 2230a_100000174882_100000204255 [0,2,0,0,0,0|1,0,0]=3 18775 B15R1.26 COC(=O)CCNCc1ccc(cc1)F 34a_100000174882_100000742370 [0,2,0,0,0,0|1,0,0]=3 18776 B15R1.26 COC(=O)CCNCc1ccc(cc1)I 2230a_100016989417_100000204255 [0,2,0,0,0,0|1,0,0]=3 18777 B15R1.26 COC(=O)CCNCc1ccc(cc1)I 34a_100016989417_100000742370 [0,2,0,0,0,0|1,0,0]=3 18778 B15R1.26 COC(=O)CCNCc1ccc(cc1)O 34a_100000185549_100000742370 [0,2,0,0,0,0|1,0,0]=3 18779 B15R1.26 COC(=O)CCNCc1ccc(cn1)Br 34a_100015188789_100000742370 [0,2,0,0,0,0|2,0,0]=4 18780 B15R1.26 COC(=O)CCNCc1ccc(cn1)C 34a_100015187455_100000742370 [0,2,0,0,0,0|2,0,0]=4 18781 B15R1.26 COC(=O)CCNCc1ccc(cn1)Cl 34a_100000697193_100000742370 [0,2,0,0,0,0|2,0,0]=4 18782 B15R1.26 COC(=O)CCNCc1ccc(cn1)F 34a_100020620131_100000742370 [0,2,0,0,0,0|2,0,0]=4 18783 B15R1.26 COC(=O)CCNCc1ccc(nc1)Br 2230a_100009817727_100000204255 [0,2,0,0,0,0|2,0,0]=4 18784 B15R1.26 COC(=O)CCNCc1ccc(nc1)Br 34a_100009817727_100000742370 [0,2,0,0,0,0|2,0,0]=4 18785 B15R1.26 COC(=O)CCNCc1ccc(nc1)C 34a_100000740942_100000742370 [0,2,0,0,0,0|2,0,0]=4 18786 B15R1.26 COC(=O)CCNCc1ccc(nc1)Cl 2230a_100000735879_100000204255 [0,2,0,0,0,0|2,0,0]=4 18787 B15R1.26 COC(=O)CCNCc1ccc(nc1)Cl 34a_100000735879_100000742370 [0,2,0,0,0,0|2,0,0]=4 18788 B15R1.26 COC(=O)CCNCc1ccc(nc1)F 2230a_100000101913_100000204255 [0,2,0,0,0,0|2,0,0]=4 18789 B15R1.26 COC(=O)CCNCc1ccc(nc1)F 34a_100000101913_100000742370 [0,2,0,0,0,0|2,0,0]=4 18790 B15R1.26 COC(=O)CCNCc1ccc(nc1)O 2230a_100000757128_100000204255 [0,2,0,0,0,0|2,0,0]=4 18791 B15R1.26 COC(=O)CCOCc1cc[n+](cc1)C 34a_100009831711_100000742370 [0,2,0,0,0,0|2,0,0]=4 18792 B15R1.26 COC(=O)CCOCc1cc[n+](cc1)[O-] 34a_100000031831_100000742370 [0,2,0,0,0,0|2,0,0]=4 18793 B15R1.26 COC(=O)CCOCc1cc[n+](cc1)[O-] 7a_100000031831_100000204255 [0,2,0,0,0,0|2,0,0]=4 18794 B15R1.26 COC(=O)CCOCc1ccc(=O)[nH]c1 34a_100011999846_100000742370 [0,2,0,0,0,0|2,0,0]=4 18795 B15R1.26 COC(=O)CCOCc1ccc(cc1)Br 34a_100000695286_100000742370 [0,2,0,0,0,0|1,0,0]=3 18796 B15R1.26 COC(=O)CCOCc1ccc(cc1)C 34a_100011215236_100000742370 [0,2,0,0,0,0|1,0,0]=3 18797 B15R1.26 COC(=O)CCOCc1ccc(cc1)C 7a_100011215236_100000204255 [0,2,0,0,0,0|1,0,0]=3 18798 B15R1.26 COC(=O)CCOCc1ccc(cc1)Cl 34a_100000211118_100000742370 [0,2,0,0,0,0|1,0,0]=3 18799 B15R1.26 COC(=O)CCOCc1ccc(cc1)Cl 7a_100000211118_100000204255 [0,2,0,0,0,0|1,0,0]=3 18800 B15R1.26 COC(=O)CCOCc1ccc(cc1)F 34a_100000210977_100000742370 [0,2,0,0,0,0|1,0,0]=3 18801 B15R1.26 COC(=O)CCOCc1ccc(cc1)F 7a_100000210977_100000204255 [0,2,0,0,0,0|1,0,0]=3 18802 B15R1.26 COC(=O)CCOCc1ccc(cc1)I 34a_100000690907_100000742370 [0,2,0,0,0,0|1,0,0]=3 18803 B15R1.26 COC(=O)CCOCc1ccc(cc1)I 7a_100000690907_100000204255 [0,2,0,0,0,0|1,0,0]=3 18804 B15R1.26 COC(=O)CCOCc1ccc(cc1)N 34a_100011215238_100000742370 [0,2,0,0,0,0|1,0,0]=3 18805 B15R1.26 COC(=O)CCOCc1ccc(cn1)Br 34a_100000754261_100000742370 [0,2,0,0,0,0|2,0,0]=4 18806 B15R1.26 COC(=O)CCOCc1ccc(cn1)C 34a_100012001401_100000742370 [0,2,0,0,0,0|2,0,0]=4 18807 B15R1.26 COC(=O)CCOCc1ccc(cn1)Cl 34a_100000703999_100000742370 [0,2,0,0,0,0|2,0,0]=4 18808 B15R1.26 COC(=O)CCOCc1ccc(cn1)F 34a_100011999454_100000742370 [0,2,0,0,0,0|2,0,0]=4 18809 B15R1.26 COC(=O)CCOCc1ccc(cn1)N 34a_100011998161_100000742370 [0,2,0,0,0,0|2,0,0]=4 18810 B15R1.26 COC(=O)CCOCc1ccc(nc1)Br 34a_100009816760_100000742370 [0,2,0,0,0,0|2,0,0]=4 18811 B15R1.26 COC(=O)CCOCc1ccc(nc1)Br 7a_100009816760_100000204255 [0,2,0,0,0,0|2,0,0]=4 18812 B15R1.26 COC(=O)CCOCc1ccc(nc1)C 34a_100011248133_100000742370 [0,2,0,0,0,0|2,0,0]=4 18813 B15R1.26 COC(=O)CCOCc1ccc(nc1)Cl 34a_100000755211_100000742370 [0,2,0,0,0,0|2,0,0]=4 18814 B15R1.26 COC(=O)CCOCc1ccc(nc1)Cl 7a_100000755211_100000204255 [0,2,0,0,0,0|2,0,0]=4 18815 B15R1.26 COC(=O)CCOCc1ccc(nc1)F 34a_100000079959_100000742370 [0,2,0,0,0,0|2,0,0]=4 18816 B15R1.26 COC(=O)CCOCc1ccc(nc1)N 34a_100000704267_100000742370 [0,2,0,0,0,0|2,0,0]=4 18817 B15R1.26 COC(=O)CCSCc1ccc(cc1)Br 62a_100000189115_100000204255 [0,2,0,0,0,0|1,0,0]=3 18818 B15R1.26 COC(=O)CCSCc1ccc(cc1)Br 62a_100000204255_100000189115 [0,2,0,0,0,0|1,0,0]=3 18819 B15R1.26 COC(=O)CCSCc1ccc(cc1)C 62a_100000204255_100000210814 [0,2,0,0,0,0|1,0,0]=3 18820 B15R1.26 COC(=O)CCSCc1ccc(cc1)C 62a_100000210814_100000204255 [0,2,0,0,0,0|1,0,0]=3 18821 B15R1.26 COC(=O)CCSCc1ccc(cc1)Cl 62a_100000187161_100000204255 [0,2,0,0,0,0|1,0,0]=3 18822 B15R1.26 COC(=O)CCSCc1ccc(cc1)Cl 62a_100000204255_100000187161 [0,2,0,0,0,0|1,0,0]=3 18823 B15R1.26 COC(=O)CCSCc1ccc(cc1)F 62a_100000198546_100000204255 [0,2,0,0,0,0|1,0,0]=3 18824 B15R1.26 COC(=O)CCSCc1ccc(cc1)F 62a_100000204255_100000187164 [0,2,0,0,0,0|1,0,0]=3 18825 B15R1.26 COC(=O)CCSCc1ccc(cc1)I 62a_100000189116_100000204255 [0,2,0,0,0,0|1,0,0]=3 18826 B15R1.26 COC(=O)CCSCc1ccc(cc1)I 62a_100000204255_100000189116 [0,2,0,0,0,0|1,0,0]=3 18827 B15R1.26 COC(=O)CCSCc1ccc(cn1)Br 62a_100000204255_100000702658 [0,2,0,0,0,0|2,0,0]=4 18828 B15R1.26 COC(=O)CCSCc1ccc(cn1)Br 62a_100000702658_100000204255 [0,2,0,0,0,0|2,0,0]=4 18829 B15R1.26 COC(=O)CCSCc1ccc(cn1)C 62a_100000204255_100000691093 [0,2,0,0,0,0|2,0,0]=4 18830 B15R1.26 COC(=O)CCSCc1ccc(cn1)C 62a_100000691093_100000204255 [0,2,0,0,0,0|2,0,0]=4 18831 B15R1.26 COC(=O)CCSCc1ccc(cn1)Cl 62a_100000204255_100000697101 [0,2,0,0,0,0|2,0,0]=4 18832 B15R1.26 COC(=O)CCSCc1ccc(cn1)Cl 62a_100012066911_100000204255 [0,2,0,0,0,0|2,0,0]=4 18833 B15R1.26 COC(=O)CCSCc1ccc(cn1)F 62a_100000204255_100000703193 [0,2,0,0,0,0|2,0,0]=4 18834 B15R1.26 COC(=O)CCSCc1ccc(cn1)F 62a_100000703193_100000204255 [0,2,0,0,0,0|2,0,0]=4 18835 B15R1.26 COC(=O)CCSCc1ccc(nc1)Br 62a_100000204255_100009831999 [0,2,0,0,0,0|2,0,0]=4 18836 B15R1.26 COC(=O)CCSCc1ccc(nc1)Br 62a_100009831999_100000204255 [0,2,0,0,0,0|2,0,0]=4 18837 B15R1.26 COC(=O)CCSCc1ccc(nc1)C 62a_100000204255_100016987292 [0,2,0,0,0,0|2,0,0]=4 18838 B15R1.26 COC(=O)CCSCc1ccc(nc1)C 62a_100016987292_100000204255 [0,2,0,0,0,0|2,0,0]=4 18839 B15R1.26 COC(=O)CCSCc1ccc(nc1)Cl 62a_100000204255_100000735431 [0,2,0,0,0,0|2,0,0]=4 18840 B15R1.26 COC(=O)CCSCc1ccc(nc1)Cl 62a_100000735431_100000204255 [0,2,0,0,0,0|2,0,0]=4 18841 B15R1.26 COC(=O)CCSCc1ccc(nc1)F 62a_100000204255_100000099788 [0,2,0,0,0,0|2,0,0]=4 18842 B15R1.26 COC(=O)CCSCc1ccc(nc1)F 62a_100009820150_100000204255 [0,2,0,0,0,0|2,0,0]=4 18843 B15R1.26 COC(=O)CNCCc1ccc(cc1)Br 2230a_100000755846_100000747449 [0,2,0,0,0,0|1,0,0]=3 18844 B15R1.26 COC(=O)CNCCc1ccc(cc1)Br 34a_100000755846_100000747449 [0,2,0,0,0,0|1,0,0]=3 18845 B15R1.26 COC(=O)CNCCc1ccc(cc1)C 2230a_100000705350_100000747449 [0,2,0,0,0,0|1,0,0]=3 18846 B15R1.26 COC(=O)CNCCc1ccc(cc1)C 34a_100000705350_100000747449 [0,2,0,0,0,0|1,0,0]=3 18847 B15R1.26 COC(=O)CNCCc1ccc(cc1)Cl 2230a_100000185265_100000747449 [0,2,0,0,0,0|1,0,0]=3 18848 B15R1.26 COC(=O)CNCCc1ccc(cc1)Cl 34a_100000185265_100000747449 [0,2,0,0,0,0|1,0,0]=3 18849 B15R1.26 COC(=O)CNCCc1ccc(cc1)F 2230a_100000199005_100000747449 [0,2,0,0,0,0|1,0,0]=3 18850 B15R1.26 COC(=O)CNCCc1ccc(cc1)F 34a_100000199005_100000747449 [0,2,0,0,0,0|1,0,0]=3 18851 B15R1.26 COC(=O)CNCCc1ccc(cc1)O 34a_100000743037_100000747449 [0,2,0,0,0,0|1,0,0]=3 18852 B15R1.26 COC(=O)COCCc1ccc(cc1)Br 34a_100000766406_100000747449 [0,2,0,0,0,0|1,0,0]=3 18853 B15R1.26 COC(=O)COCCc1ccc(cc1)Br 7a_100000766406_100000747449 [0,2,0,0,0,0|1,0,0]=3 18854 B15R1.26 COC(=O)COCCc1ccc(cc1)C 34a_100000756670_100000747449 [0,2,0,0,0,0|1,0,0]=3 18855 B15R1.26 COC(=O)COCCc1ccc(cc1)C 7a_100000756670_100000747449 [0,2,0,0,0,0|1,0,0]=3 18856 B15R1.26 COC(=O)COCCc1ccc(cc1)Cl 34a_100011219627_100000747449 [0,2,0,0,0,0|1,0,0]=3 18857 B15R1.26 COC(=O)COCCc1ccc(cc1)Cl 7a_100011219627_100000747449 [0,2,0,0,0,0|1,0,0]=3 18858 B15R1.26 COC(=O)COCCc1ccc(cc1)F 34a_100000754732_100000747449 [0,2,0,0,0,0|1,0,0]=3 18859 B15R1.26 COC(=O)COCCc1ccc(cc1)F 7a_100000754732_100000747449 [0,2,0,0,0,0|1,0,0]=3 18860 B15R1.26 COC(=O)COCCc1ccc(cc1)I 34a_100012291149_100000747449 [0,2,0,0,0,0|1,0,0]=3 18861 B15R1.26 COC(=O)COCCc1ccc(cc1)I 7a_100012291149_100000747449 [0,2,0,0,0,0|1,0,0]=3 18862 B15R1.26 COC(=O)COCCc1ccc(cc1)N 34a_100011204434_100000747449 [0,2,0,0,0,0|1,0,0]=3 18863 B15R1.26 COC(=O)COCCc1ccc(cn1)Br 34a_100012357577_100000747449 [0,2,0,0,0,0|2,0,0]=4 18864 B15R1.26 COC(=O)COCCc1ccc(nc1)C 34a_100011815783_100000747449 [0,2,0,0,0,0|2,0,0]=4 18865 B15R1.26 COC(=O)COCCc1ccc(nc1)Cl 34a_100009880866_100000747449 [0,2,0,0,0,0|2,0,0]=4 18866 B15R1.26 COC(=O)COCCc1ccc(nc1)Cl 7a_100009880866_100000747449 [0,2,0,0,0,0|2,0,0]=4 18867 B15R1.26 COC(=O)CSCCc1ccc(cc1)Br 62a_100000747449_100011740612 [0,2,0,0,0,0|1,0,0]=3 18868 B15R1.26 COC(=O)CSCCc1ccc(cc1)Br 62a_100011740612_100000747449 [0,2,0,0,0,0|1,0,0]=3 18869 B15R1.26 COC(=O)CSCCc1ccc(cc1)C 62a_100000747449_100011713686 [0,2,0,0,0,0|1,0,0]=3 18870 B15R1.26 COC(=O)CSCCc1ccc(cc1)C 62a_100011713686_100000747449 [0,2,0,0,0,0|1,0,0]=3 18871 B15R1.26 COC(=O)CSCCc1ccc(cc1)Cl 62a_100000747449_100011713675 [0,2,0,0,0,0|1,0,0]=3 18872 B15R1.26 COC(=O)CSCCc1ccc(cc1)Cl 62a_100011713675_100000747449 [0,2,0,0,0,0|1,0,0]=3 18873 B15R1.26 COC(=O)CSCCc1ccc(cc1)F 62a_100000747449_100011217392 [0,2,0,0,0,0|1,0,0]=3 18874 B15R1.26 COC(=O)CSCCc1ccc(cc1)F 62a_100011217392_100000747449 [0,2,0,0,0,0|1,0,0]=3 18875 B15R1.26 COC(=O)CSCCc1ccc(cc1)O 62a_100000747449_100009816426 [0,2,0,0,0,0|1,0,0]=3 18876 B15R1.26 COC(=O)CSCCc1ccc(cc1)O 62a_100009816426_100000747449 [0,2,0,0,0,0|1,0,0]=3 18877 B15R1.26 COC(=O)OCSCc1ccc(cc1)Br 62a_100000189115_100000139417 [0,2,0,0,0,0|2,0,0]=4 18878 B15R1.26 COC(=O)OCSCc1ccc(cc1)C 62a_100000210814_100000139417 [0,2,0,0,0,0|2,0,0]=4 18879 B15R1.26 COC(=O)OCSCc1ccc(cc1)Cl 62a_100000187161_100000139417 [0,2,0,0,0,0|2,0,0]=4 18880 B15R1.26 COC(=O)OCSCc1ccc(cc1)F 62a_100000198546_100000139417 [0,2,0,0,0,0|2,0,0]=4 18881 B15R1.26 COC(=O)OCSCc1ccc(cc1)I 62a_100000189116_100000139417 [0,2,0,0,0,0|2,0,0]=4 18882 B15R1.26 Cc1ccc(cc1)CCCNC(=O)CO 240690a_100011236272_100000210174 [0,2,0,0,0,0|1,0,0]=3 18883 B15R1.26 Cc1ccc(cc1)CCCNC(=O)CO 527a_100011236272_100000210174 [0,2,0,0,0,0|1,0,0]=3 18884 B15R1.26 Cc1ccc(cc1)COCCC(=NO)N 34a_100000749954_100000210814 [0,2,0,0,0,0|2,0,0]=4 18885 B15R1.26 Cc1ccc(cc1)CSCCC(=O)CF 1458a_200000173737_100015361967 [0,2,0,0,0,0|2,0,0]=4 18886 B15R1.26 Cc1ccc(cc1)OCCCC(=O)CF 1458a_100000182836_100015361967 [0,2,0,0,0,0|2,0,0]=4 18887 B15R1.26 Cc1ccc(cc1)OCCNC(=O)CO 240690a_100020666663_100000210174 [0,2,0,0,0,0|2,0,0]=4 18888 B15R1.26 Cc1ccc(cc1)OCCNC(=O)CO 527a_100020666663_100000210174 [0,2,0,0,0,0|2,0,0]=4 18889 B15R1.26 Cc1ccc(cc1)SCCNC(=O)CO 240690a_100000739754_100000210174 [0,2,0,0,0,0|2,0,0]=4 18890 B15R1.26 Cc1ccc(cc1)SCCNC(=O)CO 527a_100000739754_100000210174 [0,2,0,0,0,0|2,0,0]=4 18891 B15R1.26 NC(=NO)CCOCc1ccc(cc1)Br 34a_100000749954_100000189115 [0,2,0,0,0,0|2,0,0]=4 18892 B15R1.26 NC(=NO)CCOCc1ccc(cc1)Cl 34a_100000749954_100000694040 [0,2,0,0,0,0|2,0,0]=4 18893 B15R1.26 NC(=NO)CCOCc1ccc(cc1)F 34a_100000749954_100000198546 [0,2,0,0,0,0|2,0,0]=4 18894 B15R1.26 NC(=NO)CCOCc1ccc(cc1)I 34a_100000749954_100000189116 [0,2,0,0,0,0|2,0,0]=4 18895 B15R1.26 O=C(CF)CCCCc1ccc(cc1)Br 1458a_100000741018_100015361967 [0,2,0,0,0,0|1,0,0]=3 18896 B15R1.26 O=C(CF)CCCCc1ccc(cc1)Cl 1458a_100000684701_100015361967 [0,2,0,0,0,0|1,0,0]=3 18897 B15R1.26 O=C(CF)CCCCc1ccc(cc1)F 1458a_100000703604_100015361967 [0,2,0,0,0,0|1,0,0]=3 18898 B15R1.26 O=C(CF)CCCCc1ccc(cc1)I 1458a_100000749853_100015361967 [0,2,0,0,0,0|1,0,0]=3 18899 B15R1.26 O=C(CF)CCCCc1ccc(cc1)O 1458a_100000047048_100015361967 [0,2,0,0,0,0|1,0,0]=3 18900 B15R1.26 O=C(CF)CCCOc1ccc(cc1)Br 1458a_100000183208_100015361967 [0,2,0,0,0,0|2,0,0]=4 18901 B15R1.26 O=C(CF)CCCOc1ccc(cc1)Cl 1458a_100000741531_100015361967 [0,2,0,0,0,0|2,0,0]=4 18902 B15R1.26 O=C(CF)CCCOc1ccc(cc1)F 1458a_100000735736_100015361967 [0,2,0,0,0,0|2,0,0]=4 18903 B15R1.26 O=C(CF)CCCOc1ccc(cc1)I 1458a_100000744034_100015361967 [0,2,0,0,0,0|2,0,0]=4 18904 B15R1.26 O=C(CF)CCCSc1ccc(cc1)Br 1458a_100000753536_100015361967 [0,2,0,0,0,0|2,0,0]=4 18905 B15R1.26 O=C(CF)CCCSc1ccc(cc1)Cl 1458a_100000182790_100015361967 [0,2,0,0,0,0|2,0,0]=4 18906 B15R1.26 O=C(CO)CCCCc1ccc(cc1)Br 1458a_100000210174_200012094861 [0,2,0,0,0,0|0,0,0]=2 18907 B15R1.26 O=C(CO)CCCCc1ccc(cc1)F 1458a_100000210174_100012093538 [0,2,0,0,0,0|0,0,0]=2 18908 B15R1.26 O=C(CO)CCCOc1ccc(cc1)Br 1458a_100000210174_100011259224 [0,2,0,0,0,0|1,0,0]=3 18909 B15R1.26 O=C(CO)CCCOc1ccc(cc1)F 1458a_100000210174_100000181347 [0,2,0,0,0,0|1,0,0]=3 18910 B15R1.26 O=C(CO)NCCCc1ccc(cc1)Br 240690a_100011297623_100000210174 [0,2,0,0,0,0|1,0,0]=3 18911 B15R1.26 O=C(CO)NCCCc1ccc(cc1)Br 527a_100011297623_100000210174 [0,2,0,0,0,0|1,0,0]=3 18912 B15R1.26 O=C(CO)NCCCc1ccc(cc1)Cl 240690a_100000748451_100000210174 [0,2,0,0,0,0|1,0,0]=3 18913 B15R1.26 O=C(CO)NCCCc1ccc(cc1)Cl 527a_100000748451_100000210174 [0,2,0,0,0,0|1,0,0]=3 18914 B15R1.26 O=C(CO)NCCCc1ccc(cc1)F 240690a_100025745824_100000210174 [0,2,0,0,0,0|1,0,0]=3 18915 B15R1.26 O=C(CO)NCCCc1ccc(cc1)F 527a_100025745824_100000210174 [0,2,0,0,0,0|1,0,0]=3 18916 B15R1.26 O=C(CO)NCCOc1ccc(cc1)Br 240690a_100000746992_100000210174 [0,2,0,0,0,0|2,0,0]=4 18917 B15R1.26 O=C(CO)NCCOc1ccc(cc1)Br 527a_100000746992_100000210174 [0,2,0,0,0,0|2,0,0]=4 18918 B15R1.26 O=C(CO)NCCOc1ccc(cc1)Cl 240690a_100000697975_100000210174 [0,2,0,0,0,0|2,0,0]=4 18919 B15R1.26 O=C(CO)NCCOc1ccc(cc1)Cl 527a_100000697975_100000210174 [0,2,0,0,0,0|2,0,0]=4 18920 B15R1.26 O=C(CO)NCCOc1ccc(cc1)F 240690a_100000737420_100000210174 [0,2,0,0,0,0|2,0,0]=4 18921 B15R1.26 O=C(CO)NCCOc1ccc(cc1)F 527a_100000737420_100000210174 [0,2,0,0,0,0|2,0,0]=4 18922 B15R1.26 O=C(CO)NCCSc1ccc(cc1)Br 240690a_100000184645_100000210174 [0,2,0,0,0,0|2,0,0]=4 18923 B15R1.26 O=C(CO)NCCSc1ccc(cc1)Br 527a_100000184645_100000210174 [0,2,0,0,0,0|2,0,0]=4 18924 B15R1.26 O=C(CO)NCCSc1ccc(cc1)Cl 240690a_100000174974_100000210174 [0,2,0,0,0,0|2,0,0]=4 18925 B15R1.26 O=C(CO)NCCSc1ccc(cc1)Cl 527a_100000174974_100000210174 [0,2,0,0,0,0|2,0,0]=4 18926 B15R1.112 CC(=O)C(C)COCc1ccc(cc1)Br 34a_100000032740_100000189115 [0,2,0,0,0,0|2,0,0]=4 18927 B15R1.112 CC(=O)C(C)COCc1ccc(cc1)Br 7a_100000032740_100011217064 [0,2,0,0,0,0|2,0,0]=4 18928 B15R1.112 CC(=O)C(C)COCc1ccc(cc1)C 34a_100000032740_100000210814 [0,2,0,0,0,0|2,0,0]=4 18929 B15R1.112 CC(=O)C(C)COCc1ccc(cc1)C 7a_100000032740_100000210814 [0,2,0,0,0,0|2,0,0]=4 18930 B15R1.112 CC(=O)C(C)COCc1ccc(cc1)Cl 34a_100000032740_100000694040 [0,2,0,0,0,0|2,0,0]=4 18931 B15R1.112 CC(=O)C(C)COCc1ccc(cc1)Cl 7a_100000032740_100000187161 [0,2,0,0,0,0|2,0,0]=4 18932 B15R1.112 CC(=O)C(C)COCc1ccc(cc1)F 34a_100000032740_100000198546 [0,2,0,0,0,0|2,0,0]=4 18933 B15R1.112 CC(=O)C(C)COCc1ccc(cc1)F 7a_100000032740_100000198546 [0,2,0,0,0,0|2,0,0]=4 18934 B15R1.112 CC(=O)C(C)COCc1ccc(cc1)I 34a_100000032740_100000189116 [0,2,0,0,0,0|2,0,0]=4 18935 B15R1.112 CC(=O)C(C)COCc1ccc(cc1)I 7a_100000032740_100000189116 [0,2,0,0,0,0|2,0,0]=4 18936 B15R1.112 CC(=O)C(C)NCCc1ccc(cc1)Br 2230a_100000755846_100009814033 [0,2,0,0,0,0|2,0,0]=4 18937 B15R1.112 CC(=O)C(C)NCCc1ccc(cc1)C 2230a_100000705350_100009814033 [0,2,0,0,0,0|2,0,0]=4 18938 B15R1.112 CC(=O)C(C)NCCc1ccc(cc1)Cl 2230a_100000185265_100009814033 [0,2,0,0,0,0|2,0,0]=4 18939 B15R1.112 CC(=O)C(C)NCCc1ccc(cc1)F 2230a_100000199005_100009814033 [0,2,0,0,0,0|2,0,0]=4 18940 B15R1.112 CC(=O)C(C)OCCc1ccc(cc1)Br 34a_100000212229_100011740612 [0,2,0,0,0,0|2,0,0]=4 18941 B15R1.112 CC(=O)C(C)OCCc1ccc(cc1)Br 7a_100000766406_100000179758 [0,2,0,0,0,0|2,0,0]=4 18942 B15R1.112 CC(=O)C(C)OCCc1ccc(cc1)C 34a_100000212229_100011713686 [0,2,0,0,0,0|2,0,0]=4 18943 B15R1.112 CC(=O)C(C)OCCc1ccc(cc1)C 7a_100000756670_100000179758 [0,2,0,0,0,0|2,0,0]=4 18944 B15R1.112 CC(=O)C(C)OCCc1ccc(cc1)Cl 34a_100000212229_100011713675 [0,2,0,0,0,0|2,0,0]=4 18945 B15R1.112 CC(=O)C(C)OCCc1ccc(cc1)Cl 7a_100011219627_100000179758 [0,2,0,0,0,0|2,0,0]=4 18946 B15R1.112 CC(=O)C(C)OCCc1ccc(cc1)F 34a_100000212229_100011217392 [0,2,0,0,0,0|2,0,0]=4 18947 B15R1.112 CC(=O)C(C)OCCc1ccc(cc1)F 7a_100000754732_100000179758 [0,2,0,0,0,0|2,0,0]=4 18948 B15R1.112 CC(=O)C(C)OCCc1ccc(cc1)I 7a_100012291149_100000179758 [0,2,0,0,0,0|2,0,0]=4 18949 B15R1.112 CC(=O)C(C)SCCc1ccc(cc1)Br 62a_100009814033_100011740612 [0,2,0,0,0,0|2,0,0]=4 18950 B15R1.112 CC(=O)C(C)SCCc1ccc(cc1)Br 62a_100011740612_100009814033 [0,2,0,0,0,0|2,0,0]=4 18951 B15R1.112 CC(=O)C(C)SCCc1ccc(cc1)C 62a_100009814033_100011713686 [0,2,0,0,0,0|2,0,0]=4 18952 B15R1.112 CC(=O)C(C)SCCc1ccc(cc1)C 62a_100011713686_100009814033 [0,2,0,0,0,0|2,0,0]=4 18953 B15R1.112 CC(=O)C(C)SCCc1ccc(cc1)Cl 62a_100009814033_100011713675 [0,2,0,0,0,0|2,0,0]=4 18954 B15R1.112 CC(=O)C(C)SCCc1ccc(cc1)Cl 62a_100011713675_100009814033 [0,2,0,0,0,0|2,0,0]=4 18955 B15R1.112 CC(=O)C(C)SCCc1ccc(cc1)F 62a_100009814033_100011217392 [0,2,0,0,0,0|2,0,0]=4 18956 B15R1.112 CC(=O)C(C)SCCc1ccc(cc1)F 62a_100011217392_100009814033 [0,2,0,0,0,0|2,0,0]=4 18957 B15R1.112 CC(=O)C(C)SCCc1ccc(cc1)O 62a_100009814033_100009816426 [0,2,0,0,0,0|2,0,0]=4 18958 B15R1.112 CC(=O)C(C)SCCc1ccc(cc1)O 62a_100009816426_100009814033 [0,2,0,0,0,0|2,0,0]=4 18959 B15R1.112 CC(CNCc1ccc(cc1)Br)C(=O)O 269956a_100000749485_100011217064 [0,2,0,0,0,0|1,0,0]=3 18960 B15R1.112 CC(CNCc1ccc(cc1)Cl)C(=O)O 269956a_100000749485_100000187161 [0,2,0,0,0,0|1,0,0]=3 18961 B15R1.112 CC(CNCc1ccc(cc1)F)C(=O)O 269956a_100000749485_100000198546 [0,2,0,0,0,0|1,0,0]=3 18962 B15R1.112 CC(CNCc1ccc(cc1)I)C(=O)O 269956a_100000749485_100000189116 [0,2,0,0,0,0|1,0,0]=3 18963 B15R1.112 CC(CNCc1ccc(cn1)Br)C(=O)O 269956a_100000749485_100000702658 [0,2,0,0,0,0|2,0,0]=4 18964 B15R1.112 CC(CNCc1ccc(cn1)Cl)C(=O)O 269956a_100000749485_100012066911 [0,2,0,0,0,0|2,0,0]=4 18965 B15R1.112 CC(CNCc1ccc(cn1)F)C(=O)O 269956a_100000749485_100000703193 [0,2,0,0,0,0|2,0,0]=4 18966 B15R1.112 CC(CNCc1ccc(nc1)Br)C(=O)O 269956a_100000749485_100009831999 [0,2,0,0,0,0|2,0,0]=4 18967 B15R1.112 CC(CNCc1ccc(nc1)Cl)C(=O)O 269956a_100000749485_100000735431 [0,2,0,0,0,0|2,0,0]=4 18968 B15R1.112 CC(CNCc1ccc(nc1)F)C(=O)O 269956a_100000749485_100009820150 [0,2,0,0,0,0|2,0,0]=4 18969 B15R1.112 CC(NCCc1ccc(cc1)Br)C(=O)N 2230a_100000755846_100000702099 [0,2,0,0,0,0|2,0,0]=4 18970 B15R1.112 CC(NCCc1ccc(cc1)Br)C(=O)N 34a_100000755846_100000702099 [0,2,0,0,0,0|2,0,0]=4 18971 B15R1.112 CC(NCCc1ccc(cc1)Cl)C(=O)N 2230a_100000185265_100000702099 [0,2,0,0,0,0|2,0,0]=4 18972 B15R1.112 CC(NCCc1ccc(cc1)Cl)C(=O)N 34a_100000185265_100000702099 [0,2,0,0,0,0|2,0,0]=4 18973 B15R1.112 CC(NCCc1ccc(cc1)F)C(=O)N 2230a_100000199005_100000702099 [0,2,0,0,0,0|2,0,0]=4 18974 B15R1.112 CC(NCCc1ccc(cc1)F)C(=O)N 34a_100000199005_100000702099 [0,2,0,0,0,0|2,0,0]=4 18975 B15R1.112 CC(NCCc1ccc(cc1)O)C(=O)N 34a_100000743037_100000702099 [0,2,0,0,0,0|2,0,0]=4 18976 B15R1.112 CC(OCCc1ccc(cc1)Br)C(=O)N 34a_100000766406_100000702099 [0,2,0,0,0,0|2,0,0]=4 18977 B15R1.112 CC(OCCc1ccc(cc1)Br)C(=O)N 7a_100000766406_100000702099 [0,2,0,0,0,0|2,0,0]=4 18978 B15R1.112 CC(OCCc1ccc(cc1)Cl)C(=O)N 34a_100011219627_100000702099 [0,2,0,0,0,0|2,0,0]=4 18979 B15R1.112 CC(OCCc1ccc(cc1)Cl)C(=O)N 7a_100011219627_100000702099 [0,2,0,0,0,0|2,0,0]=4 18980 B15R1.112 CC(OCCc1ccc(cc1)F)C(=O)N 34a_100000754732_100000702099 [0,2,0,0,0,0|2,0,0]=4 18981 B15R1.112 CC(OCCc1ccc(cc1)F)C(=O)N 7a_100000754732_100000702099 [0,2,0,0,0,0|2,0,0]=4 18982 B15R1.112 CC(OCCc1ccc(cc1)I)C(=O)N 34a_100012291149_100000702099 [0,2,0,0,0,0|2,0,0]=4 18983 B15R1.112 CC(OCCc1ccc(cc1)I)C(=O)N 7a_100012291149_100000702099 [0,2,0,0,0,0|2,0,0]=4 18984 B15R1.112 CC(OCCc1ccc(cc1)N)C(=O)N 34a_100011204434_100000702099 [0,2,0,0,0,0|2,0,0]=4 18985 B15R1.112 CC(SCCc1ccc(cc1)Br)C(=O)N 62a_100000702099_100011740612 [0,2,0,0,0,0|2,0,0]=4 18986 B15R1.112 CC(SCCc1ccc(cc1)Br)C(=O)N 62a_100011740612_100000702099 [0,2,0,0,0,0|2,0,0]=4 18987 B15R1.112 CC(SCCc1ccc(cc1)Cl)C(=O)N 62a_100000702099_100011713675 [0,2,0,0,0,0|2,0,0]=4 18988 B15R1.112 CC(SCCc1ccc(cc1)Cl)C(=O)N 62a_100011713675_100000702099 [0,2,0,0,0,0|2,0,0]=4 18989 B15R1.112 CC(SCCc1ccc(cc1)F)C(=O)N 62a_100000702099_100011217392 [0,2,0,0,0,0|2,0,0]=4 18990 B15R1.112 CC(SCCc1ccc(cc1)F)C(=O)N 62a_100011217392_100000702099 [0,2,0,0,0,0|2,0,0]=4 18991 B15R1.112 CC(SCCc1ccc(cc1)O)C(=O)N 62a_100000702099_100009816426 [0,2,0,0,0,0|2,0,0]=4 18992 B15R1.112 CC(SCCc1ccc(cc1)O)C(=O)N 62a_100009816426_100000702099 [0,2,0,0,0,0|2,0,0]=4 18993 B15R1.112 C[C@@H](NCCc1ccc(cc1)Br)C(=O)N 2230a_100000119354_100011740612 [0,2,0,0,0,0|2,0,0]=4 18994 B15R1.112 C[C@@H](NCCc1ccc(cc1)Br)C(=O)N 34a_100000119354_100011740612 [0,2,0,0,0,0|2,0,0]=4 18995 B15R1.112 C[C@@H](NCCc1ccc(cc1)Cl)C(=O)N 2230a_100000119354_100011713675 [0,2,0,0,0,0|2,0,0]=4 18996 B15R1.112 C[C@@H](NCCc1ccc(cc1)Cl)C(=O)N 34a_100000119354_100011713675 [0,2,0,0,0,0|2,0,0]=4 18997 B15R1.112 C[C@@H](NCCc1ccc(cc1)F)C(=O)N 2230a_100000119354_100011217392 [0,2,0,0,0,0|2,0,0]=4 18998 B15R1.112 C[C@@H](NCCc1ccc(cc1)F)C(=O)N 34a_100000119354_100011217392 [0,2,0,0,0,0|2,0,0]=4 18999 B15R1.112 C[C@@H](NCCc1ccc(cc1)O)C(=O)N 2230a_100000119354_100009816426 [0,2,0,0,0,0|2,0,0]=4 19000 B15R1.112 C[C@@H](OCCc1ccc(cc1)Br)C(=O)N 34a_100000731257_100011740612 [0,2,0,0,0,0|2,0,0]=4 19001 B15R1.112 C[C@@H](OCCc1ccc(cc1)Br)C(=O)N 7a_100000731257_100011740612 [0,2,0,0,0,0|2,0,0]=4 19002 B15R1.112 C[C@@H](OCCc1ccc(cc1)Cl)C(=O)N 34a_100000731257_100011713675 [0,2,0,0,0,0|2,0,0]=4 19003 B15R1.112 C[C@@H](OCCc1ccc(cc1)Cl)C(=O)N 7a_100000731257_100011713675 [0,2,0,0,0,0|2,0,0]=4 19004 B15R1.112 C[C@@H](OCCc1ccc(cc1)F)C(=O)N 34a_100000731257_100011217392 [0,2,0,0,0,0|2,0,0]=4 19005 B15R1.112 C[C@@H](OCCc1ccc(cc1)F)C(=O)N 7a_100000731257_100011217392 [0,2,0,0,0,0|2,0,0]=4 19006 B15R1.112 C[C@@H](OCCc1ccc(cc1)O)C(=O)N 7a_100000731257_100009816426 [0,2,0,0,0,0|2,0,0]=4 19007 B15R1.112 C[C@H](NCCc1ccc(cc1)Br)C(=O)O 269956a_100000743915_100011740612 [0,2,0,0,0,0|1,0,0]=3 19008 B15R1.112 C[C@H](NCCc1ccc(cc1)Cl)C(=O)O 269956a_100000743915_100011713675 [0,2,0,0,0,0|1,0,0]=3 19009 B15R1.112 C[C@H](NCCc1ccc(cc1)F)C(=O)O 269956a_100000743915_100011217392 [0,2,0,0,0,0|1,0,0]=3 19010 B15R1.112 C[C@H](NCCc1ccc(cc1)O)C(=O)O 269956a_100000743915_100009816426 [0,2,0,0,0,0|1,0,0]=3 19011 B15R1.112 C[C@H](OCCc1ccc(cc1)Br)C(=O)[O-] 7a_217856618621_100011740612 [0,2,0,0,0,0|1,0,1]=4 19012 B15R1.112 C[C@H](OCCc1ccc(cc1)Cl)C(=O)[O-] 7a_217856618621_100011713675 [0,2,0,0,0,0|1,0,1]=4 19013 B15R1.112 C[C@H](OCCc1ccc(cc1)F)C(=O)[O-] 7a_217856618621_100011217392 [0,2,0,0,0,0|1,0,1]=4 19014 B15R1.112 C[C@H](OCCc1ccc(cc1)O)C(=O)[O-] 7a_217856618621_100009816426 [0,2,0,0,0,0|1,0,1]=4 19015 B15R1.112 Cc1ccc(cc1)CCNC(C)C(=O)N 2230a_100000705350_100000702099 [0,2,0,0,0,0|2,0,0]=4 19016 B15R1.112 Cc1ccc(cc1)CCNC(C)C(=O)N 34a_100000705350_100000702099 [0,2,0,0,0,0|2,0,0]=4 19017 B15R1.112 Cc1ccc(cc1)CCNC(F)C(=O)N 2230a_100000705350_100009813875 [0,2,0,0,0,0|2,0,0]=4 19018 B15R1.112 Cc1ccc(cc1)CCNC(F)C(=O)N 34a_100000705350_100009813875 [0,2,0,0,0,0|2,0,0]=4 19019 B15R1.112 Cc1ccc(cc1)CCNC(F)C(=O)[O-] 34a_100000705350_100020610796 [0,2,0,0,0,0|1,0,1]=4 19020 B15R1.112 Cc1ccc(cc1)CCN[C@@H](C)C(=O)O 269956a_100000743915_100011713686 [0,2,0,0,0,0|1,0,0]=3 19021 B15R1.112 Cc1ccc(cc1)CCN[C@H](C)C(=O)N 2230a_100000119354_100011713686 [0,2,0,0,0,0|2,0,0]=4 19022 B15R1.112 Cc1ccc(cc1)CCN[C@H](C)C(=O)N 34a_100000119354_100011713686 [0,2,0,0,0,0|2,0,0]=4 19023 B15R1.112 Cc1ccc(cc1)CCOC(C)C(=O)N 34a_100000756670_100000702099 [0,2,0,0,0,0|2,0,0]=4 19024 B15R1.112 Cc1ccc(cc1)CCOC(C)C(=O)N 7a_100000756670_100000702099 [0,2,0,0,0,0|2,0,0]=4 19025 B15R1.112 Cc1ccc(cc1)CCOC(F)C(=O)N 34a_100000756670_100009813875 [0,2,0,0,0,0|2,0,0]=4 19026 B15R1.112 Cc1ccc(cc1)CCOC(F)C(=O)N 7a_100000756670_100009813875 [0,2,0,0,0,0|2,0,0]=4 19027 B15R1.112 Cc1ccc(cc1)CCOC(F)C(=O)[O-] 34a_100000756670_100020610796 [0,2,0,0,0,0|1,0,1]=4 19028 B15R1.112 Cc1ccc(cc1)CCO[C@@H](C)C(=O)[O-] 7a_217856618621_100011713686 [0,2,0,0,0,0|1,0,1]=4 19029 B15R1.112 Cc1ccc(cc1)CCO[C@H](C)C(=O)N 34a_100000731257_100011713686 [0,2,0,0,0,0|2,0,0]=4 19030 B15R1.112 Cc1ccc(cc1)CCO[C@H](C)C(=O)N 7a_100000731257_100011713686 [0,2,0,0,0,0|2,0,0]=4 19031 B15R1.112 Cc1ccc(cc1)CCSC(C)C(=O)N 62a_100000702099_100011713686 [0,2,0,0,0,0|2,0,0]=4 19032 B15R1.112 Cc1ccc(cc1)CCSC(C)C(=O)N 62a_100011713686_100000702099 [0,2,0,0,0,0|2,0,0]=4 19033 B15R1.112 Cc1ccc(cc1)CCSC(F)C(=O)N 62a_100009813875_100011713686 [0,2,0,0,0,0|2,0,0]=4 19034 B15R1.112 Cc1ccc(cc1)CCSC(F)C(=O)N 62a_100011713686_100009813875 [0,2,0,0,0,0|2,0,0]=4 19035 B15R1.112 Cc1ccc(cc1)CCSC(F)C(=O)[O-] 62a_100011713686_100020610796 [0,2,0,0,0,0|1,0,1]=4 19036 B15R1.112 Cc1ccc(cc1)CCSC(F)C(=O)[O-] 62a_100020610796_100011713686 [0,2,0,0,0,0|1,0,1]=4 19037 B15R1.112 Cc1ccc(cc1)CNCC(C)C(=O)O 269956a_100000749485_100000210814 [0,2,0,0,0,0|1,0,0]=3 19038 B15R1.112 Cc1ccc(cc1)CNCC(F)C(=O)O 269956a_100000084737_100000210814 [0,2,0,0,0,0|1,0,0]=3 19039 B15R1.112 Cc1ccc(cc1)COC[C@H](N)C(=O)N 34a_100000729942_100000210814 [0,2,0,0,0,0|2,0,0]=4 19040 B15R1.112 Cc1ccc(cn1)CNCC(C)C(=O)O 269956a_100000749485_100016987292 [0,2,0,0,0,0|2,0,0]=4 19041 B15R1.112 Cc1ccc(cn1)CNCC(F)C(=O)O 269956a_100000084737_100016987292 [0,2,0,0,0,0|2,0,0]=4 19042 B15R1.112 Cc1ccc(nc1)CNCC(C)C(=O)O 269956a_100000749485_100000691093 [0,2,0,0,0,0|2,0,0]=4 19043 B15R1.112 Cc1ccc(nc1)CNCC(F)C(=O)O 269956a_100000084737_100000691093 [0,2,0,0,0,0|2,0,0]=4 19044 B15R1.112 NC(=O)C(F)NCCc1ccc(cc1)Br 2230a_100000755846_100009813875 [0,2,0,0,0,0|2,0,0]=4 19045 B15R1.112 NC(=O)C(F)NCCc1ccc(cc1)Br 34a_100000755846_100009813875 [0,2,0,0,0,0|2,0,0]=4 19046 B15R1.112 NC(=O)C(F)NCCc1ccc(cc1)Cl 2230a_100000185265_100009813875 [0,2,0,0,0,0|2,0,0]=4 19047 B15R1.112 NC(=O)C(F)NCCc1ccc(cc1)Cl 34a_100000185265_100009813875 [0,2,0,0,0,0|2,0,0]=4 19048 B15R1.112 NC(=O)C(F)NCCc1ccc(cc1)F 2230a_100000199005_100009813875 [0,2,0,0,0,0|2,0,0]=4 19049 B15R1.112 NC(=O)C(F)NCCc1ccc(cc1)F 34a_100000199005_100009813875 [0,2,0,0,0,0|2,0,0]=4 19050 B15R1.112 NC(=O)C(F)NCCc1ccc(cc1)O 34a_100000743037_100009813875 [0,2,0,0,0,0|2,0,0]=4 19051 B15R1.112 NC(=O)C(F)OCCc1ccc(cc1)Br 34a_100000766406_100009813875 [0,2,0,0,0,0|2,0,0]=4 19052 B15R1.112 NC(=O)C(F)OCCc1ccc(cc1)Br 7a_100000766406_100009813875 [0,2,0,0,0,0|2,0,0]=4 19053 B15R1.112 NC(=O)C(F)OCCc1ccc(cc1)Cl 34a_100011219627_100009813875 [0,2,0,0,0,0|2,0,0]=4 19054 B15R1.112 NC(=O)C(F)OCCc1ccc(cc1)Cl 7a_100011219627_100009813875 [0,2,0,0,0,0|2,0,0]=4 19055 B15R1.112 NC(=O)C(F)OCCc1ccc(cc1)F 34a_100000754732_100009813875 [0,2,0,0,0,0|2,0,0]=4 19056 B15R1.112 NC(=O)C(F)OCCc1ccc(cc1)F 7a_100000754732_100009813875 [0,2,0,0,0,0|2,0,0]=4 19057 B15R1.112 NC(=O)C(F)OCCc1ccc(cc1)I 34a_100012291149_100009813875 [0,2,0,0,0,0|2,0,0]=4 19058 B15R1.112 NC(=O)C(F)OCCc1ccc(cc1)I 7a_100012291149_100009813875 [0,2,0,0,0,0|2,0,0]=4 19059 B15R1.112 NC(=O)C(F)OCCc1ccc(cc1)N 34a_100011204434_100009813875 [0,2,0,0,0,0|2,0,0]=4 19060 B15R1.112 NC(=O)C(F)SCCc1ccc(cc1)Br 62a_100009813875_100011740612 [0,2,0,0,0,0|2,0,0]=4 19061 B15R1.112 NC(=O)C(F)SCCc1ccc(cc1)Br 62a_100011740612_100009813875 [0,2,0,0,0,0|2,0,0]=4 19062 B15R1.112 NC(=O)C(F)SCCc1ccc(cc1)Cl 62a_100009813875_100011713675 [0,2,0,0,0,0|2,0,0]=4 19063 B15R1.112 NC(=O)C(F)SCCc1ccc(cc1)Cl 62a_100011713675_100009813875 [0,2,0,0,0,0|2,0,0]=4 19064 B15R1.112 NC(=O)C(F)SCCc1ccc(cc1)F 62a_100009813875_100011217392 [0,2,0,0,0,0|2,0,0]=4 19065 B15R1.112 NC(=O)C(F)SCCc1ccc(cc1)F 62a_100011217392_100009813875 [0,2,0,0,0,0|2,0,0]=4 19066 B15R1.112 NC(=O)C(F)SCCc1ccc(cc1)O 62a_100009813875_100009816426 [0,2,0,0,0,0|2,0,0]=4 19067 B15R1.112 NC(=O)C(F)SCCc1ccc(cc1)O 62a_100009816426_100009813875 [0,2,0,0,0,0|2,0,0]=4 19068 B15R1.112 NC(=O)[C@@H](N)COCc1ccc(cc1)Br 34a_100000729942_100000189115 [0,2,0,0,0,0|2,0,0]=4 19069 B15R1.112 NC(=O)[C@@H](N)COCc1ccc(cc1)Cl 34a_100000729942_100000694040 [0,2,0,0,0,0|2,0,0]=4 19070 B15R1.112 NC(=O)[C@@H](N)COCc1ccc(cc1)F 34a_100000729942_100000198546 [0,2,0,0,0,0|2,0,0]=4 19071 B15R1.112 NC(=O)[C@@H](N)COCc1ccc(cc1)I 34a_100000729942_100000189116 [0,2,0,0,0,0|2,0,0]=4 19072 B15R1.112 Nc1ccc(cc1)CCOC(F)C(=O)[O-] 34a_100011204434_100020610796 [0,2,0,0,0,0|1,0,1]=4 19073 B15R1.112 O=C(O)C(F)CNCc1ccc(cc1)Br 269956a_100000084737_100011217064 [0,2,0,0,0,0|1,0,0]=3 19074 B15R1.112 O=C(O)C(F)CNCc1ccc(cc1)Cl 269956a_100000084737_100000187161 [0,2,0,0,0,0|1,0,0]=3 19075 B15R1.112 O=C(O)C(F)CNCc1ccc(cc1)F 269956a_100000084737_100000198546 [0,2,0,0,0,0|1,0,0]=3 19076 B15R1.112 O=C(O)C(F)CNCc1ccc(cc1)I 269956a_100000084737_100000189116 [0,2,0,0,0,0|1,0,0]=3 19077 B15R1.112 O=C(O)C(F)CNCc1ccc(cn1)Br 269956a_100000084737_100000702658 [0,2,0,0,0,0|2,0,0]=4 19078 B15R1.112 O=C(O)C(F)CNCc1ccc(cn1)Cl 269956a_100000084737_100012066911 [0,2,0,0,0,0|2,0,0]=4 19079 B15R1.112 O=C(O)C(F)CNCc1ccc(cn1)F 269956a_100000084737_100000703193 [0,2,0,0,0,0|2,0,0]=4 19080 B15R1.112 O=C(O)C(F)CNCc1ccc(nc1)Br 269956a_100000084737_100009831999 [0,2,0,0,0,0|2,0,0]=4 19081 B15R1.112 O=C(O)C(F)CNCc1ccc(nc1)Cl 269956a_100000084737_100000735431 [0,2,0,0,0,0|2,0,0]=4 19082 B15R1.112 O=C(O)C(F)CNCc1ccc(nc1)F 269956a_100000084737_100009820150 [0,2,0,0,0,0|2,0,0]=4 19083 B15R1.112 O=C([O-])C(F)NCCc1ccc(cc1)Br 34a_100000755846_100020610796 [0,2,0,0,0,0|1,0,1]=4 19084 B15R1.112 O=C([O-])C(F)NCCc1ccc(cc1)Cl 34a_100000185265_100020610796 [0,2,0,0,0,0|1,0,1]=4 19085 B15R1.112 O=C([O-])C(F)NCCc1ccc(cc1)F 34a_100000199005_100020610796 [0,2,0,0,0,0|1,0,1]=4 19086 B15R1.112 O=C([O-])C(F)NCCc1ccc(cc1)O 34a_100000743037_100020610796 [0,2,0,0,0,0|1,0,1]=4 19087 B15R1.112 O=C([O-])C(F)OCCc1ccc(cc1)Br 34a_100000766406_100020610796 [0,2,0,0,0,0|1,0,1]=4 19088 B15R1.112 O=C([O-])C(F)OCCc1ccc(cc1)Cl 34a_100011219627_100020610796 [0,2,0,0,0,0|1,0,1]=4 19089 B15R1.112 O=C([O-])C(F)OCCc1ccc(cc1)F 34a_100000754732_100020610796 [0,2,0,0,0,0|1,0,1]=4 19090 B15R1.112 O=C([O-])C(F)OCCc1ccc(cc1)I 34a_100012291149_100020610796 [0,2,0,0,0,0|1,0,1]=4 19091 B15R1.112 O=C([O-])C(F)SCCc1ccc(cc1)Br 62a_100011740612_100020610796 [0,2,0,0,0,0|1,0,1]=4 19092 B15R1.112 O=C([O-])C(F)SCCc1ccc(cc1)Br 62a_100020610796_100011740612 [0,2,0,0,0,0|1,0,1]=4 19093 B15R1.112 O=C([O-])C(F)SCCc1ccc(cc1)Cl 62a_100011713675_100020610796 [0,2,0,0,0,0|1,0,1]=4 19094 B15R1.112 O=C([O-])C(F)SCCc1ccc(cc1)Cl 62a_100020610796_100011713675 [0,2,0,0,0,0|1,0,1]=4 19095 B15R1.112 O=C([O-])C(F)SCCc1ccc(cc1)F 62a_100011217392_100020610796 [0,2,0,0,0,0|1,0,1]=4 19096 B15R1.112 O=C([O-])C(F)SCCc1ccc(cc1)F 62a_100020610796_100011217392 [0,2,0,0,0,0|1,0,1]=4 19097 B15R1.112 O=C([O-])C(F)SCCc1ccc(cc1)O 62a_100009816426_100020610796 [0,2,0,0,0,0|1,0,1]=4 19098 B15R1.112 O=C([O-])C(F)SCCc1ccc(cc1)O 62a_100020610796_100009816426 [0,2,0,0,0,0|1,0,1]=4 19099 B15R1.870 CN(CCc1ccc(cc1)Br)CC(=O)N 2230a_100000739694_100011740612 [0,2,0,0,0,0|2,0,0]=4 19100 B15R1.870 CN(CCc1ccc(cc1)Br)CC(=O)N 2230a_100000752880_100000747473 [0,2,0,0,0,0|2,0,0]=4 19101 B15R1.870 CN(CCc1ccc(cc1)Br)CC(=O)N 269982a_100000752880_100000187820 [0,2,0,0,0,0|2,0,0]=4 19102 B15R1.870 CN(CCc1ccc(cc1)Br)CC(=O)N 34a_100000752880_100000187820 [0,2,0,0,0,0|2,0,0]=4 19103 B15R1.870 CN(CCc1ccc(cc1)Br)CC(=O)O 269956a_100000746989_100011740612 [0,2,0,0,0,0|1,0,0]=3 19104 B15R1.870 CN(CCc1ccc(cc1)Br)CC(=O)[O-] 269982a_100000752880_100020667443 [0,2,0,0,0,0|1,0,1]=4 19105 B15R1.870 CN(CCc1ccc(cc1)Br)CC(=O)[O-] 34a_100000752880_100020667443 [0,2,0,0,0,0|1,0,1]=4 19106 B15R1.870 CN(CCc1ccc(cc1)Cl)CC(=O)N 2230a_100000698262_100000747473 [0,2,0,0,0,0|2,0,0]=4 19107 B15R1.870 CN(CCc1ccc(cc1)Cl)CC(=O)N 2230a_100000739694_100011713675 [0,2,0,0,0,0|2,0,0]=4 19108 B15R1.870 CN(CCc1ccc(cc1)Cl)CC(=O)N 269982a_100000698262_100000187820 [0,2,0,0,0,0|2,0,0]=4 19109 B15R1.870 CN(CCc1ccc(cc1)Cl)CC(=O)N 34a_100000698262_100000187820 [0,2,0,0,0,0|2,0,0]=4 19110 B15R1.870 CN(CCc1ccc(cc1)Cl)CC(=O)O 269956a_100000746989_100011713675 [0,2,0,0,0,0|1,0,0]=3 19111 B15R1.870 CN(CCc1ccc(cc1)Cl)CC(=O)[O-] 269982a_100000698262_100020667443 [0,2,0,0,0,0|1,0,1]=4 19112 B15R1.870 CN(CCc1ccc(cc1)Cl)CC(=O)[O-] 34a_100000698262_100020667443 [0,2,0,0,0,0|1,0,1]=4 19113 B15R1.870 CN(CCc1ccc(cc1)F)CC(=O)N 2230a_100000739694_100011217392 [0,2,0,0,0,0|2,0,0]=4 19114 B15R1.870 CN(CCc1ccc(cc1)F)CC(=O)N 2230a_100102946585_100000747473 [0,2,0,0,0,0|2,0,0]=4 19115 B15R1.870 CN(CCc1ccc(cc1)F)CC(=O)N 269982a_100102946585_100000187820 [0,2,0,0,0,0|2,0,0]=4 19116 B15R1.870 CN(CCc1ccc(cc1)F)CC(=O)N 34a_100102946585_100000187820 [0,2,0,0,0,0|2,0,0]=4 19117 B15R1.870 CN(CCc1ccc(cc1)F)CC(=O)O 269956a_100000746989_100011217392 [0,2,0,0,0,0|1,0,0]=3 19118 B15R1.870 CN(CCc1ccc(cc1)F)CC(=O)[O-] 269982a_100102946585_100020667443 [0,2,0,0,0,0|1,0,1]=4 19119 B15R1.870 CN(CCc1ccc(cc1)F)CC(=O)[O-] 34a_100102946585_100020667443 [0,2,0,0,0,0|1,0,1]=4 19120 B15R1.870 CN(CCc1ccc(cc1)O)CC(=O)N 2230a_100000739694_100009816426 [0,2,0,0,0,0|2,0,0]=4 19121 B15R1.870 CN(CCc1ccc(cc1)O)CC(=O)N 2230a_100016989440_100000747473 [0,2,0,0,0,0|2,0,0]=4 19122 B15R1.870 CN(CCc1ccc(cc1)O)CC(=O)N 269982a_100016989440_100000187820 [0,2,0,0,0,0|2,0,0]=4 19123 B15R1.870 CN(CCc1ccc(cc1)O)CC(=O)N 34a_100016989440_100000187820 [0,2,0,0,0,0|2,0,0]=4 19124 B15R1.870 CN(CCc1ccc(cc1)O)CC(=O)O 269956a_100000746989_100009816426 [0,2,0,0,0,0|1,0,0]=3 19125 B15R1.870 CN(CCc1ccc(cc1)O)CC(=O)[O-] 269982a_100016989440_100020667443 [0,2,0,0,0,0|1,0,1]=4 19126 B15R1.870 CN(CCc1ccc(cc1)O)CC(=O)[O-] 34a_100016989440_100020667443 [0,2,0,0,0,0|1,0,1]=4 19127 B15R1.870 Cc1ccc(cc1)CCC(=O)CC(=O)N 1458a_100000234883_100000187820 [0,2,0,0,0,0|1,0,1]=4 19128 B15R1.870 Cc1ccc(cc1)CCC(=O)CC(=O)N 1458a_100134613110_100011713686 [0,2,0,0,0,0|1,0,1]=4 19129 B15R1.870 Cc1ccc(cc1)CCC(=O)CC(=O)[O-] 1458a_100000234883_100020667443 [0,2,0,0,0,0|0,0,2]=4 19130 B15R1.870 Cc1ccc(cc1)CCN(C)CC(=O)N 2230a_100000739694_100011713686 [0,2,0,0,0,0|2,0,0]=4 19131 B15R1.870 Cc1ccc(cc1)CCN(C)CC(=O)O 269956a_100000746989_100011713686 [0,2,0,0,0,0|1,0,0]=3 19132 B15R1.870 NC(=O)CC(=O)CCc1ccc(cc1)Br 1458a_100000217147_100000187820 [0,2,0,0,0,0|1,0,1]=4 19133 B15R1.870 NC(=O)CC(=O)CCc1ccc(cc1)Br 1458a_100134613110_100011740612 [0,2,0,0,0,0|1,0,1]=4 19134 B15R1.870 NC(=O)CC(=O)CCc1ccc(cc1)Cl 1458a_100000235379_100000187820 [0,2,0,0,0,0|1,0,1]=4 19135 B15R1.870 NC(=O)CC(=O)CCc1ccc(cc1)Cl 1458a_100134613110_100011713675 [0,2,0,0,0,0|1,0,1]=4 19136 B15R1.870 NC(=O)CC(=O)CCc1ccc(cc1)F 1458a_100000198493_100000187820 [0,2,0,0,0,0|1,0,1]=4 19137 B15R1.870 NC(=O)CC(=O)CCc1ccc(cc1)F 1458a_100134613110_100011217392 [0,2,0,0,0,0|1,0,1]=4 19138 B15R1.870 NC(=O)CC(=O)CCc1ccc(cc1)I 1458a_100011217499_100000187820 [0,2,0,0,0,0|1,0,1]=4 19139 B15R1.870 NC(=O)CC(=O)CCc1ccc(cc1)O 1458a_100000742835_100000187820 [0,2,0,0,0,0|1,0,1]=4 19140 B15R1.870 NC(=O)CC(=O)CCc1ccc(cc1)O 1458a_100134613110_100009816426 [0,2,0,0,0,0|1,0,1]=4 19141 B15R1.870 O=C([O-])CC(=O)CCc1ccc(cc1)Br 1458a_100000217147_100020667443 [0,2,0,0,0,0|0,0,2]=4 19142 B15R1.870 O=C([O-])CC(=O)CCc1ccc(cc1)Cl 1458a_100000235379_100020667443 [0,2,0,0,0,0|0,0,2]=4 19143 B15R1.870 O=C([O-])CC(=O)CCc1ccc(cc1)F 1458a_100000198493_100020667443 [0,2,0,0,0,0|0,0,2]=4 19144 B15R1.870 O=C([O-])CC(=O)CCc1ccc(cc1)I 1458a_100011217499_100020667443 [0,2,0,0,0,0|0,0,2]=4 19145 B15R1.870 O=C([O-])CC(=O)CCc1ccc(cc1)O 1458a_100000742835_100020667443 [0,2,0,0,0,0|0,0,2]=4 19146 B15R1.741 C#CC(=O)CC(=O)CCc1ccccc1 1458a_100000211873_100012361361 [0,2,0,0,0,0|1,0,1]=4 19147 B15R1.741 C=CC(=O)CC(=O)CCc1ccccc1 1458a_100000185746_100012361361 [0,2,0,0,0,0|1,0,1]=4 19148 B15R1.741 C=CC(=O)NC(C)CCc1ccccc1 1626a_100000210798_100000185746 [0,2,0,0,0,0|2,0,0]=4 19149 B15R1.741 C=CC(=O)NC(C)CCc1ccccc1 240690a_100000210798_200121576911 [0,2,0,0,0,0|2,0,0]=4 19150 B15R1.741 CC(CCc1ccccc1)NC(=O)CO 240690a_100000210798_100000210174 [0,2,0,0,0,0|1,0,0]=3 19151 B15R1.741 CC(CCc1ccccc1)NC(=O)CO 527a_100000210798_100000210174 [0,2,0,0,0,0|1,0,0]=3 19152 B15R1.741 CC(COc1ccccc1)NC(=O)CO 240690a_100000746794_100000210174 [0,2,0,0,0,0|2,0,0]=4 19153 B15R1.741 CC(COc1ccccc1)NC(=O)CO 527a_100000746794_100000210174 [0,2,0,0,0,0|2,0,0]=4 19154 B15R1.741 CCC(=O)CC(=O)CCc1ccccc1 1458a_100000185753_100000747405 [0,2,0,0,0,0|1,0,1]=4 19155 B15R1.741 CCC(=O)CC(=O)CCc1ccccc1 1458a_100000210414_100012361361 [0,2,0,0,0,0|1,0,1]=4 19156 B15R1.741 CCC(=O)CN(C)CCc1ccccc1 269982a_100000207497_100000747405 [0,2,0,0,0,0|2,0,0]=4 19157 B15R1.741 CCC(=O)NC(C)CCc1ccccc1 11a_100000210798_100000210414 [0,2,0,0,0,0|2,0,0]=4 19158 B15R1.741 CCC(=O)NC(C)CCc1ccccc1 1626a_100000210798_100000210414 [0,2,0,0,0,0|2,0,0]=4 19159 B15R1.741 CCC(=O)NC(C)CCc1ccccc1 240690a_100000210798_100000210414 [0,2,0,0,0,0|2,0,0]=4 19160 B15R1.741 CCC(=O)NC(C)CCc1ccccc1 527a_100000210798_100000210414 [0,2,0,0,0,0|2,0,0]=4 19161 B15R1.741 CNC(=O)CC(=O)CCc1ccccc1 1458a_100000185753_100000183359 [0,2,0,0,0,0|1,0,1]=4 19162 B15R1.741 CNC(=O)CN(C)CCc1ccccc1 2230a_100000189611_100000765856 [0,2,0,0,0,0|2,0,0]=4 19163 B15R1.741 CNC(=O)CN(C)CCc1ccccc1 2230a_100000207497_100000183359 [0,2,0,0,0,0|2,0,0]=4 19164 B15R1.741 CNC(=O)CN(C)CCc1ccccc1 269982a_100000207497_100000183359 [0,2,0,0,0,0|2,0,0]=4 19165 B15R1.741 CNC(=O)NC(C)CCc1ccccc1 2708a_100000210798_106832991635 [0,2,0,0,0,0|2,0,0]=4 19166 B15R1.741 CNC(=O)NC(C)CCc1ccccc1 2708a_100102657272_100000210798 [0,2,0,0,0,0|2,0,0]=4 19167 B15R1.741 CNC(=O)NC(C)CCc1ccccc1 273464a_100000210798_100102657272 [0,2,0,0,0,0|2,0,0]=4 19168 B15R1.741 CNC(=O)NC(C)CCc1ccccc1 273464a_100102657272_100000210798 [0,2,0,0,0,0|2,0,0]=4 19169 B15R1.741 CNC(=O)NC(C)CCc1ccccc1 512a_100000210798_100102657272 [0,2,0,0,0,0|2,0,0]=4 19170 B15R1.741 CNC(=O)NC(C)CCc1ccccc1 512a_106832991638_100000210798 [0,2,0,0,0,0|2,0,0]=4 19171 B15R1.741 COC(=O)CC(=O)CCc1ccccc1 1458a_100000185753_100000747449 [0,2,0,0,0,0|0,0,1]=3 19172 B15R1.741 COC(=O)CC(=O)CCc1ccccc1 1458a_100000211351_100000765856 [0,2,0,0,0,0|0,0,1]=3 19173 B15R1.741 COC(=O)CC(=O)CCc1ccccn1 1458a_100000211351_100015183660 [0,2,0,0,0,0|1,0,1]=4 19174 B15R1.741 COC(=O)CC(=O)CCc1ccccn1 1458a_100015195070_100000747449 [0,2,0,0,0,0|1,0,1]=4 19175 B15R1.741 COC(=O)CC(=O)CCc1cccnc1 1458a_100000198484_100000747449 [0,2,0,0,0,0|1,0,1]=4 19176 B15R1.741 COC(=O)CC(=O)CCc1cccnc1 1458a_100000211351_200011713674 [0,2,0,0,0,0|1,0,1]=4 19177 B15R1.741 COC(=O)CC(=O)CCc1ccncc1 1458a_100000211351_100000723409 [0,2,0,0,0,0|1,0,1]=4 19178 B15R1.741 COC(=O)CC(=O)CCc1ccncc1 1458a_100011225043_100000747449 [0,2,0,0,0,0|1,0,1]=4 19179 B15R1.741 COC(=O)CC(=O)COc1ccccc1 1458a_100000186222_100000747449 [0,2,0,0,0,0|1,0,1]=4 19180 B15R1.741 COC(=O)CC(=O)CSc1ccccc1 1458a_100000211596_100000747449 [0,2,0,0,0,0|1,0,1]=4 19181 B15R1.741 COC(=O)CC(=O)CSc1ccccc1 62a_100000210525_100000041952 [0,2,0,0,0,0|1,0,1]=4 19182 B15R1.741 COC(=O)CC(=O)CSc1ccccc1 62a_100000719477_100000210525 [0,2,0,0,0,0|1,0,1]=4 19183 B15R1.741 COC(=O)CC(=O)NCc1ccccc1 240690a_100015324214_100000211351 [0,2,0,0,0,0|1,0,1]=4 19184 B15R1.741 COC(=O)CC(C)NCc1ccccc1 2230a_100015324214_100009817358 [0,2,0,0,0,0|1,0,0]=3 19185 B15R1.741 COC(=O)CC(C)NCc1ccccc1 34a_100015324214_100009817358 [0,2,0,0,0,0|1,0,0]=3 19186 B15R1.741 COC(=O)CC(C)OCc1ccccc1 34a_100000210790_100009817358 [0,2,0,0,0,0|1,0,0]=3 19187 B15R1.741 COC(=O)CC(C)OCc1ccccc1 7a_100000210790_100009817358 [0,2,0,0,0,0|1,0,0]=3 19188 B15R1.741 COC(=O)CC(C)SCc1ccccc1 62a_100000211182_100009817358 [0,2,0,0,0,0|1,0,0]=3 19189 B15R1.741 COC(=O)CC(C)SCc1ccccc1 62a_100009817358_100015291786 [0,2,0,0,0,0|1,0,0]=3 19190 B15R1.741 COC(=O)CC(C)SCc1ccccn1 62a_100000721315_100009817358 [0,2,0,0,0,0|2,0,0]=4 19191 B15R1.741 COC(=O)CC(C)SCc1ccccn1 62a_100009817358_100000721315 [0,2,0,0,0,0|2,0,0]=4 19192 B15R1.741 COC(=O)CC(C)SCc1cccnc1 62a_100000741622_100009817358 [0,2,0,0,0,0|2,0,0]=4 19193 B15R1.741 COC(=O)CC(C)SCc1cccnc1 62a_100009817358_100000741622 [0,2,0,0,0,0|2,0,0]=4 19194 B15R1.741 COC(=O)CC(C)SCc1ccncc1 62a_100009817358_100015193705 [0,2,0,0,0,0|2,0,0]=4 19195 B15R1.741 COC(=O)CC(C)SCc1ccncc1 62a_100015193705_100009817358 [0,2,0,0,0,0|2,0,0]=4 19196 B15R1.741 COC(=O)CN(C)CCc1ccccc1 2230a_100000198492_100000765856 [0,2,0,0,0,0|1,0,0]=3 19197 B15R1.741 COC(=O)CN(C)CCc1ccccc1 2230a_100000207497_100000747449 [0,2,0,0,0,0|1,0,0]=3 19198 B15R1.741 COC(=O)CN(C)CCc1ccccc1 269982a_100000207497_100000747449 [0,2,0,0,0,0|1,0,0]=3 19199 B15R1.741 COC(=O)CN(C)CCc1ccccn1 2230a_100000198492_100015183660 [0,2,0,0,0,0|2,0,0]=4 19200 B15R1.741 COC(=O)CN(C)CCc1ccccn1 2230a_100000737206_100000747449 [0,2,0,0,0,0|2,0,0]=4 19201 B15R1.741 COC(=O)CN(C)CCc1ccccn1 269982a_100000737206_100000747449 [0,2,0,0,0,0|2,0,0]=4 19202 B15R1.741 COC(=O)CN(C)CCc1cccnc1 2230a_100000198492_200011713674 [0,2,0,0,0,0|2,0,0]=4 19203 B15R1.741 COC(=O)CN(C)CCc1cccnc1 2230a_100000763209_100000747449 [0,2,0,0,0,0|2,0,0]=4 19204 B15R1.741 COC(=O)CN(C)CCc1cccnc1 269982a_100000763209_100000747449 [0,2,0,0,0,0|2,0,0]=4 19205 B15R1.741 COC(=O)CN(C)CCc1ccncc1 2230a_100000198492_100000723409 [0,2,0,0,0,0|2,0,0]=4 19206 B15R1.741 COC(=O)CN(C)CCc1ccncc1 2230a_100000742850_100000747449 [0,2,0,0,0,0|2,0,0]=4 19207 B15R1.741 COC(=O)CN(C)CCc1ccncc1 269982a_100000742850_100000747449 [0,2,0,0,0,0|2,0,0]=4 19208 B15R1.741 COC(=O)CN(C)CSc1ccccc1 2230a_100000198492_100011218342 [0,2,0,0,0,0|2,0,0]=4 19209 B15R1.741 COC(=O)C[C@@H](O)CNc1ccccc1 34a_100000106764_100000754131 [0,2,0,0,0,0|1,0,0]=3 19210 B15R1.741 COC(=O)C[C@@H](O)COc1ccccc1 34a_100000210340_100000754131 [0,2,0,0,0,0|1,0,0]=3 19211 B15R1.741 COC(=O)C[C@@H](O)COc1ccccc1 7a_100000210340_100000754131 [0,2,0,0,0,0|1,0,0]=3 19212 B15R1.741 COC(=O)C[C@@H](O)COc1cccnc1 34a_100000210849_100000754131 [0,2,0,0,0,0|2,0,0]=4 19213 B15R1.741 COC(=O)C[C@@H](O)COc1cccnc1 7a_100000210849_100000754131 [0,2,0,0,0,0|2,0,0]=4 19214 B15R1.741 COC(=O)C[C@@H](O)COc1ccncc1 34a_100000212176_100000754131 [0,2,0,0,0,0|2,0,0]=4 19215 B15R1.741 COC(=O)C[C@@H](O)CSc1ccccc1 62a_100000719477_100000754131 [0,2,0,0,0,0|1,0,0]=3 19216 B15R1.741 COC(=O)C[C@@H](O)CSc1ccccc1 62a_100000754131_100000041952 [0,2,0,0,0,0|1,0,0]=3 19217 B15R1.741 COC(=O)C[C@@H](O)CSc1ccccn1 62a_100000754131_100011216584 [0,2,0,0,0,0|2,0,0]=4 19218 B15R1.741 COC(=O)C[C@@H](O)CSc1ccccn1 62a_100011216584_100000754131 [0,2,0,0,0,0|2,0,0]=4 19219 B15R1.741 COC(=O)C[C@@H](O)CSc1cccnc1 62a_100000210063_100000754131 [0,2,0,0,0,0|2,0,0]=4 19220 B15R1.741 COC(=O)C[C@@H](O)CSc1cccnc1 62a_100000754131_100000210063 [0,2,0,0,0,0|2,0,0]=4 19221 B15R1.741 COC(=O)C[C@@H](O)CSc1ccncc1 62a_100000728582_100000754131 [0,2,0,0,0,0|2,0,0]=4 19222 B15R1.741 COC(=O)C[C@@H](O)CSc1ccncc1 62a_100000754131_100000728582 [0,2,0,0,0,0|2,0,0]=4 19223 B15R1.741 O=C(CO)CC(=O)CCc1ccccc1 1458a_100000210174_100012361361 [0,2,0,0,0,0|0,0,1]=3 19224 B15R1.741 O=C(CO)CC(=O)NCc1ccccc1 1458a_100000210174_100000183539 [0,2,0,0,0,0|1,0,1]=4 19225 B15R1.741 O=C(CO)CC(=O)OCc1ccccc1 1458a_100000210174_100000753625 [0,2,0,0,0,0|1,0,1]=4 19226 B15R1.778 C#CCC(=O)CCCCc1ccccc1 1458a_100011215911_100000184674 [0,2,0,0,0,0|1,0,0]=3 19227 B15R1.778 C#CCC(=O)CCCCc1ccccc1 1458a_100011220946_100000701786 [0,2,0,0,0,0|1,0,0]=3 19228 B15R1.778 C#CCC(=O)CCCCc1ccncc1 1458a_100011220946_100020630000 [0,2,0,0,0,0|2,0,0]=4 19229 B15R1.778 C#CCC(=O)CCCOc1ccccc1 1458a_100000212059_100000184674 [0,2,0,0,0,0|2,0,0]=4 19230 B15R1.778 C#CCC(=O)CCCOc1ccccc1 1458a_100011220946_100000199009 [0,2,0,0,0,0|2,0,0]=4 19231 B15R1.778 C#CCC(=O)CCCSc1ccccc1 1458a_100000182835_100000184674 [0,2,0,0,0,0|2,0,0]=4 19232 B15R1.778 C#CCC(=O)CCCSc1ccccc1 1458a_100011220946_200011203293 [0,2,0,0,0,0|2,0,0]=4 19233 B15R1.778 C#CCC(=O)CCOCc1ccccc1 1458a_100000743319_100000184674 [0,2,0,0,0,0|2,0,0]=4 19234 B15R1.778 C#CCC(=O)CCOCc1ccccc1 1458a_100011220946_100000234347 [0,2,0,0,0,0|2,0,0]=4 19235 B15R1.778 C#CCC(=O)CCSCc1ccccc1 1458a_100000173759_100000184674 [0,2,0,0,0,0|2,0,0]=4 19236 B15R1.778 C#CCC(=O)CCSCc1ccccc1 1458a_100011220946_200011297719 [0,2,0,0,0,0|2,0,0]=4 19237 B15R1.778 C#CCC(=O)NCCCc1ccccc1 1626a_100000211184_100011220946 [0,2,0,0,0,0|2,0,0]=4 19238 B15R1.778 C#CCC(=O)NCCCc1ccccc1 527a_100000211184_100011220946 [0,2,0,0,0,0|2,0,0]=4 19239 B15R1.778 C=CCC(=O)CCCCc1ccccc1 1458a_100000210193_100000701786 [0,2,0,0,0,0|1,0,0]=3 19240 B15R1.778 C=CCC(=O)CCCCc1ccccc1 1458a_100011215911_100000210623 [0,2,0,0,0,0|1,0,0]=3 19241 B15R1.778 C=CCC(=O)CCCCc1ccncc1 1458a_100000210193_100020630000 [0,2,0,0,0,0|2,0,0]=4 19242 B15R1.778 C=CCC(=O)CCCOc1ccccc1 1458a_100000210193_100000199009 [0,2,0,0,0,0|2,0,0]=4 19243 B15R1.778 C=CCC(=O)CCCOc1ccccc1 1458a_100000212059_100000210623 [0,2,0,0,0,0|2,0,0]=4 19244 B15R1.778 C=CCC(=O)CCCSc1ccccc1 1458a_100000182835_100000210623 [0,2,0,0,0,0|2,0,0]=4 19245 B15R1.778 C=CCC(=O)CCCSc1ccccc1 1458a_100000210193_200011203293 [0,2,0,0,0,0|2,0,0]=4 19246 B15R1.778 C=CCC(=O)CCOCc1ccccc1 1458a_100000210193_100000234347 [0,2,0,0,0,0|2,0,0]=4 19247 B15R1.778 C=CCC(=O)CCOCc1ccccc1 1458a_100000743319_100000210623 [0,2,0,0,0,0|2,0,0]=4 19248 B15R1.778 C=CCC(=O)CCSCc1ccccc1 1458a_100000173759_100000210623 [0,2,0,0,0,0|2,0,0]=4 19249 B15R1.778 C=CCC(=O)CCSCc1ccccc1 1458a_100000210193_200011297719 [0,2,0,0,0,0|2,0,0]=4 19250 B15R1.778 C=CCC(=O)NCCCc1ccccc1 11a_100000211184_100000210193 [0,2,0,0,0,0|2,0,0]=4 19251 B15R1.778 C=CCC(=O)NCCCc1ccccc1 1626a_100000211184_100000210193 [0,2,0,0,0,0|2,0,0]=4 19252 B15R1.778 C=CCC(=O)NCCCc1ccccc1 240690a_100000211184_100000210193 [0,2,0,0,0,0|2,0,0]=4 19253 B15R1.778 C=CCC(=O)NCCCc1ccccc1 527a_100000211184_100000210193 [0,2,0,0,0,0|2,0,0]=4 19254 B15R1.778 C=COC(=O)CNCCc1ccccc1 2230a_100000106460_100000036128 [0,2,0,0,0,0|1,0,0]=3 19255 B15R1.778 C=COC(=O)CNCCc1ccccc1 34a_100000106460_100000036128 [0,2,0,0,0,0|1,0,0]=3 19256 B15R1.778 C=COC(=O)CNCCc1cccnc1 2230a_100000736294_100000036128 [0,2,0,0,0,0|2,0,0]=4 19257 B15R1.778 C=COC(=O)COCCc1ccccc1 34a_100000210268_100000036128 [0,2,0,0,0,0|1,0,0]=3 19258 B15R1.778 C=COC(=O)COCCc1ccccn1 34a_100000210271_100000036128 [0,2,0,0,0,0|2,0,0]=4 19259 B15R1.778 C=COC(=O)COCCc1cccnc1 34a_100011217484_100000036128 [0,2,0,0,0,0|2,0,0]=4 19260 B15R1.778 C=COC(=O)COCCc1ccncc1 34a_100011216225_100000036128 [0,2,0,0,0,0|2,0,0]=4 19261 B15R1.778 C=COC(=O)CSCCc1ccccc1 62a_100000036128_100011218657 [0,2,0,0,0,0|1,0,0]=3 19262 B15R1.778 C=COC(=O)CSCCc1ccccc1 62a_100000765856_100000036128 [0,2,0,0,0,0|1,0,0]=3 19263 B15R1.778 C=COC(=O)CSCCc1ccccn1 62a_100000036128_100015183660 [0,2,0,0,0,0|2,0,0]=4 19264 B15R1.778 C=COC(=O)CSCCc1ccccn1 62a_100015183660_100000036128 [0,2,0,0,0,0|2,0,0]=4 19265 B15R1.778 C=COC(=O)CSCCc1cccnc1 62a_100000036128_200011713674 [0,2,0,0,0,0|2,0,0]=4 19266 B15R1.778 C=COC(=O)CSCCc1cccnc1 62a_200011713674_100000036128 [0,2,0,0,0,0|2,0,0]=4 19267 B15R1.778 C=COC(=O)CSCCc1ccncc1 62a_100000036128_100000723409 [0,2,0,0,0,0|2,0,0]=4 19268 B15R1.778 C=COC(=O)CSCCc1ccncc1 62a_100000723409_100000036128 [0,2,0,0,0,0|2,0,0]=4 19269 B15R1.778 C=COC(=O)CSCSc1ccccc1 62a_100000036128_100011218342 [0,2,0,0,0,0|2,0,0]=4 19270 B15R1.778 C=COC(=O)CSCSc1ccccc1 62a_100011218342_100000036128 [0,2,0,0,0,0|2,0,0]=4 19271 B15R1.778 CC#CC(=O)CCCCc1ccccc1 1458a_100000763181_100000701786 [0,2,0,0,0,0|1,0,0]=3 19272 B15R1.778 CC#CC(=O)CCCCc1ccncc1 1458a_100000763181_100020630000 [0,2,0,0,0,0|2,0,0]=4 19273 B15R1.778 CC#CC(=O)CCCOc1ccccc1 1458a_100000763181_100000199009 [0,2,0,0,0,0|2,0,0]=4 19274 B15R1.778 CC#CC(=O)CCCSc1ccccc1 1458a_100000763181_200011203293 [0,2,0,0,0,0|2,0,0]=4 19275 B15R1.778 CC#CC(=O)CCOCc1ccccc1 1458a_100000763181_100000234347 [0,2,0,0,0,0|2,0,0]=4 19276 B15R1.778 CC#CC(=O)CCSCc1ccccc1 1458a_100000763181_200011297719 [0,2,0,0,0,0|2,0,0]=4 19277 B15R1.778 CC=CC(=O)CCCCc1ccccc1 1458a_100000210699_100000701786 [0,2,0,0,0,0|1,0,0]=3 19278 B15R1.778 CC=CC(=O)CCCCc1ccncc1 1458a_100000210699_100020630000 [0,2,0,0,0,0|2,0,0]=4 19279 B15R1.778 CC=CC(=O)CCCOc1ccccc1 1458a_100000210699_100000199009 [0,2,0,0,0,0|2,0,0]=4 19280 B15R1.778 CC=CC(=O)CCCSc1ccccc1 1458a_100000210699_200011203293 [0,2,0,0,0,0|2,0,0]=4 19281 B15R1.778 CC=CC(=O)CCOCc1ccccc1 1458a_100000210699_100000234347 [0,2,0,0,0,0|2,0,0]=4 19282 B15R1.778 CC=CC(=O)CCSCc1ccccc1 1458a_100000210699_200011297719 [0,2,0,0,0,0|2,0,0]=4 19283 B15R1.778 CC=CC(=O)NCCCc1ccccc1 11a_100000211184_100000210699 [0,2,0,0,0,0|2,0,0]=4 19284 B15R1.778 CC=CC(=O)NCCCc1ccccc1 1626a_100000211184_100000210699 [0,2,0,0,0,0|2,0,0]=4 19285 B15R1.778 CC=CC(=O)NCCCc1ccccc1 240690a_100000211184_100000210699 [0,2,0,0,0,0|2,0,0]=4 19286 B15R1.778 CCCC(=O)CCCCc1ccccc1 1458a_100000211992_100000701786 [0,2,0,0,0,0|1,0,0]=3 19287 B15R1.778 CCCC(=O)CCCCc1ccccc1 1458a_100011215911_100000210303 [0,2,0,0,0,0|1,0,0]=3 19288 B15R1.778 CCCC(=O)CCCCc1ccncc1 1458a_100000211992_100020630000 [0,2,0,0,0,0|2,0,0]=4 19289 B15R1.778 CCCC(=O)CCCOc1ccccc1 1458a_100000211992_100000199009 [0,2,0,0,0,0|2,0,0]=4 19290 B15R1.778 CCCC(=O)CCCOc1ccccc1 1458a_100000212059_100000210303 [0,2,0,0,0,0|2,0,0]=4 19291 B15R1.778 CCCC(=O)CCCSc1ccccc1 1458a_100000182835_100000210303 [0,2,0,0,0,0|2,0,0]=4 19292 B15R1.778 CCCC(=O)CCCSc1ccccc1 1458a_100000211992_200011203293 [0,2,0,0,0,0|2,0,0]=4 19293 B15R1.778 CCCC(=O)CCOCc1ccccc1 1458a_100000211992_100000234347 [0,2,0,0,0,0|2,0,0]=4 19294 B15R1.778 CCCC(=O)CCOCc1ccccc1 1458a_100000743319_100000210303 [0,2,0,0,0,0|2,0,0]=4 19295 B15R1.778 CCCC(=O)CCSCc1ccccc1 1458a_100000173759_100000210303 [0,2,0,0,0,0|2,0,0]=4 19296 B15R1.778 CCCC(=O)CCSCc1ccccc1 1458a_100000211992_200011297719 [0,2,0,0,0,0|2,0,0]=4 19297 B15R1.778 CCCC(=O)CNCCc1ccccc1 2230a_100000106460_100000747444 [0,2,0,0,0,0|2,0,0]=4 19298 B15R1.778 CCCC(=O)COCCc1ccccc1 7a_100000210268_100000747444 [0,2,0,0,0,0|2,0,0]=4 19299 B15R1.778 CCCC(=O)CSCCc1ccccc1 62a_100000747444_100011218657 [0,2,0,0,0,0|2,0,0]=4 19300 B15R1.778 CCCC(=O)CSCCc1ccccc1 62a_100000765856_100000747444 [0,2,0,0,0,0|2,0,0]=4 19301 B15R1.778 CCCC(=O)NCCCc1ccccc1 11a_100000211184_100000211992 [0,2,0,0,0,0|2,0,0]=4 19302 B15R1.778 CCCC(=O)NCCCc1ccccc1 1626a_100000211184_100000211992 [0,2,0,0,0,0|2,0,0]=4 19303 B15R1.778 CCCC(=O)NCCCc1ccccc1 240690a_100000211184_100000211992 [0,2,0,0,0,0|2,0,0]=4 19304 B15R1.778 CCCC(=O)NCCCc1ccccc1 527a_100000211184_100000211992 [0,2,0,0,0,0|2,0,0]=4 19305 B15R1.778 CCNC(=O)CCCCc1ccccc1 11a_100015525214_100011215911 [0,2,0,0,0,0|1,0,0]=3 19306 B15R1.778 CCNC(=O)CCCCc1ccccc1 240690a_100015525214_100011215911 [0,2,0,0,0,0|1,0,0]=3 19307 B15R1.778 CCNC(=O)CCCCc1ccccc1 527a_100015525214_100011215911 [0,2,0,0,0,0|1,0,0]=3 19308 B15R1.778 CCNC(=O)CCCOc1ccccc1 11a_100015525214_100000212059 [0,2,0,0,0,0|2,0,0]=4 19309 B15R1.778 CCNC(=O)CCCOc1ccccc1 240690a_100015525214_100000212059 [0,2,0,0,0,0|2,0,0]=4 19310 B15R1.778 CCNC(=O)CCCOc1ccccc1 527a_100015525214_100000212059 [0,2,0,0,0,0|2,0,0]=4 19311 B15R1.778 CCNC(=O)CCCSc1ccccc1 11a_100015525214_100000182835 [0,2,0,0,0,0|2,0,0]=4 19312 B15R1.778 CCNC(=O)CCCSc1ccccc1 240690a_100015525214_100000182835 [0,2,0,0,0,0|2,0,0]=4 19313 B15R1.778 CCNC(=O)CCCSc1ccccc1 527a_100015525214_100000182835 [0,2,0,0,0,0|2,0,0]=4 19314 B15R1.778 CCNC(=O)CCNCc1ccccc1 207a_100025743525_100015611070 [0,2,0,0,0,0|2,0,0]=4 19315 B15R1.778 CCNC(=O)CCNCc1ccccc1 2230a_100015324214_100000737597 [0,2,0,0,0,0|2,0,0]=4 19316 B15R1.778 CCNC(=O)CCNCc1ccccc1 270004a_100025743525_100015611070 [0,2,0,0,0,0|2,0,0]=4 19317 B15R1.778 CCNC(=O)CCNCc1ccccc1 34a_100025743525_100015291786 [0,2,0,0,0,0|2,0,0]=4 19318 B15R1.778 CCNC(=O)CCOCc1ccccc1 11a_100015525214_100000743319 [0,2,0,0,0,0|2,0,0]=4 19319 B15R1.778 CCNC(=O)CCOCc1ccccc1 240690a_100015525214_100000743319 [0,2,0,0,0,0|2,0,0]=4 19320 B15R1.778 CCNC(=O)CCOCc1ccccc1 527a_100015525214_100000743319 [0,2,0,0,0,0|2,0,0]=4 19321 B15R1.778 CCNC(=O)CCOCc1ccccc1 7a_100000210790_100000737597 [0,2,0,0,0,0|2,0,0]=4 19322 B15R1.778 CCNC(=O)CCSCc1ccccc1 11a_100015525214_100000173759 [0,2,0,0,0,0|2,0,0]=4 19323 B15R1.778 CCNC(=O)CCSCc1ccccc1 240690a_100015525214_100000173759 [0,2,0,0,0,0|2,0,0]=4 19324 B15R1.778 CCNC(=O)CCSCc1ccccc1 527a_100015525214_100000173759 [0,2,0,0,0,0|2,0,0]=4 19325 B15R1.778 CCNC(=O)CCSCc1ccccc1 62a_100000211182_100000737597 [0,2,0,0,0,0|2,0,0]=4 19326 B15R1.778 CCNC(=O)CCSCc1ccccc1 62a_100000737597_100015291786 [0,2,0,0,0,0|2,0,0]=4 19327 B15R1.778 CCNC(=O)CNCCc1ccccc1 2230a_100000106460_100000183381 [0,2,0,0,0,0|2,0,0]=4 19328 B15R1.778 CCNC(=O)CNCCc1ccccc1 2230a_100016988866_100000765856 [0,2,0,0,0,0|2,0,0]=4 19329 B15R1.778 CCNC(=O)CNCCc1ccccc1 34a_100000106460_100000183381 [0,2,0,0,0,0|2,0,0]=4 19330 B15R1.778 CCNC(=O)COCCc1ccccc1 34a_100000210268_100000183381 [0,2,0,0,0,0|2,0,0]=4 19331 B15R1.778 CCNC(=O)COCCc1ccccc1 7a_100000210268_100000183381 [0,2,0,0,0,0|2,0,0]=4 19332 B15R1.778 CCNC(=O)CSCCc1ccccc1 62a_100000183381_100011218657 [0,2,0,0,0,0|2,0,0]=4 19333 B15R1.778 CCNC(=O)CSCCc1ccccc1 62a_100000765856_100000183381 [0,2,0,0,0,0|2,0,0]=4 19334 B15R1.778 CCNC(=O)NCCCc1ccccc1 2708a_100000211184_100015525214 [0,2,0,0,0,0|2,0,0]=4 19335 B15R1.778 CCNC(=O)NCCCc1ccccc1 2708a_100015525214_100000211184 [0,2,0,0,0,0|2,0,0]=4 19336 B15R1.778 CCNC(=O)NCCCc1ccccc1 273464a_100000211184_100015525214 [0,2,0,0,0,0|2,0,0]=4 19337 B15R1.778 CCNC(=O)NCCCc1ccccc1 273464a_100015525214_100000211184 [0,2,0,0,0,0|2,0,0]=4 19338 B15R1.778 CCNC(=O)NCCCc1ccccc1 512a_100000211184_100015525214 [0,2,0,0,0,0|2,0,0]=4 19339 B15R1.778 CCNC(=O)NCCCc1ccccc1 512a_100015525214_100000211184 [0,2,0,0,0,0|2,0,0]=4 19340 B15R1.778 CCOC(=O)CCCNc1ccccc1 34a_100000106764_100009991533 [0,2,0,0,0,0|1,0,0]=3 19341 B15R1.778 CCOC(=O)CCCOc1ccccc1 34a_100000210340_100009991533 [0,2,0,0,0,0|1,0,0]=3 19342 B15R1.778 CCOC(=O)CCCOc1ccccc1 7a_100000210340_100011215271 [0,2,0,0,0,0|1,0,0]=3 19343 B15R1.778 CCOC(=O)CCCOc1cccnc1 34a_100000210849_100009991533 [0,2,0,0,0,0|2,0,0]=4 19344 B15R1.778 CCOC(=O)CCCOc1cccnc1 7a_100000210849_100011215271 [0,2,0,0,0,0|2,0,0]=4 19345 B15R1.778 CCOC(=O)CCCOc1ccncc1 34a_100000212176_100009991533 [0,2,0,0,0,0|2,0,0]=4 19346 B15R1.778 CCOC(=O)CCCSc1ccccc1 62a_100000719477_100009991533 [0,2,0,0,0,0|1,0,0]=3 19347 B15R1.778 CCOC(=O)CCCSc1ccccc1 62a_100009991533_100000041952 [0,2,0,0,0,0|1,0,0]=3 19348 B15R1.778 CCOC(=O)CCCSc1ccccn1 62a_100009991533_100011216584 [0,2,0,0,0,0|2,0,0]=4 19349 B15R1.778 CCOC(=O)CCCSc1ccccn1 62a_100011216584_100009991533 [0,2,0,0,0,0|2,0,0]=4 19350 B15R1.778 CCOC(=O)CCCSc1cccnc1 62a_100000210063_100009991533 [0,2,0,0,0,0|2,0,0]=4 19351 B15R1.778 CCOC(=O)CCCSc1cccnc1 62a_100009991533_100000210063 [0,2,0,0,0,0|2,0,0]=4 19352 B15R1.778 CCOC(=O)CCCSc1ccncc1 62a_100000728582_100009991533 [0,2,0,0,0,0|2,0,0]=4 19353 B15R1.778 CCOC(=O)CCCSc1ccncc1 62a_100009991533_100000728582 [0,2,0,0,0,0|2,0,0]=4 19354 B15R1.778 CCOC(=O)CCNCc1ccccc1 2230a_100015324214_100011206558 [0,2,0,0,0,0|1,0,0]=3 19355 B15R1.778 CCOC(=O)CCNCc1ccccc1 34a_100015324214_100000765890 [0,2,0,0,0,0|1,0,0]=3 19356 B15R1.778 CCOC(=O)CCOCc1ccccc1 34a_100000210790_100000765890 [0,2,0,0,0,0|1,0,0]=3 19357 B15R1.778 CCOC(=O)CCOCc1ccccc1 7a_100000210790_100011206558 [0,2,0,0,0,0|1,0,0]=3 19358 B15R1.778 CCOC(=O)CCSCc1ccccc1 62a_100000211182_100000765890 [0,2,0,0,0,0|1,0,0]=3 19359 B15R1.778 CCOC(=O)CCSCc1ccccc1 62a_100000765890_100015291786 [0,2,0,0,0,0|1,0,0]=3 19360 B15R1.778 CCOC(=O)CCSCc1ccccn1 62a_100000721315_100000765890 [0,2,0,0,0,0|2,0,0]=4 19361 B15R1.778 CCOC(=O)CCSCc1ccccn1 62a_100000765890_100000721315 [0,2,0,0,0,0|2,0,0]=4 19362 B15R1.778 CCOC(=O)CCSCc1cccnc1 62a_100000741622_100000765890 [0,2,0,0,0,0|2,0,0]=4 19363 B15R1.778 CCOC(=O)CCSCc1cccnc1 62a_100000765890_100000741622 [0,2,0,0,0,0|2,0,0]=4 19364 B15R1.778 CCOC(=O)CCSCc1ccncc1 62a_100000765890_100015193705 [0,2,0,0,0,0|2,0,0]=4 19365 B15R1.778 CCOC(=O)CCSCc1ccncc1 62a_100015193705_100000765890 [0,2,0,0,0,0|2,0,0]=4 19366 B15R1.778 CCOC(=O)CNCCc1ccccc1 2230a_100000106460_100000188475 [0,2,0,0,0,0|1,0,0]=3 19367 B15R1.778 CCOC(=O)CNCCc1ccccc1 34a_100000106460_100000188475 [0,2,0,0,0,0|1,0,0]=3 19368 B15R1.778 CCOC(=O)CNCCc1cccnc1 2230a_100000736294_100000188475 [0,2,0,0,0,0|2,0,0]=4 19369 B15R1.778 CCOC(=O)COCCc1ccccc1 34a_100000210268_100000188475 [0,2,0,0,0,0|1,0,0]=3 19370 B15R1.778 CCOC(=O)COCCc1ccccc1 7a_100000210268_100000188475 [0,2,0,0,0,0|1,0,0]=3 19371 B15R1.778 CCOC(=O)COCCc1ccccn1 34a_100000210271_100000188475 [0,2,0,0,0,0|2,0,0]=4 19372 B15R1.778 CCOC(=O)COCCc1cccnc1 34a_100011217484_100000188475 [0,2,0,0,0,0|2,0,0]=4 19373 B15R1.778 CCOC(=O)COCCc1ccncc1 34a_100011216225_100000188475 [0,2,0,0,0,0|2,0,0]=4 19374 B15R1.778 CCOC(=O)CSCCc1ccccc1 62a_100000188475_100011218657 [0,2,0,0,0,0|1,0,0]=3 19375 B15R1.778 CCOC(=O)CSCCc1ccccc1 62a_100000765856_100000188475 [0,2,0,0,0,0|1,0,0]=3 19376 B15R1.778 CCOC(=O)CSCCc1ccccn1 62a_100000188475_100015183660 [0,2,0,0,0,0|2,0,0]=4 19377 B15R1.778 CCOC(=O)CSCCc1ccccn1 62a_100015183660_100000188475 [0,2,0,0,0,0|2,0,0]=4 19378 B15R1.778 CCOC(=O)CSCCc1cccnc1 62a_100000188475_200011713674 [0,2,0,0,0,0|2,0,0]=4 19379 B15R1.778 CCOC(=O)CSCCc1cccnc1 62a_200011713674_100000188475 [0,2,0,0,0,0|2,0,0]=4 19380 B15R1.778 CCOC(=O)CSCCc1ccncc1 62a_100000188475_100000723409 [0,2,0,0,0,0|2,0,0]=4 19381 B15R1.778 CCOC(=O)CSCCc1ccncc1 62a_100000723409_100000188475 [0,2,0,0,0,0|2,0,0]=4 19382 B15R1.778 CCOC(=O)CSCSc1ccccc1 62a_100000188475_100011218342 [0,2,0,0,0,0|2,0,0]=4 19383 B15R1.778 CCOC(=O)CSCSc1ccccc1 62a_100011218342_100000188475 [0,2,0,0,0,0|2,0,0]=4 19384 B15R1.778 CCOC(=O)NCCOc1ccccc1 7a_100000210340_200011445536 [0,2,0,0,0,0|2,0,0]=4 19385 B15R1.778 CCOC(=O)NCCSc1ccccc1 62a_100000719477_200011445536 [0,2,0,0,0,0|2,0,0]=4 19386 B15R1.778 CCOC(=O)OCSCc1ccccc1 62a_100000211182_100000075025 [0,2,0,0,0,0|2,0,0]=4 19387 B15R1.778 CN(CC=O)CCCCc1ccccc1 2230a_100000741445_200015260668 [0,2,0,0,0,0|2,0,0]=4 19388 B15R1.778 CN(CC=O)CCCCc1ccccc1 269982a_100000741445_200015260668 [0,2,0,0,0,0|2,0,0]=4 19389 B15R1.778 CN(CC=O)CCCCc1ccccc1 34a_100000741445_200009817547 [0,2,0,0,0,0|2,0,0]=4 19390 B15R1.778 CN(CCO)CCCCc1ccccc1 2230a_100000210263_100000701786 [0,2,0,0,0,0|2,0,0]=4 19391 B15R1.778 CN(CCO)CCCCc1ccccc1 2230a_100000741445_100000211926 [0,2,0,0,0,0|2,0,0]=4 19392 B15R1.778 CN(CCO)CCCCc1ccccc1 269982a_100000210263_100000701786 [0,2,0,0,0,0|2,0,0]=4 19393 B15R1.778 CN(CCO)CCCCc1ccccc1 269982a_100000741445_100000211926 [0,2,0,0,0,0|2,0,0]=4 19394 B15R1.778 CN(CCO)CCCCc1ccccc1 34a_100000741445_100000211926 [0,2,0,0,0,0|2,0,0]=4 19395 B15R1.778 CNCC(=O)NCCCc1ccccc1 2230a_106832991635_100000182878 [0,2,0,0,0,0|2,0,0]=4 19396 B15R1.778 CNCC(=O)NCCCc1ccccc1 34a_100102657272_100000182878 [0,2,0,0,0,0|2,0,0]=4 19397 B15R1.778 CNCC(=O)NCCCc1ccccc1 7a_106832991635_100000182878 [0,2,0,0,0,0|2,0,0]=4 19398 B15R1.778 CNNC(=O)CCCCc1ccccc1 22a_100016993582_100011215911 [0,2,0,0,0,0|1,0,0]=3 19399 B15R1.778 CNNC(=O)CCCOc1ccccc1 22a_100016993582_100000212059 [0,2,0,0,0,0|2,0,0]=4 19400 B15R1.778 CNNC(=O)CCCSc1ccccc1 22a_100016993582_100000182835 [0,2,0,0,0,0|2,0,0]=4 19401 B15R1.778 CNNC(=O)CCOCc1ccccc1 22a_100016993582_100000743319 [0,2,0,0,0,0|2,0,0]=4 19402 B15R1.778 CNNC(=O)CCSCc1ccccc1 22a_100016993582_100000173759 [0,2,0,0,0,0|2,0,0]=4 19403 B15R1.778 CNNC(=O)NCCCc1ccccc1 273464a_100000211184_100016993582 [0,2,0,0,0,0|2,0,0]=4 19404 B15R1.778 CNNC(=O)NCCCc1ccccc1 512a_100000211184_100016993582 [0,2,0,0,0,0|2,0,0]=4 19405 B15R1.778 CNNC(=O)NCCCc1ccccc1 512a_100016993582_100000211184 [0,2,0,0,0,0|2,0,0]=4 19406 B15R1.778 COCC(=O)CCCCc1ccccc1 1458a_100000210968_100000701786 [0,2,0,0,0,0|0,0,0]=2 19407 B15R1.778 COCC(=O)CCCCc1ccncc1 1458a_100000210968_100020630000 [0,2,0,0,0,0|1,0,0]=3 19408 B15R1.778 COCC(=O)CCCOc1ccccc1 1458a_100000210968_100000199009 [0,2,0,0,0,0|1,0,0]=3 19409 B15R1.778 COCC(=O)CCCSc1ccccc1 1458a_100000210968_200011203293 [0,2,0,0,0,0|1,0,0]=3 19410 B15R1.778 COCC(=O)CCOCc1ccccc1 1458a_100000210968_100000234347 [0,2,0,0,0,0|1,0,0]=3 19411 B15R1.778 COCC(=O)CCSCc1ccccc1 1458a_100000210968_200011297719 [0,2,0,0,0,0|1,0,0]=3 19412 B15R1.778 COCC(=O)NCCCc1ccccc1 11a_100000211184_100000210968 [0,2,0,0,0,0|1,0,0]=3 19413 B15R1.778 COCC(=O)NCCCc1ccccc1 1626a_100000211184_100000210968 [0,2,0,0,0,0|1,0,0]=3 19414 B15R1.778 COCC(=O)NCCCc1ccccc1 240690a_100000211184_100000210968 [0,2,0,0,0,0|1,0,0]=3 19415 B15R1.778 COCC(=O)NCCCc1ccccc1 34a_100138415774_100000182878 [0,2,0,0,0,0|1,0,0]=3 19416 B15R1.778 COCC(=O)NCCCc1ccccc1 527a_100000211184_100000210968 [0,2,0,0,0,0|1,0,0]=3 19417 B15R1.778 COCC(=O)NCCCc1ccccn1 11a_100000689020_100000210968 [0,2,0,0,0,0|2,0,0]=4 19418 B15R1.778 COCC(=O)NCCCc1ccccn1 1626a_100000689020_100000210968 [0,2,0,0,0,0|2,0,0]=4 19419 B15R1.778 COCC(=O)NCCCc1ccccn1 240690a_100000689020_100000210968 [0,2,0,0,0,0|2,0,0]=4 19420 B15R1.778 COCC(=O)NCCCc1ccccn1 527a_100000689020_100000210968 [0,2,0,0,0,0|2,0,0]=4 19421 B15R1.778 COCC(=O)NCCCc1cccnc1 11a_100011532358_100000210968 [0,2,0,0,0,0|2,0,0]=4 19422 B15R1.778 COCC(=O)NCCCc1cccnc1 240690a_100011532358_100000210968 [0,2,0,0,0,0|2,0,0]=4 19423 B15R1.778 COCC(=O)NCCCc1ccncc1 1626a_100011275580_100000210968 [0,2,0,0,0,0|2,0,0]=4 19424 B15R1.778 COCC(=O)NCCCc1ccncc1 240690a_100011275580_100000210968 [0,2,0,0,0,0|2,0,0]=4 19425 B15R1.778 COCC(=O)NCCCc1ccncc1 527a_100011275580_100000210968 [0,2,0,0,0,0|2,0,0]=4 19426 B15R1.778 COCC(=O)NCCOc1ccccc1 11a_100000174943_100000210968 [0,2,0,0,0,0|2,0,0]=4 19427 B15R1.778 COCC(=O)NCCOc1ccccc1 1626a_100000174943_100000210968 [0,2,0,0,0,0|2,0,0]=4 19428 B15R1.778 COCC(=O)NCCOc1ccccc1 240690a_100000174943_100000210968 [0,2,0,0,0,0|2,0,0]=4 19429 B15R1.778 COCC(=O)NCCOc1ccccc1 34a_100138415774_100000181728 [0,2,0,0,0,0|2,0,0]=4 19430 B15R1.778 COCC(=O)NCCOc1ccccc1 527a_100000174943_100000210968 [0,2,0,0,0,0|2,0,0]=4 19431 B15R1.778 COCC(=O)NCCSc1ccccc1 240690a_100000189519_100000210968 [0,2,0,0,0,0|2,0,0]=4 19432 B15R1.778 COCC(=O)NCCSc1ccccc1 527a_100000189519_100000210968 [0,2,0,0,0,0|2,0,0]=4 19433 B15R1.778 COCC(=O)NNCCc1ccccc1 22a_100000740470_100000210968 [0,2,0,0,0,0|2,0,0]=4 19434 B15R1.778 COCN(C)CCCCc1ccccc1 2230a_100000741445_100000766300 [0,2,0,0,0,0|2,0,0]=4 19435 B15R1.778 COCN(C)CCCCc1ccccc1 269982a_100000741445_100000766300 [0,2,0,0,0,0|2,0,0]=4 19436 B15R1.778 CSCC(=O)CCCCc1ccccc1 1458a_100000184570_100000701786 [0,2,0,0,0,0|0,1,0]=3 19437 B15R1.778 CSCC(=O)CCCCc1ccncc1 1458a_100000184570_100020630000 [0,2,0,0,0,0|1,1,0]=4 19438 B15R1.778 CSCC(=O)CCCOc1ccccc1 1458a_100000184570_100000199009 [0,2,0,0,0,0|1,1,0]=4 19439 B15R1.778 CSCC(=O)CCCSc1ccccc1 1458a_100000184570_200011203293 [0,2,0,0,0,0|1,1,0]=4 19440 B15R1.778 CSCC(=O)CCOCc1ccccc1 1458a_100000184570_100000234347 [0,2,0,0,0,0|1,1,0]=4 19441 B15R1.778 CSCC(=O)CCSCc1ccccc1 1458a_100000184570_200011297719 [0,2,0,0,0,0|1,1,0]=4 19442 B15R1.778 CSCC(=O)NCCCc1ccccc1 11a_100000211184_100000184570 [0,2,0,0,0,0|1,1,0]=4 19443 B15R1.778 CSCC(=O)NCCCc1ccccc1 1626a_100000211184_100000184570 [0,2,0,0,0,0|1,1,0]=4 19444 B15R1.778 CSCC(=O)NCCCc1ccccc1 240690a_100000211184_100000184570 [0,2,0,0,0,0|1,1,0]=4 19445 B15R1.778 CSCC(=O)NCCCc1ccccc1 527a_100000211184_100000184570 [0,2,0,0,0,0|1,1,0]=4 19446 B15R1.778 CSCC(=O)NCCCc1ccccc1 62a_100000182878_200000210301 [0,2,0,0,0,0|1,1,0]=4 19447 B15R1.778 CSCC(=O)NCCCc1ccccc1 62a_200000210301_100000182878 [0,2,0,0,0,0|1,1,0]=4 19448 B15R1.778 N#CCC(=O)CCCCc1ccccc1 1458a_100011215911_100011214920 [0,2,0,0,0,0|1,0,0]=3 19449 B15R1.778 N#CCC(=O)CCCCc1ccccc1 1458a_100051588842_100000701786 [0,2,0,0,0,0|1,0,0]=3 19450 B15R1.778 N#CCC(=O)CCCCc1ccncc1 1458a_100051588842_100020630000 [0,2,0,0,0,0|2,0,0]=4 19451 B15R1.778 N#CCC(=O)CCCOc1ccccc1 1458a_100000212059_100011214920 [0,2,0,0,0,0|2,0,0]=4 19452 B15R1.778 N#CCC(=O)CCCOc1ccccc1 1458a_100051588842_100000199009 [0,2,0,0,0,0|2,0,0]=4 19453 B15R1.778 N#CCC(=O)CCCSc1ccccc1 1458a_100000182835_100011214920 [0,2,0,0,0,0|2,0,0]=4 19454 B15R1.778 N#CCC(=O)CCCSc1ccccc1 1458a_100051588842_200011203293 [0,2,0,0,0,0|2,0,0]=4 19455 B15R1.778 N#CCC(=O)CCOCc1ccccc1 1458a_100000743319_100011214920 [0,2,0,0,0,0|2,0,0]=4 19456 B15R1.778 N#CCC(=O)CCOCc1ccccc1 1458a_100051588842_100000234347 [0,2,0,0,0,0|2,0,0]=4 19457 B15R1.778 N#CCC(=O)CCSCc1ccccc1 1458a_100000173759_100011214920 [0,2,0,0,0,0|2,0,0]=4 19458 B15R1.778 N#CCC(=O)CCSCc1ccccc1 1458a_100051588842_200011297719 [0,2,0,0,0,0|2,0,0]=4 19459 B15R1.778 N#CCC(=O)NCCCc1ccccc1 1626a_100000211184_100051588842 [0,2,0,0,0,0|2,0,0]=4 19460 B15R1.778 N#CCC(=O)NCCCc1ccccc1 240690a_100000211184_100051588842 [0,2,0,0,0,0|2,0,0]=4 19461 B15R1.778 O=C(C=CBr)CCCCc1ccccc1 1458a_100016273825_100000701786 [0,2,0,0,0,0|1,0,0]=3 19462 B15R1.778 O=C(C=CBr)CCCCc1ccncc1 1458a_100016273825_100020630000 [0,2,0,0,0,0|2,0,0]=4 19463 B15R1.778 O=C(C=CBr)CCCOc1ccccc1 1458a_100016273825_100000199009 [0,2,0,0,0,0|2,0,0]=4 19464 B15R1.778 O=C(C=CBr)CCCSc1ccccc1 1458a_100016273825_200011203293 [0,2,0,0,0,0|2,0,0]=4 19465 B15R1.778 O=C(C=CBr)CCOCc1ccccc1 1458a_100016273825_100000234347 [0,2,0,0,0,0|2,0,0]=4 19466 B15R1.778 O=C(C=CBr)CCSCc1ccccc1 1458a_100016273825_200011297719 [0,2,0,0,0,0|2,0,0]=4 19467 B15R1.778 O=C(C=CBr)NCCCc1ccccc1 1626a_100000211184_100016273825 [0,2,0,0,0,0|2,0,0]=4 19468 B15R1.778 O=C(C=CBr)NCCCc1ccccc1 240690a_100000211184_100016273825 [0,2,0,0,0,0|2,0,0]=4 19469 B15R1.778 O=C(C=CCCc1ccccc1)CCO 1458a_100016484021_100000211926 [0,2,0,0,0,0|0,0,2]=4 19470 B15R1.778 O=C(C=CCl)CCCCc1ccccc1 1458a_200016279998_100000701786 [0,2,0,0,0,0|1,0,0]=3 19471 B15R1.778 O=C(C=CCl)CCCCc1ccncc1 1458a_200016279998_100020630000 [0,2,0,0,0,0|2,0,0]=4 19472 B15R1.778 O=C(C=CCl)CCCOc1ccccc1 1458a_200016279998_100000199009 [0,2,0,0,0,0|2,0,0]=4 19473 B15R1.778 O=C(C=CCl)CCCSc1ccccc1 1458a_200016279998_200011203293 [0,2,0,0,0,0|2,0,0]=4 19474 B15R1.778 O=C(C=CCl)CCOCc1ccccc1 1458a_200016279998_100000234347 [0,2,0,0,0,0|2,0,0]=4 19475 B15R1.778 O=C(C=CCl)CCSCc1ccccc1 1458a_200016279998_200011297719 [0,2,0,0,0,0|2,0,0]=4 19476 B15R1.778 O=C(C=CCl)NCCCc1ccccc1 11a_100000211184_200016279998 [0,2,0,0,0,0|2,0,0]=4 19477 B15R1.778 O=C(C=CCl)NCCCc1ccccc1 1626a_100000211184_200016279998 [0,2,0,0,0,0|2,0,0]=4 19478 B15R1.778 O=C(C=CCl)NCCCc1ccccc1 240690a_100000211184_200016279998 [0,2,0,0,0,0|2,0,0]=4 19479 B15R1.778 O=C(C=CI)CCCCc1ccccc1 1458a_100016256311_100000701786 [0,2,0,0,0,0|1,0,0]=3 19480 B15R1.778 O=C(C=CI)CCCCc1ccncc1 1458a_100016256311_100020630000 [0,2,0,0,0,0|2,0,0]=4 19481 B15R1.778 O=C(C=CI)CCCOc1ccccc1 1458a_100016256311_100000199009 [0,2,0,0,0,0|2,0,0]=4 19482 B15R1.778 O=C(C=CI)CCCSc1ccccc1 1458a_100016256311_200011203293 [0,2,0,0,0,0|2,0,0]=4 19483 B15R1.778 O=C(C=CI)CCOCc1ccccc1 1458a_100016256311_100000234347 [0,2,0,0,0,0|2,0,0]=4 19484 B15R1.778 O=C(C=CI)CCSCc1ccccc1 1458a_100016256311_200011297719 [0,2,0,0,0,0|2,0,0]=4 19485 B15R1.778 O=C(C=CI)NCCCc1ccccc1 1626a_100000211184_100016256311 [0,2,0,0,0,0|2,0,0]=4 19486 B15R1.778 O=C(CCF)CCCCc1ccccc1 1458a_100011215911_100011217306 [0,2,0,0,0,0|1,0,0]=3 19487 B15R1.778 O=C(CCF)CCCOc1ccccc1 1458a_100000212059_100011217306 [0,2,0,0,0,0|2,0,0]=4 19488 B15R1.778 O=C(CCF)CCCSc1ccccc1 1458a_100000182835_100011217306 [0,2,0,0,0,0|2,0,0]=4 19489 B15R1.778 O=C(CCF)CCOCc1ccccc1 1458a_100000743319_100011217306 [0,2,0,0,0,0|2,0,0]=4 19490 B15R1.778 O=C(CCF)CCSCc1ccccc1 1458a_100000173759_100011217306 [0,2,0,0,0,0|2,0,0]=4 19491 B15R1.778 O=C(CCO)CCCCc1ccccc1 1458a_100011215911_100000211926 [0,2,0,0,0,0|0,0,0]=2 19492 B15R1.778 O=C(CCO)CCCCc1ccccc1 1458a_100011216618_100000701786 [0,2,0,0,0,0|0,0,0]=2 19493 B15R1.778 O=C(CCO)CCCCc1ccncc1 1458a_100011216618_100020630000 [0,2,0,0,0,0|1,0,0]=3 19494 B15R1.778 O=C(CCO)CCCOc1ccccc1 1458a_100000212059_100000211926 [0,2,0,0,0,0|1,0,0]=3 19495 B15R1.778 O=C(CCO)CCCOc1ccccc1 1458a_100011216618_100000199009 [0,2,0,0,0,0|1,0,0]=3 19496 B15R1.778 O=C(CCO)CCCSc1ccccc1 1458a_100000182835_100000211926 [0,2,0,0,0,0|1,0,0]=3 19497 B15R1.778 O=C(CCO)CCCSc1ccccc1 1458a_100011216618_200011203293 [0,2,0,0,0,0|1,0,0]=3 19498 B15R1.778 O=C(CCO)CCOCc1ccccc1 1458a_100000743319_100000211926 [0,2,0,0,0,0|1,0,0]=3 19499 B15R1.778 O=C(CCO)CCOCc1ccccc1 1458a_100011216618_100000234347 [0,2,0,0,0,0|1,0,0]=3 19500 B15R1.778 O=C(CCO)CCSCc1ccccc1 1458a_100000173759_100000211926 [0,2,0,0,0,0|1,0,0]=3 19501 B15R1.778 O=C(CCO)CCSCc1ccccc1 1458a_100011216618_200011297719 [0,2,0,0,0,0|1,0,0]=3 19502 B15R1.778 O=C(CCO)CCSCc1ccccn1 1458a_100000742633_100000211926 [0,2,0,0,0,0|2,0,0]=4 19503 B15R1.778 O=C(CCO)NCCCc1ccccc1 240690a_100000211184_100011216618 [0,2,0,0,0,0|1,0,0]=3 19504 B15R1.778 O=C(CCO)NCCCc1ccccn1 240690a_100000689020_100011216618 [0,2,0,0,0,0|2,0,0]=4 19505 B15R1.778 O=C(CCO)NCCCc1cccnc1 240690a_100011532358_100011216618 [0,2,0,0,0,0|2,0,0]=4 19506 B15R1.778 O=C(CCO)NCCCc1ccncc1 240690a_100011275580_100011216618 [0,2,0,0,0,0|2,0,0]=4 19507 B15R1.778 O=C(CCO)NCCOc1ccccc1 240690a_100000174943_100011216618 [0,2,0,0,0,0|2,0,0]=4 19508 B15R1.778 O=C(CCO)NCCSc1ccccc1 240690a_100000189519_100011216618 [0,2,0,0,0,0|2,0,0]=4 19509 B15R1.778 O=C(CCO)NNCCc1ccccc1 22a_100000740470_100011216618 [0,2,0,0,0,0|2,0,0]=4 19510 B15R1.778 O=C(CNCCc1ccccc1)NCO 2230a_100000106460_100000185155 [0,2,0,0,0,0|1,0,0]=3 19511 B15R1.778 O=C(CNCCc1ccccc1)NCO 34a_100000106460_100000185155 [0,2,0,0,0,0|1,0,0]=3 19512 B15R1.778 O=C(CNCCc1cccnc1)NCO 2230a_100000736294_100000185155 [0,2,0,0,0,0|2,0,0]=4 19513 B15R1.778 O=C(COCCc1ccccc1)NCO 34a_100000210268_100000185155 [0,2,0,0,0,0|1,0,0]=3 19514 B15R1.778 O=C(COCCc1ccccc1)NCO 7a_100000210268_100000185155 [0,2,0,0,0,0|1,0,0]=3 19515 B15R1.778 O=C(COCCc1ccccn1)NCO 34a_100000210271_100000185155 [0,2,0,0,0,0|2,0,0]=4 19516 B15R1.778 O=C(COCCc1cccnc1)NCO 34a_100011217484_100000185155 [0,2,0,0,0,0|2,0,0]=4 19517 B15R1.778 O=C(COCCc1ccncc1)NCO 34a_100011216225_100000185155 [0,2,0,0,0,0|2,0,0]=4 19518 B15R1.778 O=C(CSCCc1ccccc1)NCO 62a_100000185155_100011218657 [0,2,0,0,0,0|1,0,0]=3 19519 B15R1.778 O=C(CSCCc1ccccc1)NCO 62a_100000765856_100000185155 [0,2,0,0,0,0|1,0,0]=3 19520 B15R1.778 O=C(CSCCc1ccccn1)NCO 62a_100000185155_100015183660 [0,2,0,0,0,0|2,0,0]=4 19521 B15R1.778 O=C(CSCCc1ccccn1)NCO 62a_100015183660_100000185155 [0,2,0,0,0,0|2,0,0]=4 19522 B15R1.778 O=C(CSCCc1cccnc1)NCO 62a_100000185155_200011713674 [0,2,0,0,0,0|2,0,0]=4 19523 B15R1.778 O=C(CSCCc1cccnc1)NCO 62a_200011713674_100000185155 [0,2,0,0,0,0|2,0,0]=4 19524 B15R1.778 O=C(CSCCc1ccncc1)NCO 62a_100000185155_100000723409 [0,2,0,0,0,0|2,0,0]=4 19525 B15R1.778 O=C(CSCCc1ccncc1)NCO 62a_100000723409_100000185155 [0,2,0,0,0,0|2,0,0]=4 19526 B15R1.778 O=C(CSCSc1ccccc1)NCO 62a_100000185155_100011218342 [0,2,0,0,0,0|2,0,0]=4 19527 B15R1.778 O=C(CSCSc1ccccc1)NCO 62a_100011218342_100000185155 [0,2,0,0,0,0|2,0,0]=4 19528 B15R1.778 [13CH3]SCC(=O)NCCCc1ccccc1 62a_100000182878_200025704644 [0,2,0,0,0,0|1,1,0]=4 19529 B15R1.778 [13CH3]SCC(=O)NCCCc1ccccc1 62a_200025704644_100000182878 [0,2,0,0,0,0|1,1,0]=4 19530 B15R1.1321 C#CC(=O)C(C)CCCc1ccccc1 1458a_100000211873_200010759516 [0,2,0,0,0,0|1,0,0]=3 19531 B15R1.1321 C=C(CNCc1ccccc1)C(=O)OC 34a_100015324214_100009813391 [0,2,0,0,0,0|1,0,1]=4 19532 B15R1.1321 C=C(COCc1ccccc1)C(=O)OC 34a_100000210790_100009813391 [0,2,0,0,0,0|1,0,1]=4 19533 B15R1.1321 C=C(CSCc1ccccc1)C(=O)OC 62a_100000211182_100009813391 [0,2,0,0,0,0|1,0,1]=4 19534 B15R1.1321 C=C(CSCc1ccccc1)C(=O)OC 62a_100009813391_100015291786 [0,2,0,0,0,0|1,0,1]=4 19535 B15R1.1321 C=CC(=O)C(C)CCCc1ccccc1 1458a_100000185746_200010759516 [0,2,0,0,0,0|1,0,0]=3 19536 B15R1.1321 C=CC(=O)N(C)CCCc1ccccc1 1626a_100000693637_100000185746 [0,2,0,0,0,0|2,0,0]=4 19537 B15R1.1321 C=CC(=O)N(C)CCCc1ccccc1 240690a_100000693637_200121576911 [0,2,0,0,0,0|2,0,0]=4 19538 B15R1.1321 CC(CCCc1ccccc1)C(=O)CO 1458a_100000210174_200010759516 [0,2,0,0,0,0|0,0,0]=2 19539 B15R1.1321 CC(OCCc1ccccc1)C(=O)NN 34a_100000725659_100000765856 [0,2,0,0,0,0|2,0,0]=4 19540 B15R1.1321 CCC(=O)C(C)CCCc1ccccc1 1458a_100000210414_200010759516 [0,2,0,0,0,0|1,0,0]=3 19541 B15R1.1321 CCC(=O)C(C)NCCc1ccccc1 2230a_100000106460_100000742827 [0,2,0,0,0,0|2,0,0]=4 19542 B15R1.1321 CCC(=O)C(C)OCCc1ccccc1 7a_100000210268_100000742827 [0,2,0,0,0,0|2,0,0]=4 19543 B15R1.1321 CCC(=O)C(C)SCCc1ccccc1 62a_100000742827_100011218657 [0,2,0,0,0,0|2,0,0]=4 19544 B15R1.1321 CCC(=O)C(C)SCCc1ccccc1 62a_100000765856_100000742827 [0,2,0,0,0,0|2,0,0]=4 19545 B15R1.1321 CCC(=O)N(C)CCCc1ccccc1 11a_100000693637_100000210414 [0,2,0,0,0,0|2,0,0]=4 19546 B15R1.1321 CCC(=O)N(C)CCCc1ccccc1 1626a_100000693637_100000210414 [0,2,0,0,0,0|2,0,0]=4 19547 B15R1.1321 CCC(=O)N(C)CCCc1ccccc1 240690a_100000693637_100000210414 [0,2,0,0,0,0|2,0,0]=4 19548 B15R1.1321 CCC(=O)N(C)CCCc1ccccc1 527a_100000693637_100000210414 [0,2,0,0,0,0|2,0,0]=4 19549 B15R1.1321 CN(CCCc1ccccc1)C(=O)CO 240690a_100000693637_100000210174 [0,2,0,0,0,0|1,0,0]=3 19550 B15R1.1321 CN(CCCc1ccccc1)C(=O)CO 527a_100000693637_100000210174 [0,2,0,0,0,0|1,0,0]=3 19551 B15R1.1321 CN(CCOc1ccccc1)C(=O)CO 240690a_100000184383_100000210174 [0,2,0,0,0,0|2,0,0]=4 19552 B15R1.1321 CN(CCOc1ccccc1)C(=O)CO 527a_100000184383_100000210174 [0,2,0,0,0,0|2,0,0]=4 19553 B15R1.1321 CNC(=O)C(=O)CCCc1ccccc1 1458a_100011218921_100000211621 [0,2,0,0,0,0|1,0,1]=4 19554 B15R1.1321 CNC(=O)C(C)CNCc1ccccc1 207a_100015187722_100015611070 [0,2,0,0,0,0|2,0,0]=4 19555 B15R1.1321 CNC(=O)C(C)CNCc1ccccc1 2230a_100015187722_100015291786 [0,2,0,0,0,0|2,0,0]=4 19556 B15R1.1321 CNC(=O)C(C)CNCc1ccccc1 270004a_100015187722_100015611070 [0,2,0,0,0,0|2,0,0]=4 19557 B15R1.1321 CNC(=O)C(C)CNCc1ccccc1 34a_100015187722_100015291786 [0,2,0,0,0,0|2,0,0]=4 19558 B15R1.1321 CNC(=O)C(C)NCCc1ccccc1 2230a_100000106460_100000731044 [0,2,0,0,0,0|2,0,0]=4 19559 B15R1.1321 CNC(=O)C(C)NCCc1ccccc1 34a_100000106460_100000731044 [0,2,0,0,0,0|2,0,0]=4 19560 B15R1.1321 CNC(=O)C(C)OCCc1ccccc1 34a_100000210268_100000731044 [0,2,0,0,0,0|2,0,0]=4 19561 B15R1.1321 CNC(=O)C(C)OCCc1ccccc1 7a_100000210268_100000209862 [0,2,0,0,0,0|2,0,0]=4 19562 B15R1.1321 CNC(=O)C(C)SCCc1ccccc1 62a_100000209862_100011218657 [0,2,0,0,0,0|2,0,0]=4 19563 B15R1.1321 CNC(=O)C(C)SCCc1ccccc1 62a_100000765856_100000731044 [0,2,0,0,0,0|2,0,0]=4 19564 B15R1.1321 CNC(=O)C(F)NCCc1ccccc1 2230a_100000106460_100009813575 [0,2,0,0,0,0|2,0,0]=4 19565 B15R1.1321 CNC(=O)C(F)NCCc1ccccc1 34a_100000106460_100009813575 [0,2,0,0,0,0|2,0,0]=4 19566 B15R1.1321 CNC(=O)C(F)OCCc1ccccc1 34a_100000210268_100009813575 [0,2,0,0,0,0|2,0,0]=4 19567 B15R1.1321 CNC(=O)C(F)OCCc1ccccc1 7a_100000210268_100009813575 [0,2,0,0,0,0|2,0,0]=4 19568 B15R1.1321 CNC(=O)C(F)SCCc1ccccc1 62a_100000765856_100009813575 [0,2,0,0,0,0|2,0,0]=4 19569 B15R1.1321 CNC(=O)C(F)SCCc1ccccc1 62a_100009813575_100011218657 [0,2,0,0,0,0|2,0,0]=4 19570 B15R1.1321 CNC(=O)N(C)CCCc1ccccc1 2708a_100102657272_100000693637 [0,2,0,0,0,0|2,0,0]=4 19571 B15R1.1321 CNC(=O)N(C)CCCc1ccccc1 273464a_100102657272_100000693637 [0,2,0,0,0,0|2,0,0]=4 19572 B15R1.1321 CNC(=O)[C@@H](C)NCCc1ccccc1 2230a_100000684985_100000765856 [0,2,0,0,0,0|2,0,0]=4 19573 B15R1.1321 CNC(=O)[C@@H](C)NCCc1ccccc1 34a_100000684985_100000765856 [0,2,0,0,0,0|2,0,0]=4 19574 B15R1.1321 COC(=O)C(=O)CNCc1ccccc1 34a_100015324214_100011610305 [0,2,0,0,0,0|1,0,1]=4 19575 B15R1.1321 COC(=O)C(=O)COCc1ccccc1 34a_100000210790_100011610305 [0,2,0,0,0,0|1,0,1]=4 19576 B15R1.1321 COC(=O)C(=O)CSCc1ccccc1 62a_100000211182_100011610305 [0,2,0,0,0,0|1,0,1]=4 19577 B15R1.1321 COC(=O)C(=O)CSCc1ccccc1 62a_100011610305_100015291786 [0,2,0,0,0,0|1,0,1]=4 19578 B15R1.1321 COC(=O)C(=O)NCCc1ccccc1 11a_100000106460_100000024059 [0,2,0,0,0,0|1,0,1]=4 19579 B15R1.1321 COC(=O)C(=O)NCCc1ccccc1 1626a_100000106460_100000024059 [0,2,0,0,0,0|1,0,1]=4 19580 B15R1.1321 COC(=O)C(=O)NCCc1ccccc1 240690a_100000106460_100000024059 [0,2,0,0,0,0|1,0,1]=4 19581 B15R1.1321 COC(=O)C(=O)NCCc1ccccc1 527a_100000106460_100000024059 [0,2,0,0,0,0|1,0,1]=4 19582 B15R1.1321 COC(=O)C(C)CCNc1ccccc1 34a_100000106764_100000034942 [0,2,0,0,0,0|1,0,0]=3 19583 B15R1.1321 COC(=O)C(C)CCOc1ccccc1 34a_100000210340_100000034942 [0,2,0,0,0,0|1,0,0]=3 19584 B15R1.1321 COC(=O)C(C)CCOc1ccccc1 7a_100000210340_100000034942 [0,2,0,0,0,0|1,0,0]=3 19585 B15R1.1321 COC(=O)C(C)CCOc1cccnc1 34a_100000210849_100000034942 [0,2,0,0,0,0|2,0,0]=4 19586 B15R1.1321 COC(=O)C(C)CCOc1cccnc1 7a_100000210849_100000034942 [0,2,0,0,0,0|2,0,0]=4 19587 B15R1.1321 COC(=O)C(C)CCOc1ccncc1 34a_100000212176_100000034942 [0,2,0,0,0,0|2,0,0]=4 19588 B15R1.1321 COC(=O)C(C)CCSc1ccccc1 62a_100000034942_100000041952 [0,2,0,0,0,0|1,0,0]=3 19589 B15R1.1321 COC(=O)C(C)CCSc1ccccc1 62a_100000719477_100000034942 [0,2,0,0,0,0|1,0,0]=3 19590 B15R1.1321 COC(=O)C(C)CCSc1ccccn1 62a_100000034942_100011216584 [0,2,0,0,0,0|2,0,0]=4 19591 B15R1.1321 COC(=O)C(C)CCSc1ccccn1 62a_100011216584_100000034942 [0,2,0,0,0,0|2,0,0]=4 19592 B15R1.1321 COC(=O)C(C)CCSc1cccnc1 62a_100000034942_100000210063 [0,2,0,0,0,0|2,0,0]=4 19593 B15R1.1321 COC(=O)C(C)CCSc1cccnc1 62a_100000210063_100000034942 [0,2,0,0,0,0|2,0,0]=4 19594 B15R1.1321 COC(=O)C(C)CCSc1ccncc1 62a_100000034942_100000728582 [0,2,0,0,0,0|2,0,0]=4 19595 B15R1.1321 COC(=O)C(C)CCSc1ccncc1 62a_100000728582_100000034942 [0,2,0,0,0,0|2,0,0]=4 19596 B15R1.1321 COC(=O)C(C)CNCc1ccccc1 34a_100015324214_100000698445 [0,2,0,0,0,0|1,0,0]=3 19597 B15R1.1321 COC(=O)C(C)COCc1ccccc1 34a_100000210790_100000698445 [0,2,0,0,0,0|1,0,0]=3 19598 B15R1.1321 COC(=O)C(C)COCc1ccccc1 34a_100000749362_100015291786 [0,2,0,0,0,0|1,0,0]=3 19599 B15R1.1321 COC(=O)C(C)COCc1ccccc1 7a_100000749362_100000211182 [0,2,0,0,0,0|1,0,0]=3 19600 B15R1.1321 COC(=O)C(C)COCc1ccccn1 34a_100000749362_100000721315 [0,2,0,0,0,0|2,0,0]=4 19601 B15R1.1321 COC(=O)C(C)COCc1ccccn1 7a_100000749362_100000721315 [0,2,0,0,0,0|2,0,0]=4 19602 B15R1.1321 COC(=O)C(C)COCc1cccnc1 34a_100000749362_100000733263 [0,2,0,0,0,0|2,0,0]=4 19603 B15R1.1321 COC(=O)C(C)COCc1cccnc1 7a_100000749362_100000741622 [0,2,0,0,0,0|2,0,0]=4 19604 B15R1.1321 COC(=O)C(C)COCc1ccncc1 7a_100000749362_100015193705 [0,2,0,0,0,0|2,0,0]=4 19605 B15R1.1321 COC(=O)C(C)CSCc1ccccc1 62a_100000211182_100000698445 [0,2,0,0,0,0|1,0,0]=3 19606 B15R1.1321 COC(=O)C(C)CSCc1ccccc1 62a_100000698445_100015291786 [0,2,0,0,0,0|1,0,0]=3 19607 B15R1.1321 COC(=O)C(C)CSCc1ccccn1 62a_100000698445_100000721315 [0,2,0,0,0,0|2,0,0]=4 19608 B15R1.1321 COC(=O)C(C)CSCc1ccccn1 62a_100000721315_100000698445 [0,2,0,0,0,0|2,0,0]=4 19609 B15R1.1321 COC(=O)C(C)CSCc1cccnc1 62a_100000698445_100000741622 [0,2,0,0,0,0|2,0,0]=4 19610 B15R1.1321 COC(=O)C(C)CSCc1cccnc1 62a_100000741622_100000698445 [0,2,0,0,0,0|2,0,0]=4 19611 B15R1.1321 COC(=O)C(C)CSCc1ccncc1 62a_100000698445_100015193705 [0,2,0,0,0,0|2,0,0]=4 19612 B15R1.1321 COC(=O)C(C)CSCc1ccncc1 62a_100015193705_100000698445 [0,2,0,0,0,0|2,0,0]=4 19613 B15R1.1321 COC(=O)C(C)NCCc1ccccc1 2230a_100000106460_100000211248 [0,2,0,0,0,0|1,0,0]=3 19614 B15R1.1321 COC(=O)C(C)NCCc1ccccc1 34a_100000106460_100000211248 [0,2,0,0,0,0|1,0,0]=3 19615 B15R1.1321 COC(=O)C(C)NCCc1cccnc1 2230a_100000736294_100000211248 [0,2,0,0,0,0|2,0,0]=4 19616 B15R1.1321 COC(=O)C(C)OCCc1ccccc1 34a_100000210268_100000211248 [0,2,0,0,0,0|1,0,0]=3 19617 B15R1.1321 COC(=O)C(C)OCCc1ccccc1 34a_100011215400_100000765856 [0,2,0,0,0,0|1,0,0]=3 19618 B15R1.1321 COC(=O)C(C)OCCc1ccccc1 7a_100000210268_100000211248 [0,2,0,0,0,0|1,0,0]=3 19619 B15R1.1321 COC(=O)C(C)OCCc1ccccn1 34a_100000210271_100000211248 [0,2,0,0,0,0|2,0,0]=4 19620 B15R1.1321 COC(=O)C(C)OCCc1cccnc1 34a_100011217484_100000211248 [0,2,0,0,0,0|2,0,0]=4 19621 B15R1.1321 COC(=O)C(C)OCCc1ccncc1 34a_100011216225_100000211248 [0,2,0,0,0,0|2,0,0]=4 19622 B15R1.1321 COC(=O)C(C)SCCc1ccccc1 62a_100000211248_100011218657 [0,2,0,0,0,0|1,0,0]=3 19623 B15R1.1321 COC(=O)C(C)SCCc1ccccc1 62a_100000765856_100000211248 [0,2,0,0,0,0|1,0,0]=3 19624 B15R1.1321 COC(=O)C(C)SCCc1ccccn1 62a_100000211248_100015183660 [0,2,0,0,0,0|2,0,0]=4 19625 B15R1.1321 COC(=O)C(C)SCCc1ccccn1 62a_100015183660_100000211248 [0,2,0,0,0,0|2,0,0]=4 19626 B15R1.1321 COC(=O)C(C)SCCc1cccnc1 62a_100000211248_200011713674 [0,2,0,0,0,0|2,0,0]=4 19627 B15R1.1321 COC(=O)C(C)SCCc1cccnc1 62a_200011713674_100000211248 [0,2,0,0,0,0|2,0,0]=4 19628 B15R1.1321 COC(=O)C(C)SCCc1ccncc1 62a_100000211248_100000723409 [0,2,0,0,0,0|2,0,0]=4 19629 B15R1.1321 COC(=O)C(C)SCCc1ccncc1 62a_100000723409_100000211248 [0,2,0,0,0,0|2,0,0]=4 19630 B15R1.1321 COC(=O)C(C)SCSc1ccccc1 62a_100000211248_100011218342 [0,2,0,0,0,0|2,0,0]=4 19631 B15R1.1321 COC(=O)C(C)SCSc1ccccc1 62a_100011218342_100000211248 [0,2,0,0,0,0|2,0,0]=4 19632 B15R1.1321 COC(=O)C(F)COCc1ccccc1 34a_200009849844_100015291786 [0,2,0,0,0,0|1,0,0]=3 19633 B15R1.1321 COC(=O)C(F)COCc1ccccn1 34a_200009849844_100000721315 [0,2,0,0,0,0|2,0,0]=4 19634 B15R1.1321 COC(=O)C(F)COCc1cccnc1 34a_200009849844_100000733263 [0,2,0,0,0,0|2,0,0]=4 19635 B15R1.1321 COC(=O)[C@H](N)COCc1ccccc1 34a_100000003586_100015291786 [0,2,0,0,0,0|1,0,0]=3 19636 B15R1.1321 COC(=O)[C@H](N)COCc1ccccn1 34a_100000003586_100000721315 [0,2,0,0,0,0|2,0,0]=4 19637 B15R1.1321 COC(=O)[C@H](N)COCc1cccnc1 34a_100000003586_100000733263 [0,2,0,0,0,0|2,0,0]=4 19638 B15R1.1321 NNC(=O)C(N)COCc1ccccc1 34a_100016989258_100015291786 [0,2,0,0,0,0|2,0,0]=4 19639 B15R1.3678 CC(=O)C(C)C(=O)CCc1ccccc1 1458a_100000185753_100000179758 [0,2,0,0,0,0|1,0,1]=4 19640 B15R1.3678 CC(=O)C(C)N(C)CCc1ccccc1 2230a_100000207497_100009814033 [0,2,0,0,0,0|2,0,0]=4 19641 B15R1.3678 CC(=O)C(C)N(C)CCc1ccccc1 269982a_100000207497_100009814033 [0,2,0,0,0,0|2,0,0]=4 19642 B15R1.3678 CC(C(=O)N)C(=O)CCc1ccccc1 1458a_100000185753_100000702099 [0,2,0,0,0,0|1,0,1]=4 19643 B15R1.3678 CC(C(=O)N)N(C)CCc1ccccc1 2230a_100000207497_100000702099 [0,2,0,0,0,0|2,0,0]=4 19644 B15R1.3678 CC(C(=O)N)N(C)CCc1ccccc1 269982a_100000207497_100000184083 [0,2,0,0,0,0|2,0,0]=4 19645 B15R1.3678 CC(C(=O)O)N(C)CCc1ccccc1 269956a_100000749554_100000765856 [0,2,0,0,0,0|1,0,0]=3 19646 B15R1.3678 CC(C(=O)O)N(C)CCc1ccccn1 269956a_100000749554_100015183660 [0,2,0,0,0,0|2,0,0]=4 19647 B15R1.3678 CC(C(=O)O)N(C)CCc1cccnc1 269956a_100000749554_200011713674 [0,2,0,0,0,0|2,0,0]=4 19648 B15R1.3678 CC(C(=O)O)N(C)CCc1ccncc1 269956a_100000749554_100000723409 [0,2,0,0,0,0|2,0,0]=4 19649 B15R1.3678 CC(C(=O)O)N(C)CSc1ccccc1 269956a_100000749554_100011218342 [0,2,0,0,0,0|2,0,0]=4 19650 B15R1.3678 CN(CCc1ccccc1)C(F)C(=O)N 2230a_100000207497_100009813875 [0,2,0,0,0,0|2,0,0]=4 19651 B15R1.3678 CN(CCc1ccccc1)C(F)C(=O)N 269982a_100000207497_100009813875 [0,2,0,0,0,0|2,0,0]=4 19652 B15R1.3678 C[C@@H](OCc1ccccc1)[C@H](N)C(=O)N 34a_100000003557_100015291786 [0,2,0,0,0,0|2,0,0]=4 19653 B15R1.3678 NC(=O)C(F)C(=O)CCc1ccccc1 1458a_100000185753_100009813875 [0,2,0,0,0,0|1,0,1]=4 19654 B15R1.3678 O=C([O-])C(F)C(=O)CCc1ccccc1 1458a_100000185753_100020610796 [0,2,0,0,0,0|0,0,2]=4 19655 B15R1.5336 CCN(CCc1ccccc1)CC(=O)N 2230a_100000741020_100000747473 [0,2,0,0,0,0|2,0,0]=4 19656 B15R1.5336 CCN(CCc1ccccc1)CC(=O)N 269982a_100000741020_100000187820 [0,2,0,0,0,0|2,0,0]=4 19657 B15R1.5336 CCN(CCc1ccccc1)CC(=O)O 269956a_100000746405_100000765856 [0,2,0,0,0,0|1,0,0]=3 19658 B15R1.5336 CCN(CCc1ccccc1)CC(=O)[O-] 269982a_100000741020_100020667443 [0,2,0,0,0,0|1,0,1]=4 19659 B15R1.5336 CCN(CCc1ccccn1)CC(=O)O 269956a_100000746405_100015183660 [0,2,0,0,0,0|2,0,0]=4 19660 B15R1.5336 CCN(CCc1cccnc1)CC(=O)O 269956a_100000746405_200011713674 [0,2,0,0,0,0|2,0,0]=4 19661 B15R1.5336 CCN(CCc1ccncc1)CC(=O)O 269956a_100000746405_100000723409 [0,2,0,0,0,0|2,0,0]=4 19662 B15R1.5336 CCN(CSc1ccccc1)CC(=O)O 269956a_100000746405_100011218342 [0,2,0,0,0,0|2,0,0]=4 19663 B15R1.5336 CC[C@H](CC(=O)O)NCc1ccccc1 269956a_100016995926_100015291786 [0,2,0,0,0,0|1,0,0]=3 19664 B15R1.5336 CC[C@H](CC(=O)O)NCc1ccccn1 269956a_100016995926_100000721315 [0,2,0,0,0,0|2,0,0]=4 19665 B15R1.5336 CC[C@H](CC(=O)O)NCc1cccnc1 269956a_100016995926_100000733263 [0,2,0,0,0,0|2,0,0]=4 19666 B15R1.5336 CC[C@H](CC(=O)O)NCc1ccncc1 269956a_100016995926_100015193705 [0,2,0,0,0,0|2,0,0]=4 19667 B15R1.5336 O=C(O)C[C@@H](CO)NCc1ccccc1 269956a_100009816507_100015291786 [0,2,0,0,0,0|1,0,0]=3 19668 B15R1.5336 O=C(O)C[C@@H](CO)NCc1ccccn1 269956a_100009816507_100000721315 [0,2,0,0,0,0|2,0,0]=4 19669 B15R1.5336 O=C(O)C[C@@H](CO)NCc1cccnc1 269956a_100009816507_100000733263 [0,2,0,0,0,0|2,0,0]=4 19670 B15R1.5336 O=C(O)C[C@@H](CO)NCc1ccncc1 269956a_100009816507_100015193705 [0,2,0,0,0,0|2,0,0]=4 19671 B15R1.5336 O=C([O-])CN(CO)CCc1ccccc1 269956a_100016989150_100000765856 [0,2,0,0,0,0|1,0,1]=4 19672 B15R1.12240 CC(=O)CC(C)(C)OCc1ccccc1 7a_100000210262_100000211182 [0,2,0,0,0,0|2,0,0]=4 19673 B15R1.12240 CC(C)(CC(=O)N)NCc1ccccc1 207a_100000763158_100015611070 [0,2,0,0,0,0|2,0,0]=4 19674 B15R1.12240 CC(C)(CC(=O)N)NCc1ccccc1 2230a_100000763158_100015291786 [0,2,0,0,0,0|2,0,0]=4 19675 B15R1.12240 CC(C)(CC(=O)O)NCc1ccccc1 269956a_100000755897_100015291786 [0,2,0,0,0,0|1,0,0]=3 19676 B15R1.12240 CC(C)(CC(=O)O)NCc1ccccn1 269956a_100000755897_100000721315 [0,2,0,0,0,0|2,0,0]=4 19677 B15R1.12240 CC(C)(CC(=O)O)NCc1cccnc1 269956a_100000755897_100000733263 [0,2,0,0,0,0|2,0,0]=4 19678 B15R1.12240 CC(C)(CC(=O)O)NCc1ccncc1 269956a_100000755897_100015193705 [0,2,0,0,0,0|2,0,0]=4 19679 B15R1.3010 C=C[C@H](NCCc1ccccc1)C(=O)O 269956a_100016992060_100000765856 [0,2,0,0,0,0|1,0,0]=3 19680 B15R1.3010 C=C[C@H](NCCc1ccccn1)C(=O)O 269956a_100016992060_100015183660 [0,2,0,0,0,0|2,0,0]=4 19681 B15R1.3010 C=C[C@H](NCCc1cccnc1)C(=O)O 269956a_100016992060_200011713674 [0,2,0,0,0,0|2,0,0]=4 19682 B15R1.3010 C=C[C@H](NCCc1ccncc1)C(=O)O 269956a_100016992060_100000723409 [0,2,0,0,0,0|2,0,0]=4 19683 B15R1.3010 C=C[C@H](NCSc1ccccc1)C(=O)O 269956a_100016992060_100011218342 [0,2,0,0,0,0|2,0,0]=4 19684 B15R1.3010 CCC(NCCc1ccccc1)C(=O)N 2230a_100000106460_100000750255 [0,2,0,0,0,0|2,0,0]=4 19685 B15R1.3010 CCC(NCCc1ccccc1)C(=O)N 2230a_100000733705_100000765856 [0,2,0,0,0,0|2,0,0]=4 19686 B15R1.3010 CCC(NCCc1ccccc1)C(=O)N 34a_100000106460_100000750255 [0,2,0,0,0,0|2,0,0]=4 19687 B15R1.3010 CCC(NCCc1ccccc1)C(=O)N 34a_100000733705_100000765856 [0,2,0,0,0,0|2,0,0]=4 19688 B15R1.3010 CCC(OCCc1ccccc1)C(=O)N 34a_100000210268_100000750255 [0,2,0,0,0,0|2,0,0]=4 19689 B15R1.3010 CCC(OCCc1ccccc1)C(=O)N 7a_100000210268_100000750255 [0,2,0,0,0,0|2,0,0]=4 19690 B15R1.3010 CCC(SCCc1ccccc1)C(=O)N 62a_100000750255_100011218657 [0,2,0,0,0,0|2,0,0]=4 19691 B15R1.3010 CCC(SCCc1ccccc1)C(=O)N 62a_100000765856_100000750255 [0,2,0,0,0,0|2,0,0]=4 19692 B15R1.3010 CC[C@@H](NCCc1ccccc1)C(=O)O 269956a_100000747097_100000765856 [0,2,0,0,0,0|1,0,0]=3 19693 B15R1.3010 CC[C@@H](NCCc1ccccn1)C(=O)O 269956a_100000747097_100015183660 [0,2,0,0,0,0|2,0,0]=4 19694 B15R1.3010 CC[C@@H](NCCc1cccnc1)C(=O)O 269956a_100000747097_200011713674 [0,2,0,0,0,0|2,0,0]=4 19695 B15R1.3010 CC[C@@H](NCCc1ccncc1)C(=O)O 269956a_100000747097_100000723409 [0,2,0,0,0,0|2,0,0]=4 19696 B15R1.3010 CC[C@@H](NCSc1ccccc1)C(=O)O 269956a_100000747097_100011218342 [0,2,0,0,0,0|2,0,0]=4 19697 B15R1.3010 CN[C@@H](COCc1ccccc1)C(=O)O 269956a_100011417569_200000210301 [0,2,0,0,0,0|1,0,0]=3 19698 B15R1.3010 CN[C@@H](CSCc1ccccc1)C(=O)O 269956a_100011418422_200000210301 [0,2,0,0,0,0|1,0,0]=3 19699 B15R1.3010 CN[C@H](C/C=C/c1ccccc1)C(=O)O 269956a_200011934175_200000210301 [0,2,0,0,0,0|0,0,2]=4 19700 B15R1.3010 N#CC(NCCc1ccccc1)C(=O)N 2230a_100000039599_100000765856 [0,2,0,0,0,0|2,0,0]=4 19701 B15R1.3010 NC(=O)[C@H](CO)NCCc1ccccc1 2230a_100000729942_100000765856 [0,2,0,0,0,0|2,0,0]=4 19702 B15R1.3010 NC(=O)[C@H](CO)NCCc1ccccc1 34a_100000729942_100000765856 [0,2,0,0,0,0|2,0,0]=4 19703 B15R1.3010 O=C(O)C(CO)NCCc1ccccc1 269956a_100000187304_100000765856 [0,2,0,0,0,0|1,0,0]=3 19704 B15R1.3010 O=C(O)C(CO)NCCc1ccccn1 269956a_100000187304_100015183660 [0,2,0,0,0,0|2,0,0]=4 19705 B15R1.3010 O=C(O)C(CO)NCCc1cccnc1 269956a_100000187304_200011713674 [0,2,0,0,0,0|2,0,0]=4 19706 B15R1.3010 O=C(O)C(CO)NCCc1ccncc1 269956a_100000187304_100000723409 [0,2,0,0,0,0|2,0,0]=4 19707 B15R1.3010 O=C(O)C(CO)NCSc1ccccc1 269956a_100000187304_100011218342 [0,2,0,0,0,0|2,0,0]=4 19708 B15R1.3010 [13CH3]N[C@@H](COCc1ccccc1)C(=O)O 269956a_100011417569_200025704644 [0,2,0,0,0,0|1,0,0]=3 19709 B15R1.3010 [13CH3]N[C@@H](CSCc1ccccc1)C(=O)O 269956a_100011418422_200025704644 [0,2,0,0,0,0|1,0,0]=3 19710 B15R1.3010 [13CH3]N[C@H](C/C=C/c1ccccc1)C(=O)O 269956a_200011934175_200025704644 [0,2,0,0,0,0|0,0,2]=4 19711 B15R1.9012 CC(=O)C(C)(C)OCCc1ccccc1 34a_100000747739_100000765856 [0,2,0,0,0,0|2,0,0]=4 19712 B15R1.9012 CC(=O)C(C)(C)OCCc1ccccc1 7a_100000210268_100000075568 [0,2,0,0,0,0|2,0,0]=4 19713 B15R1.9012 CC(=O)C(C)(C)OCCc1ccccc1 7a_100000747739_100000765856 [0,2,0,0,0,0|2,0,0]=4 19714 B15R1.9012 CC(=O)C(C)(C)SCCc1ccccc1 62a_100000075568_100011218657 [0,2,0,0,0,0|2,0,0]=4 19715 B15R1.9012 CC(=O)C(C)(C)SCCc1ccccc1 62a_100000765856_100000075568 [0,2,0,0,0,0|2,0,0]=4 19716 B15R1.9012 CC(C)(CNCc1ccccc1)C(=O)N 207a_100000740840_100015611070 [0,2,0,0,0,0|2,0,0]=4 19717 B15R1.9012 CC(C)(CNCc1ccccc1)C(=O)N 2230a_100000740840_100015291786 [0,2,0,0,0,0|2,0,0]=4 19718 B15R1.9012 CC(C)(CNCc1ccccc1)C(=O)N 270004a_100000740840_100015611070 [0,2,0,0,0,0|2,0,0]=4 19719 B15R1.9012 CC(C)(CNCc1ccccc1)C(=O)N 34a_100000740840_100015291786 [0,2,0,0,0,0|2,0,0]=4 19720 B15R1.9012 CC(C)(CNCc1ccccc1)C(=O)N 34a_100015324214_200009895572 [0,2,0,0,0,0|2,0,0]=4 19721 B15R1.9012 CC(C)(CNCc1ccccc1)C(=O)O 269956a_100000693527_100015291786 [0,2,0,0,0,0|1,0,0]=3 19722 B15R1.9012 CC(C)(CNCc1ccccn1)C(=O)O 269956a_100000693527_100000721315 [0,2,0,0,0,0|2,0,0]=4 19723 B15R1.9012 CC(C)(CNCc1cccnc1)C(=O)O 269956a_100000693527_100000733263 [0,2,0,0,0,0|2,0,0]=4 19724 B15R1.9012 CC(C)(CNCc1ccncc1)C(=O)O 269956a_100000693527_100015193705 [0,2,0,0,0,0|2,0,0]=4 19725 B15R1.9012 CC(C)(COCc1ccccc1)C(=O)N 34a_100000210790_200009895572 [0,2,0,0,0,0|2,0,0]=4 19726 B15R1.9012 CC(C)(CSCc1ccccc1)C(=O)N 62a_100000211182_200009895572 [0,2,0,0,0,0|2,0,0]=4 19727 B15R1.9012 CC(C)(CSCc1ccccc1)C(=O)N 62a_200009895572_100015291786 [0,2,0,0,0,0|2,0,0]=4 19728 B15R1.9012 CC(C)(NCCc1ccccc1)C(=O)N 2230a_100000106460_100000702505 [0,2,0,0,0,0|2,0,0]=4 19729 B15R1.9012 CC(C)(NCCc1ccccc1)C(=O)N 2230a_100000743658_100000765856 [0,2,0,0,0,0|2,0,0]=4 19730 B15R1.9012 CC(C)(NCCc1ccccc1)C(=O)N 34a_100000106460_100000702505 [0,2,0,0,0,0|2,0,0]=4 19731 B15R1.9012 CC(C)(NCCc1ccccc1)C(=O)N 34a_100000743658_100000765856 [0,2,0,0,0,0|2,0,0]=4 19732 B15R1.9012 CC(C)(OCCc1ccccc1)C(=O)N 34a_100000210268_100000702505 [0,2,0,0,0,0|2,0,0]=4 19733 B15R1.9012 CC(C)(OCCc1ccccc1)C(=O)N 34a_100011626353_100000765856 [0,2,0,0,0,0|2,0,0]=4 19734 B15R1.9012 CC(C)(OCCc1ccccc1)C(=O)N 7a_100000210268_100000702505 [0,2,0,0,0,0|2,0,0]=4 19735 B15R1.9012 CC(C)(OCCc1ccccc1)C(=O)N 7a_100011626353_100000765856 [0,2,0,0,0,0|2,0,0]=4 19736 B15R1.9012 CC(C)(ONCc1ccccc1)C(=O)O 269956a_100016989451_100015291786 [0,2,0,0,0,0|2,0,0]=4 19737 B15R1.9012 CC(C)(SCCc1ccccc1)C(=O)N 62a_100000702505_100011218657 [0,2,0,0,0,0|2,0,0]=4 19738 B15R1.9012 CC(C)(SCCc1ccccc1)C(=O)N 62a_100000765856_100000702505 [0,2,0,0,0,0|2,0,0]=4 19739 B15R1.9012 NC(=O)C(F)(F)OCCc1ccccc1 7a_100000210268_100009811971 [0,2,0,0,0,0|2,0,0]=4 19740 B15R1.9012 NC(=O)C(F)(F)SCCc1ccccc1 62a_100000765856_100009811971 [0,2,0,0,0,0|2,0,0]=4 19741 B15R1.9012 NC(=O)C(F)(F)SCCc1ccccc1 62a_100009811971_100011218657 [0,2,0,0,0,0|2,0,0]=4 19742 B15R1.9012 O=C(O)C(F)(F)CNCc1ccccc1 269956a_100000734215_100015291786 [0,2,0,0,0,0|1,0,0]=3 19743 B15R1.9012 O=C(O)C(F)(F)CNCc1ccccn1 269956a_100000734215_100000721315 [0,2,0,0,0,0|2,0,0]=4 19744 B15R1.9012 O=C(O)C(F)(F)CNCc1cccnc1 269956a_100000734215_100000733263 [0,2,0,0,0,0|2,0,0]=4 19745 B15R1.9012 O=C(O)C(F)(F)CNCc1ccncc1 269956a_100000734215_100015193705 [0,2,0,0,0,0|2,0,0]=4 19746 B15R1.9012 O=C([O-])C(F)(F)NCCc1ccccc1 34a_100000106460_100020612412 [0,2,0,0,0,0|1,0,1]=4 19747 B15R1.9012 O=C([O-])C(F)(F)OCCc1ccccc1 34a_100000210268_100020612412 [0,2,0,0,0,0|1,0,1]=4 19748 B15R1.9012 O=C([O-])C(F)(F)SCCc1ccccc1 62a_100000745680_100011218657 [0,2,0,0,0,0|1,0,1]=4 19749 B15R1.9012 O=C([O-])C(F)(F)SCCc1ccccc1 62a_100000765856_100000745680 [0,2,0,0,0,0|1,0,1]=4 19750 B13R1.43 C=CC=CC(=O)CC1CNC(=O)O1 1458a_100016291481_100000181169 [0,0,1,1,0,0|2,0,0]=4 19751 B13R1.43 C=CC=CC(=O)CC1COC(=O)O1 1458a_100016291481_100000073702 [0,0,1,1,0,0|2,0,0]=4 19752 B13R1.43 C=CC=CC(=O)C[C@@H]1CCC(=O)N1 1458a_100016291481_100015189358 [0,0,1,1,0,0|2,0,0]=4 19753 B13R2.1 CNCC1CCc2c1cccc2 2230a_100020632452_200000210301 [1,0,0,1,0,0|2,0,0]=4 19754 B13R2.1 CNCC1CCc2c1cccc2 34a_100020632452_200000210301 [1,0,0,1,0,0|2,0,0]=4 19755 B13R2.1 [13CH3]NCC1CCc2c1cccc2 2230a_100020632452_200025704644 [1,0,0,1,0,0|2,0,0]=4 19756 B13R2.1 [13CH3]NCC1CCc2c1cccc2 34a_100020632452_200025704644 [1,0,0,1,0,0|2,0,0]=4 19757 B13R2.15 CN1CCCC1c2ccccc2 2230a_100000243309_200000210301 [1,0,0,1,0,0|2,0,0]=4 19758 B13R2.15 CN1CCCC1c2ccccc2 269982a_100000243309_200000210301 [1,0,0,1,0,0|2,0,0]=4 19759 B13R2.15 CN1CCCC1c2ccccc2 34a_100000243309_200000210301 [1,0,0,1,0,0|2,0,0]=4 19760 B13R2.15 [13CH3]N1CCCC1c2ccccc2 2230a_100000243309_200025704644 [1,0,0,1,0,0|2,0,0]=4 19761 B13R2.15 [13CH3]N1CCCC1c2ccccc2 269982a_100000243309_200025704644 [1,0,0,1,0,0|2,0,0]=4 19762 B13R2.15 [13CH3]N1CCCC1c2ccccc2 34a_100000243309_200025704644 [1,0,0,1,0,0|2,0,0]=4 19763 B13R2.25 COCC1CC1c2ccccc2 34a_100011997005_200000210301 [1,0,0,1,0,0|2,0,0]=4 19764 B13R2.25 COCC1CC1c2ccccc2 7a_100011997005_200000210301 [1,0,0,1,0,0|2,0,0]=4 19765 B13R2.25 [13CH3]OCC1CC1c2ccccc2 34a_100011997005_200025704644 [1,0,0,1,0,0|2,0,0]=4 19766 B13R2.25 [13CH3]OCC1CC1c2ccccc2 7a_100011997005_200025704644 [1,0,0,1,0,0|2,0,0]=4 19767 B13R2.27 O=C1CCC1Nc2ccccc2 34a_100000106764_100009892977 [1,0,0,1,0,0|1,0,0]=3 19768 B13R2.27 O=C1CCC1Oc2ccccc2 34a_100000210340_100009892977 [1,0,0,1,0,0|1,0,0]=3 19769 B13R2.27 O=C1CCC1Oc2ccccc2 7a_100000210340_100009892977 [1,0,0,1,0,0|1,0,0]=3 19770 B13R2.27 O=C1CCC1Oc2cccnc2 34a_100000210849_100009892977 [1,0,0,1,0,0|2,0,0]=4 19771 B13R2.27 O=C1CCC1Oc2cccnc2 7a_100000210849_100009892977 [1,0,0,1,0,0|2,0,0]=4 19772 B13R2.27 O=C1CCC1Oc2ccncc2 34a_100000212176_100009892977 [1,0,0,1,0,0|2,0,0]=4 19773 B13R2.27 O=C1CCC1Sc2ccccc2 62a_100000719477_100009892977 [1,0,0,1,0,0|1,0,0]=3 19774 B13R2.27 O=C1CCC1Sc2ccccc2 62a_100009892977_100000041952 [1,0,0,1,0,0|1,0,0]=3 19775 B13R2.27 O=C1CCC1Sc2ccccn2 62a_100009892977_100011216584 [1,0,0,1,0,0|2,0,0]=4 19776 B13R2.27 O=C1CCC1Sc2ccccn2 62a_100011216584_100009892977 [1,0,0,1,0,0|2,0,0]=4 19777 B13R2.27 O=C1CCC1Sc2cccnc2 62a_100000210063_100009892977 [1,0,0,1,0,0|2,0,0]=4 19778 B13R2.27 O=C1CCC1Sc2cccnc2 62a_100009892977_100000210063 [1,0,0,1,0,0|2,0,0]=4 19779 B13R2.27 O=C1CCC1Sc2ccncc2 62a_100000728582_100009892977 [1,0,0,1,0,0|2,0,0]=4 19780 B13R2.27 O=C1CCC1Sc2ccncc2 62a_100009892977_100000728582 [1,0,0,1,0,0|2,0,0]=4 19781 B13R2.1028 C=CCSC1Cc2c1cccc2 62a_100000210623_100009813401 [1,0,0,1,0,0|2,0,0]=4 19782 B13R2.1028 C=CCSC1Cc2c1cccc2 62a_100009813401_100000210623 [1,0,0,1,0,0|2,0,0]=4 19783 B13R2.1028 O=CCSC1Cc2c1cccc2 62a_100009813401_200015260668 [1,0,0,1,0,0|1,0,0]=3 19784 B13R2.1028 O=CCSC1Cc2c1cccc2 62a_200015260668_100009813401 [1,0,0,1,0,0|1,0,0]=3 19785 B13R2.1028 OCCSC1Cc2c1cccc2 62a_100000211926_100009813401 [1,0,0,1,0,0|1,0,1]=4 19786 B13R2.1028 OCCSC1Cc2c1cccc2 62a_100009813401_100000211926 [1,0,0,1,0,0|1,0,1]=4 19787 B13R2.1613 CNC1CCCc2c1cccc2 269862a_106832991636_100000210882 [1,0,0,1,0,0|2,0,0]=4 19788 B13R2.1613 CN[C@H]1CCCc2c1cccc2 34a_100020654734_200000210301 [1,0,0,1,0,0|2,0,0]=4 19789 B13R2.1613 COC1CCCc2c1cccc2 34a_100000183665_200000210301 [1,0,0,1,0,0|2,0,0]=4 19790 B13R2.1613 COC1CCCc2c1cccc2 7a_100000183665_200000210301 [1,0,0,1,0,0|2,0,0]=4 19791 B13R2.1613 [13CH3]N[C@H]1CCCc2c1cccc2 34a_100020654734_200025704644 [1,0,0,1,0,0|2,0,0]=4 19792 B13R2.1613 [13CH3]OC1CCCc2c1cccc2 34a_100000183665_200025704644 [1,0,0,1,0,0|2,0,0]=4 19793 B13R2.1613 [13CH3]OC1CCCc2c1cccc2 7a_100000183665_200025704644 [1,0,0,1,0,0|2,0,0]=4 19794 B13R2.2382 c1ccc(cc1)CNCC2CO2 2230a_100015324214_100011216344 [1,0,0,1,0,0|1,0,1]=4 19795 B13R2.2382 c1ccc(cc1)CNCC2CO2 34a_100015324214_102125554688 [1,0,0,1,0,0|1,0,1]=4 19796 B13R2.2382 c1ccc(cc1)COCC2CO2 34a_100000210790_102125554688 [1,0,0,1,0,0|1,0,1]=4 19797 B13R2.2382 c1ccc(cc1)COCC2CO2 7a_100000210790_102125554688 [1,0,0,1,0,0|1,0,1]=4 19798 B13R2.2382 c1ccc(cc1)COC[C@@H]2CO2 34a_100000757423_100015291786 [1,0,0,1,0,0|1,0,1]=4 19799 B13R2.2382 c1ccc(cc1)COC[C@@H]2CO2 7a_100000210790_100000745022 [1,0,0,1,0,0|1,0,1]=4 19800 B13R2.2382 c1ccc(cc1)CSCC2CO2 62a_100000211182_102125554688 [1,0,0,1,0,0|1,0,1]=4 19801 B13R2.2382 c1ccc(cc1)CSCC2CO2 62a_102125554688_100015291786 [1,0,0,1,0,0|1,0,1]=4 19802 B13R2.2382 c1ccc(cc1)CSC[C@@H]2CO2 62a_100000211182_100000745022 [1,0,0,1,0,0|1,0,1]=4 19803 B13R2.2382 c1ccc(cc1)CSC[C@@H]2CO2 62a_100000745022_100015291786 [1,0,0,1,0,0|1,0,1]=4 19804 B13R2.2382 c1ccc(cc1)NCCC2CO2 34a_100000106764_100000732470 [1,0,0,1,0,0|1,0,1]=4 19805 B13R2.2382 c1ccc(cc1)OCCC2CO2 34a_100000210340_100000732470 [1,0,0,1,0,0|1,0,1]=4 19806 B13R2.2382 c1ccc(cc1)OCCC2CO2 7a_100000210340_100000732470 [1,0,0,1,0,0|1,0,1]=4 19807 B13R2.2382 c1ccc(cc1)SCCC2CO2 62a_100000719477_100000732470 [1,0,0,1,0,0|1,0,1]=4 19808 B13R2.2382 c1ccc(cc1)SCCC2CO2 62a_100000732470_100000041952 [1,0,0,1,0,0|1,0,1]=4 19809 B13R2.2383 c1ccc(cc1)NCC2CCO2 34a_100000106764_100000103362 [1,0,0,1,0,0|1,0,1]=4 19810 B13R2.2383 c1ccc(cc1)OCC2CCO2 34a_100000210340_100000103362 [1,0,0,1,0,0|1,0,1]=4 19811 B13R2.2383 c1ccc(cc1)OCC2CCO2 7a_100000210340_100000103362 [1,0,0,1,0,0|1,0,1]=4 19812 B13R2.2383 c1ccc(cc1)SCC2CCO2 62a_100000103362_100000041952 [1,0,0,1,0,0|1,0,1]=4 19813 B13R2.2383 c1ccc(cc1)SCC2CCO2 62a_100000719477_100000103362 [1,0,0,1,0,0|1,0,1]=4 19814 B13R2.10 O=C1C=C(CC1)c2ccccc2 271570a_100010737933_100000210277 [0,0,0,1,1,0|1,0,1]=4 19815 B13R2.31 O=C1CC(C1)Sc2ccccc2 62a_100009894365_100000041952 [0,0,0,1,1,0|2,0,0]=4 19816 B13R2.72 CC(=O)C1CCc2c1cccc2 1458a_100000750891_200000210301 [0,0,0,1,1,0|1,0,0]=3 19817 B13R2.72 [13CH3]C(=O)C1CCc2c1cccc2 1458a_100000750891_200025704644 [0,0,0,1,1,0|1,0,0]=3 19818 B13R2.423 CC(=O)C1CC1c2cccnc2 1458a_100000746292_200000210301 [0,0,0,1,1,0|2,0,0]=4 19819 B13R2.423 CC(=O)[C@@H]1C[C@H]1c2ccccc2 1458a_100009815801_200000210301 [0,0,0,1,1,0|1,0,0]=3 19820 B13R2.423 [13CH3]C(=O)C1CC1c2cccnc2 1458a_100000746292_200025704644 [0,0,0,1,1,0|2,0,0]=4 19821 B13R2.423 [13CH3]C(=O)[C@@H]1C[C@H]1c2ccccc2 1458a_100009815801_200025704644 [0,0,0,1,1,0|1,0,0]=3 19822 B15R2.6 C=C(C)CN[C@H]1CCc2c1cccc2 2230a_100016989578_100000748629 [0,0,0,1,0,1|2,0,0]=4 19823 B15R2.6 C=C(C)CN[C@H]1CCc2c1cccc2 34a_100016989578_100000748629 [0,0,0,1,0,1|2,0,0]=4 19824 B15R2.6 C=C(C)COC1CCc2c1cccc2 34a_100000212247_100000748629 [0,0,0,1,0,1|2,0,0]=4 19825 B15R2.6 C=C(C)COC1CCc2c1cccc2 7a_100000212247_100000748629 [0,0,0,1,0,1|2,0,0]=4 19826 B15R2.6 C=C(C)CSC1CCc2c1cccc2 62a_100000748629_200000721974 [0,0,0,1,0,1|2,0,0]=4 19827 B15R2.6 C=C(F)CN[C@H]1CCc2c1cccc2 2230a_100016989578_100009893438 [0,0,0,1,0,1|2,0,0]=4 19828 B15R2.6 C=C(F)CN[C@H]1CCc2c1cccc2 34a_100016989578_100009893438 [0,0,0,1,0,1|2,0,0]=4 19829 B15R2.6 C=C(F)COC1CCc2c1cccc2 34a_100000212247_100009893438 [0,0,0,1,0,1|2,0,0]=4 19830 B15R2.6 C=C(F)COC1CCc2c1cccc2 7a_100000212247_100000042424 [0,0,0,1,0,1|2,0,0]=4 19831 B15R2.6 C=C(F)CSC1CCc2c1cccc2 62a_100000042424_200000721974 [0,0,0,1,0,1|2,0,0]=4 19832 B15R2.6 CC(=O)NCC1CCc2c1cccc2 11a_100020632452_100015343762 [0,0,0,1,0,1|1,0,0]=3 19833 B15R2.6 CC(=O)NCC1CCc2c1cccc2 1626a_100020632452_100015343762 [0,0,0,1,0,1|1,0,0]=3 19834 B15R2.6 CC(=O)NCC1CCc2c1cccc2 240690a_100020632452_100015343762 [0,0,0,1,0,1|1,0,0]=3 19835 B15R2.6 CC(=O)NCC1CCc2c1cccc2 527a_100020632452_100103153847 [0,0,0,1,0,1|1,0,0]=3 19836 B15R2.6 CC(O)CNC1CCc2c1cccc2 2230a_100000210904_200000721974 [0,0,0,1,0,1|1,0,1]=4 19837 B15R2.6 CC(O)CNC1CCc2c1cccc2 269862a_100000210904_100000212051 [0,0,0,1,0,1|1,0,1]=4 19838 B15R2.6 CC(O)CN[C@H]1CCc2c1cccc2 2230a_100016989578_100011218427 [0,0,0,1,0,1|1,0,1]=4 19839 B15R2.6 CC(O)CN[C@H]1CCc2c1cccc2 34a_100016989578_100011218427 [0,0,0,1,0,1|1,0,1]=4 19840 B15R2.6 CC(O)COC1CCc2c1cccc2 34a_100000212247_100011218427 [0,0,0,1,0,1|1,0,1]=4 19841 B15R2.6 CC(O)COC1CCc2c1cccc2 7a_100000212247_100011218427 [0,0,0,1,0,1|1,0,1]=4 19842 B15R2.6 CC(O)CSC1CCc2c1cccc2 62a_100011218427_200000721974 [0,0,0,1,0,1|1,0,1]=4 19843 B15R2.6 C[C@@H](O)CN[C@H]1CCc2c1cccc2 2230a_100016989578_100009817552 [0,0,0,1,0,1|1,0,1]=4 19844 B15R2.6 C[C@@H](O)CN[C@H]1CCc2c1cccc2 34a_100016989578_100009817552 [0,0,0,1,0,1|1,0,1]=4 19845 B15R2.6 C[C@@H](O)COC1CCc2c1cccc2 34a_100000212247_100009817552 [0,0,0,1,0,1|1,0,1]=4 19846 B15R2.6 C[C@@H](O)COC1CCc2c1cccc2 7a_100000212247_100009817552 [0,0,0,1,0,1|1,0,1]=4 19847 B15R2.6 C[C@@H](O)CSC1CCc2c1cccc2 62a_100009817552_200000721974 [0,0,0,1,0,1|1,0,1]=4 19848 B15R2.6 NC(=O)CNC1CCc2c1cccc2 2230a_100000711301_200000721974 [0,0,0,1,0,1|1,0,0]=3 19849 B15R2.6 NC(=O)CNC1COc2c1cccc2 2230a_100000747519_100000747473 [0,0,0,1,0,1|2,0,0]=4 19850 B15R2.6 NC(=O)CN[C@H]1CCc2c1cccc2 2230a_100016989578_100000747473 [0,0,0,1,0,1|1,0,0]=3 19851 B15R2.6 NC(=O)CN[C@H]1CCc2c1cccc2 34a_100016989578_100000187820 [0,0,0,1,0,1|1,0,0]=3 19852 B15R2.6 NC(=O)COC1CCc2c1cccc2 34a_100000212247_100000187820 [0,0,0,1,0,1|1,0,0]=3 19853 B15R2.6 NC(=O)COC1CCc2c1cccc2 7a_100000212247_100000187820 [0,0,0,1,0,1|1,0,0]=3 19854 B15R2.6 NC(=O)CSC1CCc2c1cccc2 62a_100000747473_200000721974 [0,0,0,1,0,1|1,0,0]=3 19855 B15R2.6 O=C(O)CNC1CCc2c1cccc2 269956a_100016091260_200000721974 [0,0,0,1,0,1|0,0,0]=2 19856 B15R2.6 O=C([O-])CN[C@H]1CCc2c1cccc2 34a_100016989578_100020667443 [0,0,0,1,0,1|0,0,1]=3 19857 B15R2.6 O=C([O-])COC1CCc2c1cccc2 34a_100000212247_100020667443 [0,0,0,1,0,1|0,0,1]=3 19858 B15R2.6 O=C([O-])CSC1CCc2c1cccc2 62a_100020667443_200000721974 [0,0,0,1,0,1|0,0,1]=3 19859 B15R2.6 O=[N+]([O-])CN[C@H]1CCc2c1cccc2 34a_100016989578_100000761209 [0,0,0,1,0,1|1,0,1]=4 19860 B15R2.6 O=[N+]([O-])COC1CCc2c1cccc2 34a_100000212247_100000761209 [0,0,0,1,0,1|1,0,1]=4 19861 B15R2.31 O=C1CN(CCN1)Cc2ccccc2 2230a_100000184651_100015291786 [0,0,0,1,0,1|2,0,0]=4 19862 B15R2.31 O=C1CN(CCN1)Cc2ccccc2 270004a_100000184651_100015611070 [0,0,0,1,0,1|2,0,0]=4 19863 B15R2.31 O=C1CN(CCO1)Cc2ccccc2 2230a_100000131268_100015291786 [0,0,0,1,0,1|2,0,0]=4 19864 B15R2.31 O=C1CN(CCO1)Cc2ccccc2 270004a_100000131268_100015611070 [0,0,0,1,0,1|2,0,0]=4 19865 B15R2.31 OC1CCCN(C1)Cc2ccccc2 2230a_100000211013_100015291786 [0,0,0,1,0,1|1,0,1]=4 19866 B15R2.31 OC1CCCN(C1)Cc2ccccc2 269982a_100000211013_100000211182 [0,0,0,1,0,1|1,0,1]=4 19867 B15R2.31 OC1CCCN(C1)Cc2ccccc2 270004a_100000211013_100015611070 [0,0,0,1,0,1|1,0,1]=4 19868 B15R2.63 CC(=O)N1CCCC1c2ccccc2 11a_100000243309_100015343762 [0,0,0,1,0,1|1,0,0]=3 19869 B15R2.63 CC(=O)N1CCCC1c2ccccc2 1626a_100000243309_100015343762 [0,0,0,1,0,1|1,0,0]=3 19870 B15R2.63 CC(=O)N1CCCC1c2ccccc2 240690a_100000243309_100015343762 [0,0,0,1,0,1|1,0,0]=3 19871 B15R2.63 CC(=O)N1CCCC1c2ccccc2 527a_100000243309_100103153847 [0,0,0,1,0,1|1,0,0]=3 19872 B15R2.63 CC(=O)N1CCCC1c2ccccn2 11a_100000744244_100015343762 [0,0,0,1,0,1|2,0,0]=4 19873 B15R2.63 CC(=O)N1CCCC1c2ccccn2 1626a_100000744244_100015343762 [0,0,0,1,0,1|2,0,0]=4 19874 B15R2.63 CC(=O)N1CCCC1c2ccccn2 240690a_100000744244_100015343762 [0,0,0,1,0,1|2,0,0]=4 19875 B15R2.63 CC(=O)N1CCCC1c2ccccn2 527a_100000744244_100103153847 [0,0,0,1,0,1|2,0,0]=4 19876 B15R2.63 CC(=O)N1CCCC1c2cccnc2 11a_100000233489_100015343762 [0,0,0,1,0,1|2,0,0]=4 19877 B15R2.63 CC(=O)N1CCCC1c2cccnc2 240690a_100000233489_100015343762 [0,0,0,1,0,1|2,0,0]=4 19878 B15R2.63 CC(=O)N1CCCC1c2cccnc2 527a_100000233489_100103153847 [0,0,0,1,0,1|2,0,0]=4 19879 B15R2.63 CC(=O)N1CCCC1c2ccncc2 240690a_106446545576_100015343762 [0,0,0,1,0,1|2,0,0]=4 19880 B15R2.63 CC(=O)N1CCCC1c2ccncc2 527a_106446545576_100103153847 [0,0,0,1,0,1|2,0,0]=4 19881 B15R2.63 CC(=O)N1CCSC1c2ccccc2 11a_100000215944_100015343762 [0,0,0,1,0,1|2,0,0]=4 19882 B15R2.63 CC(=O)N1CCSC1c2ccccc2 240690a_100000215944_100015343762 [0,0,0,1,0,1|2,0,0]=4 19883 B15R2.63 CC(=O)N1CCSC1c2ccccc2 527a_100000215944_100103153847 [0,0,0,1,0,1|2,0,0]=4 19884 B15R2.283 O=C1CC(CN1)NCc2ccccc2 207a_100000697751_100015611070 [0,0,0,1,0,1|2,0,0]=4 19885 B15R2.283 O=C1CC(CN1)NCc2ccccc2 2230a_100000697751_100015291786 [0,0,0,1,0,1|2,0,0]=4 19886 B15R2.283 O=C1CC(CN1)OCc2ccccc2 34a_100000690082_100015291786 [0,0,0,1,0,1|2,0,0]=4 19887 B15R2.283 O=C1CCC(C1)OCc2ccccc2 34a_100012614533_100015291786 [0,0,0,1,0,1|1,0,0]=3 19888 B15R2.283 O=C1CCC(C1)OCc2ccccn2 34a_100012614533_100000721315 [0,0,0,1,0,1|2,0,0]=4 19889 B15R2.283 O=C1CCC(C1)OCc2cccnc2 34a_100012614533_100000733263 [0,0,0,1,0,1|2,0,0]=4 19890 B15R2.283 O=C1CC[C@H](N1)COc2ccccc2 7a_100000210340_100015189358 [0,0,0,1,0,1|1,0,0]=3 19891 B15R2.283 O=C1CC[C@H](N1)COc2cccnc2 7a_100000210849_100015189358 [0,0,0,1,0,1|2,0,0]=4 19892 B15R2.283 O=C1CC[C@H](N1)CSc2ccccc2 62a_100000719477_100015189358 [0,0,0,1,0,1|1,0,0]=3 19893 B15R2.283 O=C1CC[C@H](N1)CSc2ccccc2 62a_100015189358_100000041952 [0,0,0,1,0,1|1,0,0]=3 19894 B15R2.283 O=C1CC[C@H](N1)CSc2ccccn2 62a_100011216584_100015189358 [0,0,0,1,0,1|2,0,0]=4 19895 B15R2.283 O=C1CC[C@H](N1)CSc2ccccn2 62a_100015189358_100011216584 [0,0,0,1,0,1|2,0,0]=4 19896 B15R2.283 O=C1CC[C@H](N1)CSc2cccnc2 62a_100000210063_100015189358 [0,0,0,1,0,1|2,0,0]=4 19897 B15R2.283 O=C1CC[C@H](N1)CSc2cccnc2 62a_100015189358_100000210063 [0,0,0,1,0,1|2,0,0]=4 19898 B15R2.283 O=C1CC[C@H](N1)CSc2ccncc2 62a_100000728582_100015189358 [0,0,0,1,0,1|2,0,0]=4 19899 B15R2.283 O=C1CC[C@H](N1)CSc2ccncc2 62a_100015189358_100000728582 [0,0,0,1,0,1|2,0,0]=4 19900 B15R2.283 O=C1CN(CN1)CCc2ccccc2 2230a_200000708111_100000765856 [0,0,0,1,0,1|2,0,0]=4 19901 B15R2.283 O=C1NCC(O1)CNc2ccccc2 34a_100000106764_100000181169 [0,0,0,1,0,1|1,0,0]=3 19902 B15R2.283 O=C1NCC(O1)COc2ccccc2 34a_100000210340_100000181169 [0,0,0,1,0,1|1,0,0]=3 19903 B15R2.283 O=C1NCC(O1)COc2ccccc2 7a_100000210340_100000181169 [0,0,0,1,0,1|1,0,0]=3 19904 B15R2.283 O=C1NCC(O1)COc2cccnc2 34a_100000210849_100000181169 [0,0,0,1,0,1|2,0,0]=4 19905 B15R2.283 O=C1NCC(O1)COc2cccnc2 7a_100000210849_100000181169 [0,0,0,1,0,1|2,0,0]=4 19906 B15R2.283 O=C1NCC(O1)COc2ccncc2 34a_100000212176_100000181169 [0,0,0,1,0,1|2,0,0]=4 19907 B15R2.283 O=C1NCC(O1)CSc2ccccc2 62a_100000181169_100000041952 [0,0,0,1,0,1|1,0,0]=3 19908 B15R2.283 O=C1NCC(O1)CSc2ccccc2 62a_100000719477_100000181169 [0,0,0,1,0,1|1,0,0]=3 19909 B15R2.283 O=C1NCC(O1)CSc2ccccn2 62a_100000181169_100011216584 [0,0,0,1,0,1|2,0,0]=4 19910 B15R2.283 O=C1NCC(O1)CSc2ccccn2 62a_100011216584_100000181169 [0,0,0,1,0,1|2,0,0]=4 19911 B15R2.283 O=C1NCC(O1)CSc2cccnc2 62a_100000181169_100000210063 [0,0,0,1,0,1|2,0,0]=4 19912 B15R2.283 O=C1NCC(O1)CSc2cccnc2 62a_100000210063_100000181169 [0,0,0,1,0,1|2,0,0]=4 19913 B15R2.283 O=C1NCC(O1)CSc2ccncc2 62a_100000181169_100000728582 [0,0,0,1,0,1|2,0,0]=4 19914 B15R2.283 O=C1NCC(O1)CSc2ccncc2 62a_100000728582_100000181169 [0,0,0,1,0,1|2,0,0]=4 19915 B15R2.283 O=C1N[C@H](CO1)CNc2ccccc2 34a_100000106764_100015307671 [0,0,0,1,0,1|2,0,0]=4 19916 B15R2.283 O=C1N[C@H](CO1)COc2ccccc2 34a_100000210340_100015307671 [0,0,0,1,0,1|2,0,0]=4 19917 B15R2.283 O=C1N[C@H](CO1)COc2ccccc2 7a_100000210340_100015307671 [0,0,0,1,0,1|2,0,0]=4 19918 B15R2.283 O=C1N[C@H](CO1)CSc2ccccc2 62a_100000719477_100015307671 [0,0,0,1,0,1|2,0,0]=4 19919 B15R2.283 O=C1N[C@H](CO1)CSc2ccccc2 62a_100015307671_100000041952 [0,0,0,1,0,1|2,0,0]=4 19920 B15R2.283 O=C1OCC(O1)CNc2ccccc2 34a_100000106764_100000073702 [0,0,0,1,0,1|1,0,0]=3 19921 B15R2.283 O=C1OCC(O1)COc2ccccc2 34a_100000210340_100000073702 [0,0,0,1,0,1|1,0,0]=3 19922 B15R2.283 O=C1OCC(O1)COc2cccnc2 34a_100000210849_100000073702 [0,0,0,1,0,1|2,0,0]=4 19923 B15R2.283 O=C1OCC(O1)COc2ccncc2 34a_100000212176_100000073702 [0,0,0,1,0,1|2,0,0]=4 19924 B15R2.283 O=C1OCC(O1)CSc2ccccc2 62a_100000073702_100000041952 [0,0,0,1,0,1|1,0,0]=3 19925 B15R2.283 O=C1OCC(O1)CSc2ccccc2 62a_100000719477_100000073702 [0,0,0,1,0,1|1,0,0]=3 19926 B15R2.283 O=C1OCC(O1)CSc2ccccn2 62a_100000073702_100011216584 [0,0,0,1,0,1|2,0,0]=4 19927 B15R2.283 O=C1OCC(O1)CSc2ccccn2 62a_100011216584_100000073702 [0,0,0,1,0,1|2,0,0]=4 19928 B15R2.283 O=C1OCC(O1)CSc2cccnc2 62a_100000073702_100000210063 [0,0,0,1,0,1|2,0,0]=4 19929 B15R2.283 O=C1OCC(O1)CSc2cccnc2 62a_100000210063_100000073702 [0,0,0,1,0,1|2,0,0]=4 19930 B15R2.283 O=C1OCC(O1)CSc2ccncc2 62a_100000073702_100000728582 [0,0,0,1,0,1|2,0,0]=4 19931 B15R2.283 O=C1OCC(O1)CSc2ccncc2 62a_100000728582_100000073702 [0,0,0,1,0,1|2,0,0]=4 19932 B15R2.283 O=C1OCC(O1)NCc2ccccc2 34a_100015324214_100000032252 [0,0,0,1,0,1|1,0,0]=3 19933 B15R2.283 O=C1OCC(O1)OCc2ccccc2 34a_100000210790_100000032252 [0,0,0,1,0,1|1,0,0]=3 19934 B15R2.283 O=C1OCC(O1)SCc2ccccc2 62a_100000211182_100000032252 [0,0,0,1,0,1|1,0,0]=3 19935 B15R2.283 O=C1OCC(O1)SCc2ccccn2 62a_100000721315_100000032252 [0,0,0,1,0,1|2,0,0]=4 19936 B15R2.283 O=C1OCC(O1)SCc2cccnc2 62a_100000741622_100000032252 [0,0,0,1,0,1|2,0,0]=4 19937 B15R2.283 O=C1OCC(O1)SCc2ccncc2 62a_100015193705_100000032252 [0,0,0,1,0,1|2,0,0]=4 19938 B15R2.283 OC1CCC(C1)NCc2ccccc2 270004a_100015324214_100012614533 [0,0,0,1,0,1|1,0,1]=4 19939 B15R2.283 OC1CCN(C1)CCc2ccccc2 2230a_100011215560_100000765856 [0,0,0,1,0,1|1,0,1]=4 19940 B15R2.283 OC1CCN(C1)CCc2ccccc2 269982a_100011215560_100000765856 [0,0,0,1,0,1|1,0,1]=4 19941 B15R2.283 O[C@@H]1CC[C@@H](C1)NCc2ccccc2 207a_100015195300_100015611070 [0,0,0,1,0,1|1,0,1]=4 19942 B15R2.283 O[C@@H]1CC[C@@H](C1)NCc2ccccc2 2230a_100015195300_100015291786 [0,0,0,1,0,1|1,0,1]=4 19943 B15R2.283 O[C@@H]1CC[C@@H](C1)NCc2ccccc2 270004a_100015195300_100015611070 [0,0,0,1,0,1|1,0,1]=4 19944 B15R2.617 C=C1CC(C1)CNCc2ccccc2 207a_100102567296_100015611070 [0,0,0,1,0,1|2,0,0]=4 19945 B15R2.617 C=C1CC(C1)CNCc2ccccc2 2230a_100102567296_100015291786 [0,0,0,1,0,1|2,0,0]=4 19946 B15R2.617 C=C1CC(C1)CNCc2ccccc2 270004a_100102567296_100015611070 [0,0,0,1,0,1|2,0,0]=4 19947 B15R2.617 C=C1CC(C1)CNCc2ccccc2 34a_100102567296_100015291786 [0,0,0,1,0,1|2,0,0]=4 19948 B15R2.617 C=C1CC(C1)COCc2ccccc2 34a_100011011225_100015291786 [0,0,0,1,0,1|2,0,0]=4 19949 B15R2.617 C=C1CC(C1)NCCc2ccccc2 2230a_100132301982_100000765856 [0,0,0,1,0,1|2,0,0]=4 19950 B15R2.617 O=C1CC(C1)CNCc2ccccc2 2230a_100015324214_100009874392 [0,0,0,1,0,1|1,0,0]=3 19951 B15R2.617 O=C1CC(C1)COCc2ccccc2 34a_100000101936_100015291786 [0,0,0,1,0,1|1,0,0]=3 19952 B15R2.617 O=C1CC(C1)COCc2ccccc2 7a_100000210790_100009874392 [0,0,0,1,0,1|1,0,0]=3 19953 B15R2.617 O=C1CC(C1)COCc2ccccn2 34a_100000101936_100000721315 [0,0,0,1,0,1|2,0,0]=4 19954 B15R2.617 O=C1CC(C1)COCc2cccnc2 34a_100000101936_100000733263 [0,0,0,1,0,1|2,0,0]=4 19955 B15R2.617 O=C1CC(C1)CSCc2ccccc2 62a_100000211182_100009874392 [0,0,0,1,0,1|1,0,0]=3 19956 B15R2.617 O=C1CC(C1)CSCc2ccccc2 62a_100009874392_100015291786 [0,0,0,1,0,1|1,0,0]=3 19957 B15R2.617 O=C1CC(C1)CSCc2ccccn2 62a_100000721315_100009874392 [0,0,0,1,0,1|2,0,0]=4 19958 B15R2.617 O=C1CC(C1)CSCc2ccccn2 62a_100009874392_100000721315 [0,0,0,1,0,1|2,0,0]=4 19959 B15R2.617 O=C1CC(C1)CSCc2cccnc2 62a_100000741622_100009874392 [0,0,0,1,0,1|2,0,0]=4 19960 B15R2.617 O=C1CC(C1)CSCc2cccnc2 62a_100009874392_100000741622 [0,0,0,1,0,1|2,0,0]=4 19961 B15R2.617 O=C1CC(C1)CSCc2ccncc2 62a_100009874392_100015193705 [0,0,0,1,0,1|2,0,0]=4 19962 B15R2.617 O=C1CC(C1)CSCc2ccncc2 62a_100015193705_100009874392 [0,0,0,1,0,1|2,0,0]=4 19963 B15R2.617 O=C1CC(C1)SCCc2ccccc2 62a_100009894365_100011218657 [0,0,0,1,0,1|1,0,0]=3 19964 B15R2.617 O=C1CC(C1)SCCc2ccccn2 62a_100009894365_100015183660 [0,0,0,1,0,1|2,0,0]=4 19965 B15R2.617 O=C1CC(C1)SCCc2cccnc2 62a_100009894365_200011713674 [0,0,0,1,0,1|2,0,0]=4 19966 B15R2.617 O=C1CC(C1)SCCc2ccncc2 62a_100009894365_100000723409 [0,0,0,1,0,1|2,0,0]=4 19967 B15R2.617 O=C1CC(C1)SCSc2ccccc2 62a_100009894365_100011218342 [0,0,0,1,0,1|2,0,0]=4 19968 B15R2.617 OC1CC(C1)CNCc2ccccc2 207a_100016992100_100015611070 [0,0,0,1,0,1|1,0,1]=4 19969 B15R2.617 OC1CC(C1)CNCc2ccccc2 2230a_100016992100_100015291786 [0,0,0,1,0,1|1,0,1]=4 19970 B15R2.617 OC1CC(C1)CNCc2ccccc2 270004a_100016992100_100015611070 [0,0,0,1,0,1|1,0,1]=4 19971 B15R2.617 OC1CN(C1)CCCc2ccccc2 269982a_100000749847_100000211621 [0,0,0,1,0,1|1,0,1]=4 19972 B15R2.617 O[C@H]1C[C@@H](C1)NCCc2ccccc2 2230a_100020629032_100000765856 [0,0,0,1,0,1|1,0,1]=4 19973 B15R2.1222 C=C(C)CN1C[C@@H]1Cc2ccccc2 2230a_100016998360_100000748629 [0,0,0,1,0,1|2,0,0]=4 19974 B15R2.1222 C=C(C)CN1C[C@@H]1Cc2ccccc2 269982a_100016998360_100000748629 [0,0,0,1,0,1|2,0,0]=4 19975 B15R2.1222 C=C(C)CN1C[C@@H]1Cc2ccccc2 34a_100016998360_100000748629 [0,0,0,1,0,1|2,0,0]=4 19976 B15R2.1222 C=C(F)CN1C[C@@H]1Cc2ccccc2 2230a_100016998360_100009893438 [0,0,0,1,0,1|2,0,0]=4 19977 B15R2.1222 C=C(F)CN1C[C@@H]1Cc2ccccc2 269982a_100016998360_100009893438 [0,0,0,1,0,1|2,0,0]=4 19978 B15R2.1222 C=C(F)CN1C[C@@H]1Cc2ccccc2 34a_100016998360_100009893438 [0,0,0,1,0,1|2,0,0]=4 19979 B15R2.1222 CC(O)CN1C[C@@H]1Cc2ccccc2 2230a_100016998360_100011218427 [0,0,0,1,0,1|1,0,1]=4 19980 B15R2.1222 CC(O)CN1C[C@@H]1Cc2ccccc2 269982a_100016998360_100011218427 [0,0,0,1,0,1|1,0,1]=4 19981 B15R2.1222 CC(O)CN1C[C@@H]1Cc2ccccc2 34a_100016998360_100011218427 [0,0,0,1,0,1|1,0,1]=4 19982 B15R2.1222 C[C@@H](O)CN1C[C@@H]1Cc2ccccc2 2230a_100016998360_100009817552 [0,0,0,1,0,1|1,0,1]=4 19983 B15R2.1222 C[C@@H](O)CN1C[C@@H]1Cc2ccccc2 269982a_100016998360_100009817552 [0,0,0,1,0,1|1,0,1]=4 19984 B15R2.1222 C[C@@H](O)CN1C[C@@H]1Cc2ccccc2 34a_100016998360_100009817552 [0,0,0,1,0,1|1,0,1]=4 19985 B15R2.1222 NC(=O)CN1C[C@@H]1Cc2ccccc2 2230a_100016998360_100000747473 [0,0,0,1,0,1|1,0,0]=3 19986 B15R2.1222 NC(=O)CN1C[C@@H]1Cc2ccccc2 269982a_100016998360_100000187820 [0,0,0,1,0,1|1,0,0]=3 19987 B15R2.1222 NC(=O)CN1C[C@@H]1Cc2ccccc2 34a_100016998360_100000187820 [0,0,0,1,0,1|1,0,0]=3 19988 B15R2.1222 O=C([O-])CN1C[C@@H]1Cc2ccccc2 269982a_100016998360_100020667443 [0,0,0,1,0,1|0,0,1]=3 19989 B15R2.1222 O=C([O-])CN1C[C@@H]1Cc2ccccc2 34a_100016998360_100020667443 [0,0,0,1,0,1|0,0,1]=3 19990 B15R2.1222 O=[N+]([O-])CN1C[C@@H]1Cc2ccccc2 269982a_100016998360_100000761209 [0,0,0,1,0,1|1,0,1]=4 19991 B15R2.1222 O=[N+]([O-])CN1C[C@@H]1Cc2ccccc2 34a_100016998360_100000761209 [0,0,0,1,0,1|1,0,1]=4 19992 B15R2.1223 C=C(C)CN1CCC1c2ccccc2 2230a_100000739605_100000748629 [0,0,0,1,0,1|2,0,0]=4 19993 B15R2.1223 C=C(C)CN1CCC1c2ccccc2 269982a_100000739605_100000748629 [0,0,0,1,0,1|2,0,0]=4 19994 B15R2.1223 C=C(F)CN1CCC1c2ccccc2 2230a_100000739605_100009893438 [0,0,0,1,0,1|2,0,0]=4 19995 B15R2.1223 C=C(F)CN1CCC1c2ccccc2 269982a_100000739605_100009893438 [0,0,0,1,0,1|2,0,0]=4 19996 B15R2.1223 CC(O)CN1CCC1c2ccccc2 2230a_100000739605_100011218427 [0,0,0,1,0,1|1,0,1]=4 19997 B15R2.1223 CC(O)CN1CCC1c2ccccc2 269982a_100000739605_100011218427 [0,0,0,1,0,1|1,0,1]=4 19998 B15R2.1223 C[C@@H](O)CN1CCC1c2ccccc2 2230a_100000739605_100009817552 [0,0,0,1,0,1|1,0,1]=4 19999 B15R2.1223 C[C@@H](O)CN1CCC1c2ccccc2 269982a_100000739605_100009817552 [0,0,0,1,0,1|1,0,1]=4 20000 B15R2.1223 NC(=O)CN1CCC1c2ccccc2 2230a_100000739605_100000747473 [0,0,0,1,0,1|1,0,0]=3 20001 B15R2.1223 NC(=O)CN1CCC1c2ccccc2 269982a_100000739605_100000187820 [0,0,0,1,0,1|1,0,0]=3 20002 B15R2.1223 O=C([O-])CN1CCC1c2ccccc2 269982a_100000739605_100020667443 [0,0,0,1,0,1|0,0,1]=3 20003 B15R2.1223 O=[N+]([O-])CN1CCC1c2ccccc2 269982a_100000739605_100000761209 [0,0,0,1,0,1|1,0,1]=4 20004 B15R2.1226 C=C(C)CN[C@H]1C[C@@H]1c2ccccc2 2230a_100020588832_100000748629 [0,0,0,1,0,1|2,0,0]=4 20005 B15R2.1226 C=C(C)CN[C@H]1C[C@@H]1c2ccccc2 34a_100020588832_100000748629 [0,0,0,1,0,1|2,0,0]=4 20006 B15R2.1226 C=C(F)CN[C@H]1C[C@@H]1c2ccccc2 2230a_100020588832_100009893438 [0,0,0,1,0,1|2,0,0]=4 20007 B15R2.1226 C=C(F)CN[C@H]1C[C@@H]1c2ccccc2 34a_100020588832_100009893438 [0,0,0,1,0,1|2,0,0]=4 20008 B15R2.1226 CC(O)CN[C@H]1C[C@@H]1c2ccccc2 2230a_100020588832_100011218427 [0,0,0,1,0,1|1,0,1]=4 20009 B15R2.1226 CC(O)CN[C@H]1C[C@@H]1c2ccccc2 34a_100020588832_100011218427 [0,0,0,1,0,1|1,0,1]=4 20010 B15R2.1226 C[C@@H](O)CN[C@H]1C[C@@H]1c2ccccc2 2230a_100020588832_100009817552 [0,0,0,1,0,1|1,0,1]=4 20011 B15R2.1226 C[C@@H](O)CN[C@H]1C[C@@H]1c2ccccc2 34a_100020588832_100009817552 [0,0,0,1,0,1|1,0,1]=4 20012 B15R2.1226 NC(=O)CN[C@H]1C[C@@H]1c2ccccc2 2230a_100020588832_100000747473 [0,0,0,1,0,1|1,0,0]=3 20013 B15R2.1226 NC(=O)CN[C@H]1C[C@@H]1c2ccccc2 34a_100020588832_100000187820 [0,0,0,1,0,1|1,0,0]=3 20014 B15R2.1226 O=C([O-])CN[C@H]1C[C@@H]1c2ccccc2 34a_100020588832_100020667443 [0,0,0,1,0,1|0,0,1]=3 20015 B15R2.1226 O=[N+]([O-])CN[C@H]1C[C@@H]1c2ccccc2 34a_100020588832_100000761209 [0,0,0,1,0,1|1,0,1]=4 20016 B15R2.1241 O=C(O)C1CCN1Cc2ccccc2 269956a_100000021838_100015291786 [0,0,0,1,0,1|0,0,0]=2 20017 B15R2.1241 O=C(O)C1CCN1Cc2ccccn2 269956a_100000021838_100000721315 [0,0,0,1,0,1|1,0,0]=3 20018 B15R2.1241 O=C(O)C1CCN1Cc2cccnc2 269956a_100000021838_100000733263 [0,0,0,1,0,1|1,0,0]=3 20019 B15R2.1241 O=C(O)C1CCN1Cc2cccnn2 269956a_100000021838_100016990269 [0,0,0,1,0,1|2,0,0]=4 20020 B15R2.1241 O=C(O)C1CCN1Cc2ccncc2 269956a_100000021838_100015193705 [0,0,0,1,0,1|1,0,0]=3 20021 B15R2.1241 O=C(O)C1CCN1Cc2cnccn2 269956a_100000021838_100016995436 [0,0,0,1,0,1|2,0,0]=4 20022 B15R2.1241 O=C(O)C1CCN1Cc2cncnc2 269956a_100000021838_100016991940 [0,0,0,1,0,1|2,0,0]=4 20023 B15R2.1241 O=C(O)C1CCN1Cc2ncccn2 269956a_100000021838_100000703007 [0,0,0,1,0,1|2,0,0]=4 20024 B15R2.4226 c1ccc(cc1)CCCNCC2CO2 2230a_100000211184_100011216344 [0,0,0,1,0,1|1,0,1]=4 20025 B15R2.4226 c1ccc(cc1)CCCNCC2CO2 34a_100000211184_102125554688 [0,0,0,1,0,1|1,0,1]=4 20026 B15R2.4226 c1ccc(cc1)CCCOCC2CO2 34a_100000210828_102125554688 [0,0,0,1,0,1|1,0,1]=4 20027 B15R2.4226 c1ccc(cc1)CCCOCC2CO2 7a_100000210828_102125554688 [0,0,0,1,0,1|1,0,1]=4 20028 B15R2.4226 c1ccc(cc1)CCCOC[C@@H]2CO2 34a_100000757423_100000211621 [0,0,0,1,0,1|1,0,1]=4 20029 B15R2.4226 c1ccc(cc1)CCCOC[C@@H]2CO2 7a_100000210828_100000745022 [0,0,0,1,0,1|1,0,1]=4 20030 B15R2.4226 c1ccc(cc1)CCCSCC2CO2 62a_100000211621_102125554688 [0,0,0,1,0,1|1,0,1]=4 20031 B15R2.4226 c1ccc(cc1)CCCSCC2CO2 62a_102125554688_100000211621 [0,0,0,1,0,1|1,0,1]=4 20032 B15R2.4226 c1ccc(cc1)CCCSC[C@@H]2CO2 62a_100000211621_100000745022 [0,0,0,1,0,1|1,0,1]=4 20033 B15R2.4226 c1ccc(cc1)CCCSC[C@@H]2CO2 62a_100000745022_100000211621 [0,0,0,1,0,1|1,0,1]=4 20034 B15R2.4226 c1ccc(cc1)CCNCCC2CO2 2230a_100000106460_100000732470 [0,0,0,1,0,1|1,0,1]=4 20035 B15R2.4226 c1ccc(cc1)CCNCCC2CO2 34a_100000106460_100000732470 [0,0,0,1,0,1|1,0,1]=4 20036 B15R2.4226 c1ccc(cc1)CCOCCC2CO2 34a_100000210268_100000732470 [0,0,0,1,0,1|1,0,1]=4 20037 B15R2.4226 c1ccc(cc1)CCOCCC2CO2 7a_100000210268_100000732470 [0,0,0,1,0,1|1,0,1]=4 20038 B15R2.4226 c1ccc(cc1)CCOCC[C@@H]2CO2 34a_100009820653_100000765856 [0,0,0,1,0,1|1,0,1]=4 20039 B15R2.4226 c1ccc(cc1)CCSCCC2CO2 62a_100000732470_100011218657 [0,0,0,1,0,1|1,0,1]=4 20040 B15R2.4226 c1ccc(cc1)CCSCCC2CO2 62a_100000765856_100000732470 [0,0,0,1,0,1|1,0,1]=4 20041 B15R2.4226 c1ccc(cc1)CNCCCC2CO2 2230a_100015324214_100000733510 [0,0,0,1,0,1|1,0,1]=4 20042 B15R2.4226 c1ccc(cc1)CNCCCC2CO2 34a_100015324214_100000733510 [0,0,0,1,0,1|1,0,1]=4 20043 B15R2.4226 c1ccc(cc1)COCCCC2CO2 34a_100000210790_100000733510 [0,0,0,1,0,1|1,0,1]=4 20044 B15R2.4226 c1ccc(cc1)COCCCC2CO2 7a_100000210790_100000733510 [0,0,0,1,0,1|1,0,1]=4 20045 B15R2.4226 c1ccc(cc1)CSCCCC2CO2 62a_100000211182_100000733510 [0,0,0,1,0,1|1,0,1]=4 20046 B15R2.4226 c1ccc(cc1)CSCCCC2CO2 62a_100000733510_100015291786 [0,0,0,1,0,1|1,0,1]=4 20047 B15R2.68122 CC(=O)CC1OCCc2c1cccc2 1458a_100000751863_200000210301 [0,0,0,1,0,1|1,0,0]=3 20048 B15R2.68122 CC(=O)NC1CCCc2c1ccnc2 11a_100020634316_100015343762 [0,0,0,1,0,1|2,0,0]=4 20049 B15R2.68122 CC(=O)NC1CCCc2c1ccnc2 1626a_100020634316_100015343762 [0,0,0,1,0,1|2,0,0]=4 20050 B15R2.68122 CC(=O)NC1CCCc2c1ccnc2 240690a_100020634316_100015343762 [0,0,0,1,0,1|2,0,0]=4 20051 B15R2.68122 CC(=O)NC1CCCc2c1ccnc2 527a_100020634316_100103153847 [0,0,0,1,0,1|2,0,0]=4 20052 B15R2.68122 CC(=O)NC1CCCc2c1nccc2 11a_100011259139_100015343762 [0,0,0,1,0,1|2,0,0]=4 20053 B15R2.68122 CC(=O)NC1CCCc2c1nccc2 1626a_100011259139_100015343762 [0,0,0,1,0,1|2,0,0]=4 20054 B15R2.68122 CC(=O)NC1CCCc2c1nccc2 240690a_100011259139_100015343762 [0,0,0,1,0,1|2,0,0]=4 20055 B15R2.68122 CC(=O)NC1CCCc2c1nccc2 527a_100011259139_100103153847 [0,0,0,1,0,1|2,0,0]=4 20056 B15R2.68122 CC(=O)NC1CCOc2c1cccc2 11a_100015190321_100015343762 [0,0,0,1,0,1|2,0,0]=4 20057 B15R2.68122 CC(=O)NC1CCOc2c1cccc2 1626a_100015190321_100015343762 [0,0,0,1,0,1|2,0,0]=4 20058 B15R2.68122 CC(=O)NC1CCOc2c1cccc2 240690a_100015190321_100015343762 [0,0,0,1,0,1|2,0,0]=4 20059 B15R2.68122 CC(=O)NC1CCOc2c1cccc2 527a_100015190321_100103153847 [0,0,0,1,0,1|2,0,0]=4 20060 B15R2.68122 CC(=O)N[C@H]1CCCc2c1cccc2 11a_100020654734_100015343762 [0,0,0,1,0,1|1,0,0]=3 20061 B15R2.68122 CC(=O)N[C@H]1CCCc2c1cccc2 1626a_100020654734_100015343762 [0,0,0,1,0,1|1,0,0]=3 20062 B15R2.68122 CC(=O)N[C@H]1CCCc2c1cccc2 240690a_100020654734_100015343762 [0,0,0,1,0,1|1,0,0]=3 20063 B15R2.68122 CC(=O)N[C@H]1CCCc2c1cccc2 527a_100020654734_100103153847 [0,0,0,1,0,1|1,0,0]=3 20064 B15R2.68122 [13CH3]C(=O)CC1OCCc2c1cccc2 1458a_100000751863_200025704644 [0,0,0,1,0,1|1,0,0]=3 20065 B15R2.68818 C=C(C)CCSC1Cc2c1cccc2 62a_100000730704_100009813401 [0,0,0,1,0,1|2,0,0]=4 20066 B15R2.68818 C=C(C)CCSC1Cc2c1cccc2 62a_100009813401_100000730704 [0,0,0,1,0,1|2,0,0]=4 20067 B15R2.68818 C=C(C)COCC1Cc2c1cccc2 34a_100012476685_100000748629 [0,0,0,1,0,1|2,0,0]=4 20068 B15R2.68818 C=C(C)COCC1Cc2c1cccc2 7a_100012476685_100000748629 [0,0,0,1,0,1|2,0,0]=4 20069 B15R2.68818 C=C(F)COCC1Cc2c1cccc2 34a_100012476685_100009893438 [0,0,0,1,0,1|2,0,0]=4 20070 B15R2.68818 C=C(F)COCC1Cc2c1cccc2 7a_100012476685_100000042424 [0,0,0,1,0,1|2,0,0]=4 20071 B15R2.68818 CC(=O)CCOC1Cc2c1cccc2 7a_100000759926_100009813401 [0,0,0,1,0,1|1,0,0]=3 20072 B15R2.68818 CC(=O)CCSC1Cc2c1cccc2 62a_100000053229_100009813401 [0,0,0,1,0,1|1,0,0]=3 20073 B15R2.68818 CC(=O)CCSC1Cc2c1cccc2 62a_100009813401_100000053229 [0,0,0,1,0,1|1,0,0]=3 20074 B15R2.68818 CC(=O)OCSC1Cc2c1cccc2 62a_100000076356_100009813401 [0,0,0,1,0,1|2,0,0]=4 20075 B15R2.68818 CC(=O)OCSC1Cc2c1cccc2 62a_100009813401_100000076356 [0,0,0,1,0,1|2,0,0]=4 20076 B15R2.68818 CC(O)CCSC1Cc2c1cccc2 62a_100009813401_100012276601 [0,0,0,1,0,1|1,0,1]=4 20077 B15R2.68818 CC(O)CCSC1Cc2c1cccc2 62a_100012276601_100009813401 [0,0,0,1,0,1|1,0,1]=4 20078 B15R2.68818 CC(O)COCC1Cc2c1cccc2 34a_100012476685_100011218427 [0,0,0,1,0,1|1,0,1]=4 20079 B15R2.68818 CC(O)COCC1Cc2c1cccc2 7a_100012476685_100011218427 [0,0,0,1,0,1|1,0,1]=4 20080 B15R2.68818 C[C@@H](O)COCC1Cc2c1cccc2 34a_100012476685_100009817552 [0,0,0,1,0,1|1,0,1]=4 20081 B15R2.68818 C[C@@H](O)COCC1Cc2c1cccc2 7a_100012476685_100009817552 [0,0,0,1,0,1|1,0,1]=4 20082 B15R2.68818 NC(=O)CCOC1Cc2c1cccc2 7a_100000757172_100009813401 [0,0,0,1,0,1|1,0,0]=3 20083 B15R2.68818 NC(=O)CCSC1Cc2c1cccc2 62a_100000744528_100009813401 [0,0,0,1,0,1|1,0,0]=3 20084 B15R2.68818 NC(=O)CCSC1Cc2c1cccc2 62a_100009813401_100000744528 [0,0,0,1,0,1|1,0,0]=3 20085 B15R2.68818 NC(=O)COCC1Cc2c1cccc2 34a_100012476685_100000187820 [0,0,0,1,0,1|1,0,0]=3 20086 B15R2.68818 NC(=O)COCC1Cc2c1cccc2 7a_100012476685_100000187820 [0,0,0,1,0,1|1,0,0]=3 20087 B15R2.68818 O=C(O)CONC1Cc2c1cccc2 269956a_100000106656_100009813401 [0,0,0,1,0,1|1,0,0]=3 20088 B15R2.68818 O=C([O-])COCC1Cc2c1cccc2 34a_100012476685_100020667443 [0,0,0,1,0,1|0,0,1]=3 20089 B15R2.68818 O=[N+]([O-])COCC1Cc2c1cccc2 34a_100012476685_100000761209 [0,0,0,1,0,1|1,0,1]=4 20090 B15R2.30 Cc1cccc(c1)C2=CC(=O)CCC2 271570a_100000723966_100011215228 [0,1,0,1,0,0|1,0,1]=4 20091 B15R2.30 Nc1cccc(c1)C2=CC(=O)CCC2 271570a_100000723966_100000210019 [0,1,0,1,0,0|1,0,1]=4 20092 B15R2.30 O=C1C=C(CCC1)c2cccc(c2)Br 271570a_100000723966_100000691529 [0,1,0,1,0,0|1,0,1]=4 20093 B15R2.30 O=C1C=C(CCC1)c2cccc(c2)Cl 271570a_100000723966_100000699651 [0,1,0,1,0,0|1,0,1]=4 20094 B15R2.30 O=C1C=C(CCC1)c2cccc(c2)F 271570a_100000723966_100000685547 [0,1,0,1,0,0|1,0,1]=4 20095 B15R2.30 O=C1C=C(CCC1)c2cccc(c2)O 271570a_100000723966_100000211634 [0,1,0,1,0,0|1,0,1]=4 20096 B15R2.30 O=C1C=C(CCC1)c2cccc(c2)[S] 271570a_100000723966_114929384022 [0,1,0,1,0,0|1,0,1]=4 20097 B15R2.377 CC(=O)CC1COc2c1ccc(c2)O 1458a_100009846009_200000210301 [0,1,0,1,0,0|2,0,0]=4 20098 B15R2.377 CC(=O)NC1CCc2c1ccc(c2)Br 11a_100000744021_100015343762 [0,1,0,1,0,0|2,0,0]=4 20099 B15R2.377 CC(=O)NC1CCc2c1ccc(c2)Br 1626a_100000744021_100015343762 [0,1,0,1,0,0|2,0,0]=4 20100 B15R2.377 CC(=O)NC1CCc2c1ccc(c2)Br 240690a_100000744021_100015343762 [0,1,0,1,0,0|2,0,0]=4 20101 B15R2.377 CC(=O)NC1CCc2c1ccc(c2)Br 527a_100000744021_100103153847 [0,1,0,1,0,0|2,0,0]=4 20102 B15R2.377 CC(=O)NC1CCc2c1ccc(c2)C 11a_200000746848_100015343762 [0,1,0,1,0,0|2,0,0]=4 20103 B15R2.377 CC(=O)NC1CCc2c1ccc(c2)C 1626a_200000746848_100015343762 [0,1,0,1,0,0|2,0,0]=4 20104 B15R2.377 CC(=O)NC1CCc2c1ccc(c2)C 240690a_200000746848_100015343762 [0,1,0,1,0,0|2,0,0]=4 20105 B15R2.377 CC(=O)NC1CCc2c1ccc(c2)C 527a_200000746848_100103153847 [0,1,0,1,0,0|2,0,0]=4 20106 B15R2.377 CC(=O)NC1CCc2c1ccc(c2)Cl 11a_100000743821_100015343762 [0,1,0,1,0,0|2,0,0]=4 20107 B15R2.377 CC(=O)NC1CCc2c1ccc(c2)Cl 1626a_100000743821_100015343762 [0,1,0,1,0,0|2,0,0]=4 20108 B15R2.377 CC(=O)NC1CCc2c1ccc(c2)Cl 240690a_100000743821_100015343762 [0,1,0,1,0,0|2,0,0]=4 20109 B15R2.377 CC(=O)NC1CCc2c1ccc(c2)Cl 527a_100000743821_100103153847 [0,1,0,1,0,0|2,0,0]=4 20110 B15R2.377 CC(=O)N[C@@H]1CCc2c1ccc(c2)F 11a_100025717273_100015343762 [0,1,0,1,0,0|2,0,0]=4 20111 B15R2.377 CC(=O)N[C@@H]1CCc2c1ccc(c2)F 1626a_100025717273_100015343762 [0,1,0,1,0,0|2,0,0]=4 20112 B15R2.377 CC(=O)N[C@@H]1CCc2c1ccc(c2)F 240690a_100025717273_100015343762 [0,1,0,1,0,0|2,0,0]=4 20113 B15R2.377 CC(=O)N[C@@H]1CCc2c1ccc(c2)F 527a_100025717273_100103153847 [0,1,0,1,0,0|2,0,0]=4 20114 B15R2.377 [13CH3]C(=O)CC1COc2c1ccc(c2)O 1458a_100009846009_200025704644 [0,1,0,1,0,0|2,0,0]=4 20115 B15R2.384 CC(=O)N1CCCc2c1ccc(c2)O 271570a_203496583355_100000739347 [0,1,0,1,0,0|2,0,0]=4 20116 B15R2.1115 Cc1cccc(c1)NC2COC(=O)O2 34a_100000188690_100000032252 [0,1,0,1,0,0|2,0,0]=4 20117 B15R2.1115 Cc1cccc(c1)OC2COC(=O)O2 34a_100000210337_100000032252 [0,1,0,1,0,0|2,0,0]=4 20118 B15R2.1115 Cc1cccc(c1)SC2COC(=O)O2 62a_100011215228_100000032252 [0,1,0,1,0,0|2,0,0]=4 20119 B15R2.1115 Nc1cccc(c1)OC2COC(=O)O2 34a_100000210217_100000032252 [0,1,0,1,0,0|2,0,0]=4 20120 B15R2.1115 Nc1cccc(c1)SC2COC(=O)O2 62a_100000210019_100000032252 [0,1,0,1,0,0|2,0,0]=4 20121 B15R2.1115 O=C1OCC(O1)Nc2cccc(c2)Br 34a_100000210019_100000032252 [0,1,0,1,0,0|2,0,0]=4 20122 B15R2.1115 O=C1OCC(O1)Nc2cccc(c2)Cl 34a_100000185859_100000032252 [0,1,0,1,0,0|2,0,0]=4 20123 B15R2.1115 O=C1OCC(O1)Nc2cccc(c2)F 34a_100000210047_100000032252 [0,1,0,1,0,0|2,0,0]=4 20124 B15R2.1115 O=C1OCC(O1)Nc2cccc(c2)I 34a_100000211102_100000032252 [0,1,0,1,0,0|2,0,0]=4 20125 B15R2.1115 O=C1OCC(O1)Nc2cccc(c2)O 34a_100000210217_100000032252 [0,1,0,1,0,0|2,0,0]=4 20126 B15R2.1115 O=C1OCC(O1)Oc2cccc(c2)Br 34a_100000210342_100000032252 [0,1,0,1,0,0|2,0,0]=4 20127 B15R2.1115 O=C1OCC(O1)Oc2cccc(c2)Cl 34a_100000210295_100000032252 [0,1,0,1,0,0|2,0,0]=4 20128 B15R2.1115 O=C1OCC(O1)Oc2cccc(c2)F 34a_100000210426_100000032252 [0,1,0,1,0,0|2,0,0]=4 20129 B15R2.1115 O=C1OCC(O1)Oc2cccc(c2)I 34a_100000211634_100000032252 [0,1,0,1,0,0|2,0,0]=4 20130 B15R2.1115 O=C1OCC(O1)Sc2cccc(c2)Br 62a_100000691529_100000032252 [0,1,0,1,0,0|2,0,0]=4 20131 B15R2.1115 O=C1OCC(O1)Sc2cccc(c2)Cl 62a_100000699651_100000032252 [0,1,0,1,0,0|2,0,0]=4 20132 B15R2.1115 O=C1OCC(O1)Sc2cccc(c2)F 62a_100000685547_100000032252 [0,1,0,1,0,0|2,0,0]=4 20133 B15R2.1115 O=C1OCC(O1)Sc2cccc(c2)[S] 62a_114929384022_100000032252 [0,1,0,1,0,0|2,0,0]=4 20134 B15R2.13624 CC(=O)NC1CCc2c1c(ccc2)Br 11a_100103168669_100015343762 [0,1,0,1,0,0|2,0,0]=4 20135 B15R2.13624 CC(=O)NC1CCc2c1c(ccc2)Br 1626a_100103168669_100015343762 [0,1,0,1,0,0|2,0,0]=4 20136 B15R2.13624 CC(=O)NC1CCc2c1c(ccc2)Br 240690a_100103168669_100015343762 [0,1,0,1,0,0|2,0,0]=4 20137 B15R2.13624 CC(=O)NC1CCc2c1c(ccc2)Br 527a_100103168669_100103153847 [0,1,0,1,0,0|2,0,0]=4 20138 B15R2.15418 Cc1cccc(c1)CSC2CC(=O)C2 62a_100009894365_100000211840 [0,1,0,1,0,0|2,0,0]=4 20139 B15R2.15418 Cc1cccc(c1)NCC2CC(=O)C2 2230a_100000188690_100009874392 [0,1,0,1,0,0|2,0,0]=4 20140 B15R2.15418 Cc1cccc(c1)OCC2CC(=O)C2 7a_100000210337_100009874392 [0,1,0,1,0,0|2,0,0]=4 20141 B15R2.15418 Cc1cccc(c1)SCC2CC(=O)C2 62a_100009874392_100011215228 [0,1,0,1,0,0|2,0,0]=4 20142 B15R2.15418 Cc1cccc(c1)SCC2CC(=O)C2 62a_100011215228_100009874392 [0,1,0,1,0,0|2,0,0]=4 20143 B15R2.15418 Nc1cccc(c1)SCC2CC(=O)C2 62a_100000210019_100009874392 [0,1,0,1,0,0|2,0,0]=4 20144 B15R2.15418 Nc1cccc(c1)SCC2CC(=O)C2 62a_100009874392_100000210019 [0,1,0,1,0,0|2,0,0]=4 20145 B15R2.15418 O=C1CC(C1)COc2cccc(c2)Br 7a_100000210342_100009874392 [0,1,0,1,0,0|2,0,0]=4 20146 B15R2.15418 O=C1CC(C1)COc2cccc(c2)Cl 7a_100000210295_100009874392 [0,1,0,1,0,0|2,0,0]=4 20147 B15R2.15418 O=C1CC(C1)COc2cccc(c2)F 7a_100000210426_100009874392 [0,1,0,1,0,0|2,0,0]=4 20148 B15R2.15418 O=C1CC(C1)COc2cccc(c2)I 7a_100000211634_100009874392 [0,1,0,1,0,0|2,0,0]=4 20149 B15R2.15418 O=C1CC(C1)CSc2cccc(c2)Br 62a_100000691529_100009874392 [0,1,0,1,0,0|2,0,0]=4 20150 B15R2.15418 O=C1CC(C1)CSc2cccc(c2)Br 62a_100009874392_100000691529 [0,1,0,1,0,0|2,0,0]=4 20151 B15R2.15418 O=C1CC(C1)CSc2cccc(c2)Cl 62a_100000699651_100009874392 [0,1,0,1,0,0|2,0,0]=4 20152 B15R2.15418 O=C1CC(C1)CSc2cccc(c2)Cl 62a_100009874392_100000699651 [0,1,0,1,0,0|2,0,0]=4 20153 B15R2.15418 O=C1CC(C1)CSc2cccc(c2)F 62a_100000685547_100009874392 [0,1,0,1,0,0|2,0,0]=4 20154 B15R2.15418 O=C1CC(C1)CSc2cccc(c2)F 62a_100009874392_100000685547 [0,1,0,1,0,0|2,0,0]=4 20155 B15R2.15418 O=C1CC(C1)CSc2cccc(c2)O 62a_100009874392_100000211634 [0,1,0,1,0,0|2,0,0]=4 20156 B15R2.15418 O=C1CC(C1)CSc2cccc(c2)[S] 62a_100009874392_114929384022 [0,1,0,1,0,0|2,0,0]=4 20157 B15R2.15418 O=C1CC(C1)CSc2cccc(c2)[S] 62a_114929384022_100009874392 [0,1,0,1,0,0|2,0,0]=4 20158 B15R2.15418 O=C1CC(C1)SCc2cccc(c2)Br 62a_100009894365_100000211773 [0,1,0,1,0,0|2,0,0]=4 20159 B15R2.15418 O=C1CC(C1)SCc2cccc(c2)Cl 62a_100009894365_100000187163 [0,1,0,1,0,0|2,0,0]=4 20160 B15R2.15418 O=C1CC(C1)SCc2cccc(c2)F 62a_100009894365_100000230114 [0,1,0,1,0,0|2,0,0]=4 20161 B15R2.15418 O=C1CC(C1)SCc2cccc(c2)I 62a_100009894365_100011218688 [0,1,0,1,0,0|2,0,0]=4 20162 B15R2.15418 O=C1CC(C1)SCc2cccc(c2)O 62a_100009894365_100011660834 [0,1,0,1,0,0|2,0,0]=4 20163 B15R2.305 Cc1ccccc1NC2COC(=O)O2 34a_100015192222_100000032252 [0,1,0,1,0,0|2,0,0]=4 20164 B15R2.305 Cc1ccccc1OC2COC(=O)O2 34a_100000210338_100000032252 [0,1,0,1,0,0|2,0,0]=4 20165 B15R2.305 Cc1ccccc1SC2COC(=O)O2 62a_100000210755_100000032252 [0,1,0,1,0,0|2,0,0]=4 20166 B15R2.305 Nc1ccccc1OC2COC(=O)O2 34a_100000185747_100000032252 [0,1,0,1,0,0|2,0,0]=4 20167 B15R2.305 Nc1ccccc1SC2COC(=O)O2 62a_100000210017_100000032252 [0,1,0,1,0,0|2,0,0]=4 20168 B15R2.305 O=C1OCC(O1)Nc2ccccc2Br 34a_100000210017_100000032252 [0,1,0,1,0,0|2,0,0]=4 20169 B15R2.305 O=C1OCC(O1)Nc2ccccc2Cl 34a_100000185783_100000032252 [0,1,0,1,0,0|2,0,0]=4 20170 B15R2.305 O=C1OCC(O1)Nc2ccccc2F 34a_100000210422_100000032252 [0,1,0,1,0,0|2,0,0]=4 20171 B15R2.305 O=C1OCC(O1)Nc2ccccc2I 34a_100000210053_100000032252 [0,1,0,1,0,0|2,0,0]=4 20172 B15R2.305 O=C1OCC(O1)Nc2ccccc2O 34a_100000185747_100000032252 [0,1,0,1,0,0|2,0,0]=4 20173 B15R2.305 O=C1OCC(O1)Oc2ccccc2Br 34a_100000181306_100000032252 [0,1,0,1,0,0|2,0,0]=4 20174 B15R2.305 O=C1OCC(O1)Oc2ccccc2Cl 34a_100000210172_100000032252 [0,1,0,1,0,0|2,0,0]=4 20175 B15R2.305 O=C1OCC(O1)Oc2ccccc2F 34a_100000210171_100000032252 [0,1,0,1,0,0|2,0,0]=4 20176 B15R2.305 O=C1OCC(O1)Oc2ccccc2I 34a_100000739446_100000032252 [0,1,0,1,0,0|2,0,0]=4 20177 B15R2.305 O=C1OCC(O1)Sc2ccccc2Br 62a_100000695589_100000032252 [0,1,0,1,0,0|2,0,0]=4 20178 B15R2.305 O=C1OCC(O1)Sc2ccccc2Cl 62a_100000764095_100000032252 [0,1,0,1,0,0|2,0,0]=4 20179 B15R2.305 O=C1OCC(O1)Sc2ccccc2F 62a_100011215700_100000032252 [0,1,0,1,0,0|2,0,0]=4 20180 B15R2.305 O=C1OCC(O1)Sc2ccccc2O 62a_100000739446_100000032252 [0,1,0,1,0,0|2,0,0]=4 20181 B15R2.332 Cc1ccccc1C2=CC(=O)CCC2 271570a_100000723966_100000210755 [0,1,0,1,0,0|1,0,1]=4 20182 B15R2.332 Nc1ccccc1C2=CC(=O)CCC2 271570a_100000723966_100000210017 [0,1,0,1,0,0|1,0,1]=4 20183 B15R2.332 O=C1C=C(CCC1)c2ccccc2Br 271570a_100000723966_100000695589 [0,1,0,1,0,0|1,0,1]=4 20184 B15R2.332 O=C1C=C(CCC1)c2ccccc2Cl 271570a_100000723966_100000764095 [0,1,0,1,0,0|1,0,1]=4 20185 B15R2.332 O=C1C=C(CCC1)c2ccccc2F 271570a_100000723966_100011215700 [0,1,0,1,0,0|1,0,1]=4 20186 B15R2.332 O=C1C=C(CCC1)c2ccccc2O 271570a_100000723966_100000739446 [0,1,0,1,0,0|1,0,1]=4 20187 B15R2.1237 CC(=O)C1CCOc2ccccc2O1 1458a_100000097261_200000210301 [0,1,0,1,0,0|2,0,0]=4 20188 B15R2.1237 CC(=O)N1CCCc2ccccc2C1 11a_100000059810_100015343762 [0,1,0,1,0,0|2,0,0]=4 20189 B15R2.1237 CC(=O)N1CCCc2ccccc2C1 1626a_100000059810_100015343762 [0,1,0,1,0,0|2,0,0]=4 20190 B15R2.1237 CC(=O)N1CCCc2ccccc2C1 240690a_100000059810_100015343762 [0,1,0,1,0,0|2,0,0]=4 20191 B15R2.1237 CC(=O)N1CCCc2ccccc2C1 527a_100000059810_100103153847 [0,1,0,1,0,0|2,0,0]=4 20192 B15R2.1237 [13CH3]C(=O)C1CCOc2ccccc2O1 1458a_100000097261_200025704644 [0,1,0,1,0,0|2,0,0]=4 20193 B15R2.1660 CC(=O)CCN1Cc2ccccc2C1 1458a_100015183805_200000210301 [0,1,0,1,0,0|2,0,0]=4 20194 B15R2.1660 CC(=O)CCN1Cc2ccccc2C1 269982a_100000752595_100000053229 [0,1,0,1,0,0|2,0,0]=4 20195 B15R2.1660 CC(=O)COC1Cc2ccccc2C1 34a_100000211253_100000753484 [0,1,0,1,0,0|2,0,0]=4 20196 B15R2.1660 CC(=O)NCC1Cc2ccccc2C1 11a_100000757167_100015343762 [0,1,0,1,0,0|2,0,0]=4 20197 B15R2.1660 CC(=O)NCC1Cc2ccccc2C1 1626a_100000757167_100015343762 [0,1,0,1,0,0|2,0,0]=4 20198 B15R2.1660 CC(=O)NCC1Cc2ccccc2C1 240690a_100000757167_100015343762 [0,1,0,1,0,0|2,0,0]=4 20199 B15R2.1660 CC(=O)NCC1Cc2ccccc2C1 527a_100000757167_100103153847 [0,1,0,1,0,0|2,0,0]=4 20200 B15R2.1660 CC(=O)NCC1Cc2ccccc2O1 11a_100015207006_100015343762 [0,1,0,1,0,0|2,0,0]=4 20201 B15R2.1660 CC(=O)NCC1Cc2ccccc2O1 1626a_100015207006_100015343762 [0,1,0,1,0,0|2,0,0]=4 20202 B15R2.1660 CC(=O)NCC1Cc2ccccc2O1 240690a_100015207006_100015343762 [0,1,0,1,0,0|2,0,0]=4 20203 B15R2.1660 CC(=O)NCC1Cc2ccccc2O1 527a_100015207006_100103153847 [0,1,0,1,0,0|2,0,0]=4 20204 B15R2.1660 NC(=O)CCN1Cc2ccccc2C1 2230a_100000752595_100000744528 [0,1,0,1,0,0|2,0,0]=4 20205 B15R2.1660 NC(=O)CCN1Cc2ccccc2C1 269982a_100000752595_100000744528 [0,1,0,1,0,0|2,0,0]=4 20206 B15R2.1660 NC(=O)CCN1Cc2ccccc2C1 34a_100000752595_100000731001 [0,1,0,1,0,0|2,0,0]=4 20207 B15R2.1660 NC(=O)CNC1Cc2ccccc2C1 2230a_100000753258_100000747473 [0,1,0,1,0,0|2,0,0]=4 20208 B15R2.1660 NC(=O)CNC1Cc2ccccc2C1 34a_100000753258_100000187820 [0,1,0,1,0,0|2,0,0]=4 20209 B15R2.1660 NC(=O)COC1Cc2ccccc2C1 34a_100011215286_100000187820 [0,1,0,1,0,0|2,0,0]=4 20210 B15R2.1660 NC(=O)CSC1Cc2ccccc2C1 62a_100000747473_100000753484 [0,1,0,1,0,0|2,0,0]=4 20211 B15R2.1660 O=C(O)CNC1Cc2ccccc2C1 269956a_100016091260_100000753484 [0,1,0,1,0,0|1,0,0]=3 20212 B15R2.1660 O=C([O-])CNC1Cc2ccccc2C1 34a_100000753258_100020667443 [0,1,0,1,0,0|1,0,1]=4 20213 B15R2.1660 O=C([O-])COC1Cc2ccccc2C1 34a_100011215286_100020667443 [0,1,0,1,0,0|1,0,1]=4 20214 B15R2.1660 O=C([O-])CSC1Cc2ccccc2C1 62a_100020667443_100000753484 [0,1,0,1,0,0|1,0,1]=4 20215 B15R2.1660 [13CH3]C(=O)CCN1Cc2ccccc2C1 1458a_100015183805_200025704644 [0,1,0,1,0,0|2,0,0]=4 20216 B15R2.1668 CC(=O)CC1COc2ccccc2O1 1458a_100000070787_100011215957 [0,1,0,1,0,0|2,0,0]=4 20217 B15R2.1668 CC(=O)CN1CCc2ccccc2C1 1458a_100015184552_200000210301 [0,1,0,1,0,0|2,0,0]=4 20218 B15R2.1668 CC(=O)NC1CCc2ccccc2C1 11a_100000748446_100015343762 [0,1,0,1,0,0|2,0,0]=4 20219 B15R2.1668 CC(=O)NC1CCc2ccccc2C1 1626a_100000748446_100015343762 [0,1,0,1,0,0|2,0,0]=4 20220 B15R2.1668 CC(=O)NC1CCc2ccccc2C1 240690a_100000748446_100015343762 [0,1,0,1,0,0|2,0,0]=4 20221 B15R2.1668 CC(=O)NC1CCc2ccccc2C1 527a_100000748446_100103153847 [0,1,0,1,0,0|2,0,0]=4 20222 B15R2.1668 NC(=O)CN1CCc2ccccc2C1 2230a_100000188457_100000747473 [0,1,0,1,0,0|2,0,0]=4 20223 B15R2.1668 NC(=O)CN1CCc2ccccc2C1 269982a_100000188457_100000187820 [0,1,0,1,0,0|2,0,0]=4 20224 B15R2.1668 NC(=O)CN1CCc2ccccc2C1 34a_100000188457_100000187820 [0,1,0,1,0,0|2,0,0]=4 20225 B15R2.1668 O=C([O-])CN1CCc2ccccc2C1 269982a_100000188457_100020667443 [0,1,0,1,0,0|1,0,1]=4 20226 B15R2.1668 O=C([O-])CN1CCc2ccccc2C1 34a_100000188457_100020667443 [0,1,0,1,0,0|1,0,1]=4 20227 B15R2.1668 [13CH3]C(=O)CN1CCc2ccccc2C1 1458a_100015184552_200025704644 [0,1,0,1,0,0|2,0,0]=4 20228 B15R2.8795 CC(=O)NC1CC1c2ccccc2F 1626a_100000753450_100015343762 [0,1,0,1,0,0|2,0,0]=4 20229 B15R2.8795 CC(=O)NC1CC1c2ccccc2F 240690a_100000753450_100015343762 [0,1,0,1,0,0|2,0,0]=4 20230 B15R2.8795 CC(=O)NC1CC1c2ccccc2F 527a_100000753450_100103153847 [0,1,0,1,0,0|2,0,0]=4 20231 B15R2.8833 Cc1ccccc1CSC2CC(=O)C2 62a_100009894365_100000211839 [0,1,0,1,0,0|2,0,0]=4 20232 B15R2.8833 Cc1ccccc1OCC2CC(=O)C2 7a_100000210338_100009874392 [0,1,0,1,0,0|2,0,0]=4 20233 B15R2.8833 Cc1ccccc1SCC2CC(=O)C2 62a_100000210755_100009874392 [0,1,0,1,0,0|2,0,0]=4 20234 B15R2.8833 Cc1ccccc1SCC2CC(=O)C2 62a_100009874392_100000210755 [0,1,0,1,0,0|2,0,0]=4 20235 B15R2.8833 Nc1ccccc1OCC2CC(=O)C2 7a_100000185747_100009874392 [0,1,0,1,0,0|2,0,0]=4 20236 B15R2.8833 Nc1ccccc1SCC2CC(=O)C2 62a_100000210017_100009874392 [0,1,0,1,0,0|2,0,0]=4 20237 B15R2.8833 Nc1ccccc1SCC2CC(=O)C2 62a_100009874392_100000210017 [0,1,0,1,0,0|2,0,0]=4 20238 B15R2.8833 O=C1CC(C1)COc2ccccc2Br 7a_100000181306_100009874392 [0,1,0,1,0,0|2,0,0]=4 20239 B15R2.8833 O=C1CC(C1)COc2ccccc2Cl 7a_100000210172_100009874392 [0,1,0,1,0,0|2,0,0]=4 20240 B15R2.8833 O=C1CC(C1)COc2ccccc2F 7a_100000210171_100009874392 [0,1,0,1,0,0|2,0,0]=4 20241 B15R2.8833 O=C1CC(C1)COc2ccccc2I 7a_100000739446_100009874392 [0,1,0,1,0,0|2,0,0]=4 20242 B15R2.8833 O=C1CC(C1)CSc2ccccc2Br 62a_100000695589_100009874392 [0,1,0,1,0,0|2,0,0]=4 20243 B15R2.8833 O=C1CC(C1)CSc2ccccc2Br 62a_100009874392_100000695589 [0,1,0,1,0,0|2,0,0]=4 20244 B15R2.8833 O=C1CC(C1)CSc2ccccc2Cl 62a_100000764095_100009874392 [0,1,0,1,0,0|2,0,0]=4 20245 B15R2.8833 O=C1CC(C1)CSc2ccccc2Cl 62a_100009874392_100000764095 [0,1,0,1,0,0|2,0,0]=4 20246 B15R2.8833 O=C1CC(C1)CSc2ccccc2F 62a_100009874392_100011215700 [0,1,0,1,0,0|2,0,0]=4 20247 B15R2.8833 O=C1CC(C1)CSc2ccccc2F 62a_100011215700_100009874392 [0,1,0,1,0,0|2,0,0]=4 20248 B15R2.8833 O=C1CC(C1)CSc2ccccc2O 62a_100000739446_100009874392 [0,1,0,1,0,0|2,0,0]=4 20249 B15R2.8833 O=C1CC(C1)CSc2ccccc2O 62a_100009874392_100000739446 [0,1,0,1,0,0|2,0,0]=4 20250 B15R2.8833 O=C1CC(C1)SCc2ccccc2Br 62a_100009894365_100000184730 [0,1,0,1,0,0|2,0,0]=4 20251 B15R2.8833 O=C1CC(C1)SCc2ccccc2Cl 62a_100009894365_100000187162 [0,1,0,1,0,0|2,0,0]=4 20252 B15R2.8833 O=C1CC(C1)SCc2ccccc2F 62a_100009894365_100000211605 [0,1,0,1,0,0|2,0,0]=4 20253 B15R2.8833 O=C1CC(C1)SCc2ccccc2I 62a_100009894365_100011216222 [0,1,0,1,0,0|2,0,0]=4 20254 B15R2.13587 CC(=O)NC1CCc2c1cccc2Br 11a_100000751068_100015343762 [0,1,0,1,0,0|2,0,0]=4 20255 B15R2.13587 CC(=O)NC1CCc2c1cccc2Br 1626a_100000751068_100015343762 [0,1,0,1,0,0|2,0,0]=4 20256 B15R2.13587 CC(=O)NC1CCc2c1cccc2Br 240690a_100000751068_100015343762 [0,1,0,1,0,0|2,0,0]=4 20257 B15R2.13587 CC(=O)NC1CCc2c1cccc2Br 527a_100000751068_100103153847 [0,1,0,1,0,0|2,0,0]=4 20258 B15R2.13587 CC(=O)NC1CCc2c1cccc2Cl 11a_100000743989_100015343762 [0,1,0,1,0,0|2,0,0]=4 20259 B15R2.13587 CC(=O)NC1CCc2c1cccc2Cl 1626a_100000743989_100015343762 [0,1,0,1,0,0|2,0,0]=4 20260 B15R2.13587 CC(=O)NC1CCc2c1cccc2Cl 240690a_100000743989_100015343762 [0,1,0,1,0,0|2,0,0]=4 20261 B15R2.13587 CC(=O)NC1CCc2c1cccc2Cl 527a_100000743989_100103153847 [0,1,0,1,0,0|2,0,0]=4 20262 B15R2.13587 CC(=O)N[C@H]1CCc2c1cccc2C 11a_100134618347_100015343762 [0,1,0,1,0,0|2,0,0]=4 20263 B15R2.13587 CC(=O)N[C@H]1CCc2c1cccc2C 1626a_100134618347_100015343762 [0,1,0,1,0,0|2,0,0]=4 20264 B15R2.13587 CC(=O)N[C@H]1CCc2c1cccc2C 240690a_100134618347_100015343762 [0,1,0,1,0,0|2,0,0]=4 20265 B15R2.13587 CC(=O)N[C@H]1CCc2c1cccc2C 527a_100134618347_100103153847 [0,1,0,1,0,0|2,0,0]=4 20266 B15R2.13587 CC(=O)N[C@H]1CCc2c1cccc2F 11a_100015193782_100015343762 [0,1,0,1,0,0|2,0,0]=4 20267 B15R2.13587 CC(=O)N[C@H]1CCc2c1cccc2F 1626a_100015193782_100015343762 [0,1,0,1,0,0|2,0,0]=4 20268 B15R2.13587 CC(=O)N[C@H]1CCc2c1cccc2F 240690a_100015193782_100015343762 [0,1,0,1,0,0|2,0,0]=4 20269 B15R2.13587 CC(=O)N[C@H]1CCc2c1cccc2F 527a_100015193782_100103153847 [0,1,0,1,0,0|2,0,0]=4 20270 B15R2.13587 CC(=O)N[C@H]1CCc2c1cccc2O 1626a_100134616730_100015343762 [0,1,0,1,0,0|2,0,0]=4 20271 B15R2.13587 CC(=O)N[C@H]1CCc2c1cccc2O 240690a_100134616730_100015343762 [0,1,0,1,0,0|2,0,0]=4 20272 B15R2.13587 CC(=O)N[C@H]1CCc2c1cccc2O 527a_100134616730_100103153847 [0,1,0,1,0,0|2,0,0]=4 20273 B15R2.59 CC(=O)N1CCC(C1)c2ccccc2 11a_100000747531_100015343762 [0,1,0,1,0,0|2,0,0]=4 20274 B15R2.59 CC(=O)N1CCC(C1)c2ccccc2 1626a_100000747531_100015343762 [0,1,0,1,0,0|2,0,0]=4 20275 B15R2.59 CC(=O)N1CCC(C1)c2ccccc2 240690a_100000747531_100015343762 [0,1,0,1,0,0|2,0,0]=4 20276 B15R2.59 CC(=O)N1CCC(C1)c2ccccc2 527a_100000747531_100103153847 [0,1,0,1,0,0|2,0,0]=4 20277 B15R2.297 CN(c1ccccc1)C2COC(=O)O2 34a_100000210012_100000032252 [0,1,0,1,0,0|2,0,0]=4 20278 B15R2.612 CC(SC1CC(=O)C1)c2ccccc2 62a_100009894365_100000230085 [0,1,0,1,0,0|2,0,0]=4 20279 B15R2.612 CN(CC1CC(=O)C1)c2ccccc2 2230a_100000210012_100009874392 [0,1,0,1,0,0|2,0,0]=4 20280 B15R2.612 CN(CC1CC(=O)C1)c2ccccc2 269982a_100000210012_100009874392 [0,1,0,1,0,0|2,0,0]=4 20281 B15R2.612 O=C1CC(C1)CC(=O)c2ccccc2 1458a_100000185807_100009874392 [0,1,0,1,0,0|1,0,1]=4 20282 B15R2.1224 CC(=O)N[C@H]1C[C@H](C1)c2ccccc2 11a_102125402554_100015343762 [0,1,0,1,0,0|2,0,0]=4 20283 B15R2.1224 CC(=O)N[C@H]1C[C@H](C1)c2ccccc2 1626a_102125402554_100015343762 [0,1,0,1,0,0|2,0,0]=4 20284 B15R2.1224 CC(=O)N[C@H]1C[C@H](C1)c2ccccc2 527a_102125402554_100103153847 [0,1,0,1,0,0|2,0,0]=4 20285 B15R2.596 CN(Cc1ccccc1)C2CC(=O)C2 269982a_100000186898_100009894365 [0,1,0,1,0,0|2,0,0]=4 20286 B15R2.596 O=C1C[C@H](N1)C(=O)Cc2ccccc2 1458a_100016090685_100015291786 [0,1,0,1,0,0|1,0,1]=4 20287 B15R2.993 CC(=O)N[C@H]1c2ccccc2C[C@H]1O 11a_100000744645_100015343762 [0,1,0,1,0,0|2,0,0]=4 20288 B15R2.993 CC(=O)N[C@H]1c2ccccc2C[C@H]1O 240690a_100000744645_100015343762 [0,1,0,1,0,0|2,0,0]=4 20289 B15R2.993 CC(=O)N[C@H]1c2ccccc2C[C@H]1O 527a_100000744645_100103153847 [0,1,0,1,0,0|2,0,0]=4 20290 B15R2.1244 NC(=O)C1CN(C1)Cc2ccccc2 270004a_100025753142_100015611070 [0,1,0,1,0,0|2,0,0]=4 20291 B15R2.1244 NC(=O)C1CN(C1)Cc2ccccc2 34a_100025753142_100015291786 [0,1,0,1,0,0|2,0,0]=4 20292 B15R2.28 Cc1ccc(cc1)C2=CC(=O)CCC2 271570a_100000723966_100000186775 [0,1,0,1,0,0|1,0,1]=4 20293 B15R2.28 Nc1ccc(cc1)C2=CC(=O)CCC2 271570a_100000723966_100000185761 [0,1,0,1,0,0|1,0,1]=4 20294 B15R2.28 O=C1C=C(CCC1)c2ccc(cc2)Br 271570a_100000723966_100000752885 [0,1,0,1,0,0|1,0,1]=4 20295 B15R2.28 O=C1C=C(CCC1)c2ccc(cc2)Cl 271570a_100000723966_100000755918 [0,1,0,1,0,0|1,0,1]=4 20296 B15R2.28 O=C1C=C(CCC1)c2ccc(cc2)F 271570a_100000723966_100000211213 [0,1,0,1,0,0|1,0,1]=4 20297 B15R2.28 O=C1C=C(CCC1)c2ccc(cc2)O 271570a_100000723966_100000185759 [0,1,0,1,0,0|1,0,1]=4 20298 B15R2.98 Cc1ccc(cc1)NC2COC(=O)O2 34a_100000124888_100000032252 [0,1,0,1,0,0|2,0,0]=4 20299 B15R2.98 Cc1ccc(cc1)OC2COC(=O)O2 34a_100000210336_100000032252 [0,1,0,1,0,0|2,0,0]=4 20300 B15R2.98 Cc1ccc(cc1)SC2COC(=O)O2 62a_100000186775_100000032252 [0,1,0,1,0,0|2,0,0]=4 20301 B15R2.98 Nc1ccc(cc1)OC2COC(=O)O2 34a_100000185829_100000032252 [0,1,0,1,0,0|2,0,0]=4 20302 B15R2.98 Nc1ccc(cc1)SC2COC(=O)O2 62a_100000185761_100000032252 [0,1,0,1,0,0|2,0,0]=4 20303 B15R2.98 O=C1OCC(O1)Nc2ccc(cc2)Br 34a_100000210018_100000032252 [0,1,0,1,0,0|2,0,0]=4 20304 B15R2.98 O=C1OCC(O1)Nc2ccc(cc2)Cl 34a_100000210052_100000032252 [0,1,0,1,0,0|2,0,0]=4 20305 B15R2.98 O=C1OCC(O1)Nc2ccc(cc2)F 34a_100000185862_100000032252 [0,1,0,1,0,0|2,0,0]=4 20306 B15R2.98 O=C1OCC(O1)Nc2ccc(cc2)I 34a_100000185761_100000032252 [0,1,0,1,0,0|2,0,0]=4 20307 B15R2.98 O=C1OCC(O1)Nc2ccc(cc2)O 34a_100000185829_100000032252 [0,1,0,1,0,0|2,0,0]=4 20308 B15R2.98 O=C1OCC(O1)Oc2ccc(cc2)Br 34a_100000185759_100000032252 [0,1,0,1,0,0|2,0,0]=4 20309 B15R2.98 O=C1OCC(O1)Oc2ccc(cc2)Cl 34a_100000210216_100000032252 [0,1,0,1,0,0|2,0,0]=4 20310 B15R2.98 O=C1OCC(O1)Oc2ccc(cc2)F 34a_100000210339_100000032252 [0,1,0,1,0,0|2,0,0]=4 20311 B15R2.98 O=C1OCC(O1)Oc2ccc(cc2)I 34a_100000212066_100000032252 [0,1,0,1,0,0|2,0,0]=4 20312 B15R2.98 O=C1OCC(O1)Sc2ccc(cc2)Br 62a_100000752885_100000032252 [0,1,0,1,0,0|2,0,0]=4 20313 B15R2.98 O=C1OCC(O1)Sc2ccc(cc2)Cl 62a_100000755918_100000032252 [0,1,0,1,0,0|2,0,0]=4 20314 B15R2.98 O=C1OCC(O1)Sc2ccc(cc2)F 62a_100000211213_100000032252 [0,1,0,1,0,0|2,0,0]=4 20315 B15R2.1553 Cc1ccc(cc1)CSC2CC(=O)C2 62a_100009894365_100000210814 [0,1,0,1,0,0|2,0,0]=4 20316 B15R2.1553 Cc1ccc(cc1)OCC2CC(=O)C2 7a_100000210336_100009874392 [0,1,0,1,0,0|2,0,0]=4 20317 B15R2.1553 Cc1ccc(cc1)SCC2CC(=O)C2 62a_100000186775_100009874392 [0,1,0,1,0,0|2,0,0]=4 20318 B15R2.1553 Cc1ccc(cc1)SCC2CC(=O)C2 62a_100009874392_100000186775 [0,1,0,1,0,0|2,0,0]=4 20319 B15R2.1553 Nc1ccc(cc1)SCC2CC(=O)C2 62a_100000185761_100009874392 [0,1,0,1,0,0|2,0,0]=4 20320 B15R2.1553 Nc1ccc(cc1)SCC2CC(=O)C2 62a_100009874392_100000185761 [0,1,0,1,0,0|2,0,0]=4 20321 B15R2.1553 O=C1CC(C1)CNc2ccc(cc2)Br 2230a_100000210018_100009874392 [0,1,0,1,0,0|2,0,0]=4 20322 B15R2.1553 O=C1CC(C1)CNc2ccc(cc2)Cl 2230a_100000210052_100009874392 [0,1,0,1,0,0|2,0,0]=4 20323 B15R2.1553 O=C1CC(C1)COc2ccc(cc2)Br 7a_100000185759_100009874392 [0,1,0,1,0,0|2,0,0]=4 20324 B15R2.1553 O=C1CC(C1)COc2ccc(cc2)Cl 7a_100000210216_100009874392 [0,1,0,1,0,0|2,0,0]=4 20325 B15R2.1553 O=C1CC(C1)COc2ccc(cc2)I 7a_100000212066_100009874392 [0,1,0,1,0,0|2,0,0]=4 20326 B15R2.1553 O=C1CC(C1)CSc2ccc(cc2)Br 62a_100000752885_100009874392 [0,1,0,1,0,0|2,0,0]=4 20327 B15R2.1553 O=C1CC(C1)CSc2ccc(cc2)Br 62a_100009874392_100000752885 [0,1,0,1,0,0|2,0,0]=4 20328 B15R2.1553 O=C1CC(C1)CSc2ccc(cc2)Cl 62a_100000755918_100009874392 [0,1,0,1,0,0|2,0,0]=4 20329 B15R2.1553 O=C1CC(C1)CSc2ccc(cc2)Cl 62a_100009874392_100000755918 [0,1,0,1,0,0|2,0,0]=4 20330 B15R2.1553 O=C1CC(C1)CSc2ccc(cc2)F 62a_100000211213_100009874392 [0,1,0,1,0,0|2,0,0]=4 20331 B15R2.1553 O=C1CC(C1)CSc2ccc(cc2)F 62a_100009874392_100000211213 [0,1,0,1,0,0|2,0,0]=4 20332 B15R2.1553 O=C1CC(C1)CSc2ccc(cc2)O 62a_100009874392_100000185759 [0,1,0,1,0,0|2,0,0]=4 20333 B15R2.1553 O=C1CC(C1)SCc2ccc(cc2)Br 62a_100009894365_100000189115 [0,1,0,1,0,0|2,0,0]=4 20334 B15R2.1553 O=C1CC(C1)SCc2ccc(cc2)Cl 62a_100009894365_100000187161 [0,1,0,1,0,0|2,0,0]=4 20335 B15R2.1553 O=C1CC(C1)SCc2ccc(cc2)F 62a_100009894365_100000187164 [0,1,0,1,0,0|2,0,0]=4 20336 B15R2.1553 O=C1CC(C1)SCc2ccc(cc2)I 62a_100009894365_100000189116 [0,1,0,1,0,0|2,0,0]=4 20337 B15R2.6974 CC(=O)NC1CC1c2ccc(cc2)Br 11a_100000755575_100015343762 [0,1,0,1,0,0|2,0,0]=4 20338 B15R2.6974 CC(=O)NC1CC1c2ccc(cc2)Br 1626a_100000755575_100015343762 [0,1,0,1,0,0|2,0,0]=4 20339 B15R2.6974 CC(=O)NC1CC1c2ccc(cc2)Br 240690a_100000755575_100015343762 [0,1,0,1,0,0|2,0,0]=4 20340 B15R2.6974 CC(=O)N[C@@H]1C[C@H]1c2ccc(cc2)F 1626a_100025713227_100015343762 [0,1,0,1,0,0|2,0,0]=4 20341 B15R2.6974 CC(=O)N[C@@H]1C[C@H]1c2ccc(cc2)F 240690a_100025713227_100015343762 [0,1,0,1,0,0|2,0,0]=4 20342 B15R2.9410 CC(=O)CC1CCc2c1cc(cc2)F 1458a_200009856706_200000210301 [0,1,0,1,0,0|1,0,0]=3 20343 B15R2.9410 CC(=O)NC1CCc2c1cc(cc2)Br 11a_100011435097_100015343762 [0,1,0,1,0,0|2,0,0]=4 20344 B15R2.9410 CC(=O)NC1CCc2c1cc(cc2)Br 1626a_100011435097_100015343762 [0,1,0,1,0,0|2,0,0]=4 20345 B15R2.9410 CC(=O)NC1CCc2c1cc(cc2)Br 240690a_100011435097_100015343762 [0,1,0,1,0,0|2,0,0]=4 20346 B15R2.9410 CC(=O)NC1CCc2c1cc(cc2)Br 527a_100011435097_100103153847 [0,1,0,1,0,0|2,0,0]=4 20347 B15R2.9410 CC(=O)NC1CCc2c1cc(cc2)Cl 11a_100016987686_100015343762 [0,1,0,1,0,0|2,0,0]=4 20348 B15R2.9410 CC(=O)NC1CCc2c1cc(cc2)Cl 1626a_100016987686_100015343762 [0,1,0,1,0,0|2,0,0]=4 20349 B15R2.9410 CC(=O)NC1CCc2c1cc(cc2)Cl 240690a_100016987686_100015343762 [0,1,0,1,0,0|2,0,0]=4 20350 B15R2.9410 CC(=O)NC1CCc2c1cc(cc2)Cl 527a_100016987686_100103153847 [0,1,0,1,0,0|2,0,0]=4 20351 B15R2.9410 CC(=O)NC1CCc2c1cc(cc2)F 11a_100000752734_100015343762 [0,1,0,1,0,0|2,0,0]=4 20352 B15R2.9410 CC(=O)NC1CCc2c1cc(cc2)F 1626a_100000752734_100015343762 [0,1,0,1,0,0|2,0,0]=4 20353 B15R2.9410 CC(=O)NC1CCc2c1cc(cc2)F 240690a_100000752734_100015343762 [0,1,0,1,0,0|2,0,0]=4 20354 B15R2.9410 CC(=O)NC1CCc2c1cc(cc2)F 527a_100000752734_100103153847 [0,1,0,1,0,0|2,0,0]=4 20355 B15R2.9410 [13CH3]C(=O)CC1CCc2c1cc(cc2)F 1458a_200009856706_200025704644 [0,1,0,1,0,0|1,0,0]=3 20356 B15R2.4 C=CC(=O)N[C@H]1CCc2c1cccc2 1626a_100016989578_100000185746 [0,1,0,1,0,0|2,0,0]=4 20357 B15R2.4 C=CC(=O)N[C@H]1CCc2c1cccc2 240690a_100016989578_200121576911 [0,1,0,1,0,0|2,0,0]=4 20358 B15R2.4 CCC(=O)CC1CCc2c1cccc2 1458a_100000756587_100000210202 [0,1,0,1,0,0|1,0,0]=3 20359 B15R2.4 CCC(=O)CN1CCc2c1cccc2 1458a_100000742689_100000210202 [0,1,0,1,0,0|2,0,0]=4 20360 B15R2.4 CCC(=O)N[C@H]1CCc2c1cccc2 11a_100016989578_100000210414 [0,1,0,1,0,0|2,0,0]=4 20361 B15R2.4 CCC(=O)N[C@H]1CCc2c1cccc2 1626a_100016989578_100000210414 [0,1,0,1,0,0|2,0,0]=4 20362 B15R2.4 CCC(=O)N[C@H]1CCc2c1cccc2 240690a_100016989578_100000210414 [0,1,0,1,0,0|2,0,0]=4 20363 B15R2.4 CCC(=O)N[C@H]1CCc2c1cccc2 527a_100016989578_100000210414 [0,1,0,1,0,0|2,0,0]=4 20364 B15R2.4 CNC(=O)CC1CCc2c1cccc2 11a_106832991635_100000756587 [0,1,0,1,0,0|1,0,0]=3 20365 B15R2.4 CNC(=O)CC1CCc2c1cccc2 1626a_100102657272_100000756587 [0,1,0,1,0,0|1,0,0]=3 20366 B15R2.4 CNC(=O)CC1CCc2c1cccc2 240690a_100102657272_100000756587 [0,1,0,1,0,0|1,0,0]=3 20367 B15R2.4 CNC(=O)CC1CCc2c1cccc2 527a_100102657272_100000756587 [0,1,0,1,0,0|1,0,0]=3 20368 B15R2.4 CNC(=O)CN1CCc2c1cccc2 527a_100102657272_100000742689 [0,1,0,1,0,0|2,0,0]=4 20369 B15R2.4 CNC(=O)N[C@H]1CCc2c1cccc2 2708a_100016989578_106832991635 [0,1,0,1,0,0|2,0,0]=4 20370 B15R2.4 CNC(=O)N[C@H]1CCc2c1cccc2 2708a_100102657272_100016989578 [0,1,0,1,0,0|2,0,0]=4 20371 B15R2.4 CNC(=O)N[C@H]1CCc2c1cccc2 273464a_100016989578_100102657272 [0,1,0,1,0,0|2,0,0]=4 20372 B15R2.4 CNC(=O)N[C@H]1CCc2c1cccc2 273464a_100102657272_100016989578 [0,1,0,1,0,0|2,0,0]=4 20373 B15R2.4 CNC(=O)N[C@H]1CCc2c1cccc2 512a_100016989578_100102657272 [0,1,0,1,0,0|2,0,0]=4 20374 B15R2.4 CNC(=O)N[C@H]1CCc2c1cccc2 512a_106832991638_100016989578 [0,1,0,1,0,0|2,0,0]=4 20375 B15R2.4 O=C(CF)CC1CCc2c1cccc2 1458a_100000756587_100015361967 [0,1,0,1,0,0|1,0,0]=3 20376 B15R2.4 O=C(CF)CN1CCc2c1cccc2 1458a_100000742689_100015361967 [0,1,0,1,0,0|2,0,0]=4 20377 B15R2.4 O=C(CO)NC1COc2c1cccc2 240690a_100000747519_100000210174 [0,1,0,1,0,0|2,0,0]=4 20378 B15R2.4 O=C(CO)NC1COc2c1cccc2 527a_100000747519_100000210174 [0,1,0,1,0,0|2,0,0]=4 20379 B15R2.4 O=C(CO)N[C@H]1CCc2c1cccc2 240690a_100016989578_100000210174 [0,1,0,1,0,0|1,0,0]=3 20380 B15R2.4 O=C(CO)N[C@H]1CCc2c1cccc2 527a_100016989578_100000210174 [0,1,0,1,0,0|1,0,0]=3 20381 B15R2.342 O=C1CCC1CCOc2ccccc2 7a_100000210340_200016118888 [0,1,0,1,0,0|2,0,0]=4 20382 B15R2.342 O=C1CCC1CCSc2ccccc2 62a_100000719477_200016118888 [0,1,0,1,0,0|2,0,0]=4 20383 B15R2.342 O=C1CCC1CCSc2ccccc2 62a_200016118888_100000041952 [0,1,0,1,0,0|2,0,0]=4 20384 B15R2.342 O=C1CCC1NCCc2ccccc2 34a_100000106460_100009892977 [0,1,0,1,0,0|2,0,0]=4 20385 B15R2.342 O=C1CCC1OCCc2ccccc2 34a_100000210268_100009892977 [0,1,0,1,0,0|2,0,0]=4 20386 B15R2.342 O=C1CCC1OCCc2ccccc2 7a_100000210268_100009892977 [0,1,0,1,0,0|2,0,0]=4 20387 B15R2.342 O=C1CCC1SCCc2ccccc2 62a_100000765856_100009892977 [0,1,0,1,0,0|2,0,0]=4 20388 B15R2.342 O=C1CCC1SCCc2ccccc2 62a_100009892977_100011218657 [0,1,0,1,0,0|2,0,0]=4 20389 B15R2.1561 C=CC(=O)N1C[C@@H]1Cc2ccccc2 1626a_100016998360_100000185746 [0,1,0,1,0,0|2,0,0]=4 20390 B15R2.1561 C=CC(=O)N1C[C@@H]1Cc2ccccc2 240690a_100016998360_200121576911 [0,1,0,1,0,0|2,0,0]=4 20391 B15R2.1561 CCC(=O)N1C[C@@H]1Cc2ccccc2 11a_100016998360_100000210414 [0,1,0,1,0,0|2,0,0]=4 20392 B15R2.1561 CCC(=O)N1C[C@@H]1Cc2ccccc2 1626a_100016998360_100000210414 [0,1,0,1,0,0|2,0,0]=4 20393 B15R2.1561 CCC(=O)N1C[C@@H]1Cc2ccccc2 240690a_100016998360_100000210414 [0,1,0,1,0,0|2,0,0]=4 20394 B15R2.1561 CCC(=O)N1C[C@@H]1Cc2ccccc2 527a_100016998360_100000210414 [0,1,0,1,0,0|2,0,0]=4 20395 B15R2.1561 CNC(=O)N1C[C@@H]1Cc2ccccc2 2708a_100102657272_100016998360 [0,1,0,1,0,0|2,0,0]=4 20396 B15R2.1561 CNC(=O)N1C[C@@H]1Cc2ccccc2 273464a_100102657272_100016998360 [0,1,0,1,0,0|2,0,0]=4 20397 B15R2.1561 COC(=O)C1CN1Cc2ccccc2 2230a_200009830135_100015291786 [0,1,0,1,0,0|1,0,0]=3 20398 B15R2.1561 COC(=O)C1CN1Cc2ccccc2 270004a_200009830135_100015611070 [0,1,0,1,0,0|1,0,0]=3 20399 B15R2.1561 COC(=O)C1CN1Cc2ccccn2 2230a_200009830135_100000721315 [0,1,0,1,0,0|2,0,0]=4 20400 B15R2.1561 COC(=O)C1CN1Cc2ccccn2 270004a_200009830135_100000209966 [0,1,0,1,0,0|2,0,0]=4 20401 B15R2.1561 COC(=O)C1CN1Cc2cccnc2 2230a_200009830135_100000741622 [0,1,0,1,0,0|2,0,0]=4 20402 B15R2.1561 COC(=O)C1CN1Cc2cccnc2 270004a_200009830135_100000209961 [0,1,0,1,0,0|2,0,0]=4 20403 B15R2.1561 COC(=O)C1CN1Cc2ccncc2 2230a_200009830135_100015193705 [0,1,0,1,0,0|2,0,0]=4 20404 B15R2.1561 O=C(CO)N1C[C@@H]1Cc2ccccc2 240690a_100016998360_100000210174 [0,1,0,1,0,0|1,0,0]=3 20405 B15R2.1561 O=C(CO)N1C[C@@H]1Cc2ccccc2 527a_100016998360_100000210174 [0,1,0,1,0,0|1,0,0]=3 20406 B15R2.1600 C=CC(=O)N1CCC1c2ccccc2 1626a_100000739605_100000185746 [0,1,0,1,0,0|2,0,0]=4 20407 B15R2.1600 C=CC(=O)N1CCC1c2ccccc2 240690a_100000739605_200121576911 [0,1,0,1,0,0|2,0,0]=4 20408 B15R2.1600 CCC(=O)N1CCC1c2ccccc2 11a_100000739605_100000210414 [0,1,0,1,0,0|2,0,0]=4 20409 B15R2.1600 CCC(=O)N1CCC1c2ccccc2 1626a_100000739605_100000210414 [0,1,0,1,0,0|2,0,0]=4 20410 B15R2.1600 CCC(=O)N1CCC1c2ccccc2 240690a_100000739605_100000210414 [0,1,0,1,0,0|2,0,0]=4 20411 B15R2.1600 CCC(=O)N1CCC1c2ccccc2 527a_100000739605_100000210414 [0,1,0,1,0,0|2,0,0]=4 20412 B15R2.1600 CNC(=O)N1CCC1c2ccccc2 2708a_100102657272_100000739605 [0,1,0,1,0,0|2,0,0]=4 20413 B15R2.1600 CNC(=O)N1CCC1c2ccccc2 273464a_100102657272_100000739605 [0,1,0,1,0,0|2,0,0]=4 20414 B15R2.1600 O=C(CO)N1CCC1c2ccccc2 240690a_100000739605_100000210174 [0,1,0,1,0,0|1,0,0]=3 20415 B15R2.1600 O=C(CO)N1CCC1c2ccccc2 527a_100000739605_100000210174 [0,1,0,1,0,0|1,0,0]=3 20416 B15R2.1621 C=CC(=O)N[C@H]1C[C@@H]1c2ccccc2 1626a_100020588832_100000185746 [0,1,0,1,0,0|2,0,0]=4 20417 B15R2.1621 C=CC(=O)N[C@H]1C[C@@H]1c2ccccc2 240690a_100020588832_200121576911 [0,1,0,1,0,0|2,0,0]=4 20418 B15R2.1621 CCC(=O)N[C@H]1C[C@@H]1c2ccccc2 11a_100020588832_100000210414 [0,1,0,1,0,0|2,0,0]=4 20419 B15R2.1621 CCC(=O)N[C@H]1C[C@@H]1c2ccccc2 1626a_100020588832_100000210414 [0,1,0,1,0,0|2,0,0]=4 20420 B15R2.1621 CCC(=O)N[C@H]1C[C@@H]1c2ccccc2 240690a_100020588832_100000210414 [0,1,0,1,0,0|2,0,0]=4 20421 B15R2.1621 CCC(=O)N[C@H]1C[C@@H]1c2ccccc2 527a_100020588832_100000210414 [0,1,0,1,0,0|2,0,0]=4 20422 B15R2.1621 CNC(=O)N[C@H]1C[C@@H]1c2ccccc2 2708a_100020588832_106832991635 [0,1,0,1,0,0|2,0,0]=4 20423 B15R2.1621 CNC(=O)N[C@H]1C[C@@H]1c2ccccc2 2708a_100102657272_100020588832 [0,1,0,1,0,0|2,0,0]=4 20424 B15R2.1621 CNC(=O)N[C@H]1C[C@@H]1c2ccccc2 273464a_100020588832_100102657272 [0,1,0,1,0,0|2,0,0]=4 20425 B15R2.1621 CNC(=O)N[C@H]1C[C@@H]1c2ccccc2 512a_100020588832_100102657272 [0,1,0,1,0,0|2,0,0]=4 20426 B15R2.1621 CNC(=O)N[C@H]1C[C@@H]1c2ccccc2 512a_106832991638_100020588832 [0,1,0,1,0,0|2,0,0]=4 20427 B15R2.1621 O=C(CO)N[C@H]1C[C@@H]1c2ccccc2 240690a_100020588832_100000210174 [0,1,0,1,0,0|1,0,0]=3 20428 B15R2.1621 O=C(CO)N[C@H]1C[C@@H]1c2ccccc2 527a_100020588832_100000210174 [0,1,0,1,0,0|1,0,0]=3 20429 B15R2.79185 CCC(=O)CSC1Cc2c1cccc2 62a_100000747405_100009813401 [0,1,0,1,0,0|2,0,0]=4 20430 B15R2.79185 CCC(=O)CSC1Cc2c1cccc2 62a_100009813401_100000747405 [0,1,0,1,0,0|2,0,0]=4 20431 B15R2.79185 CNC(=O)CSC1Cc2c1cccc2 62a_100000183359_100009813401 [0,1,0,1,0,0|2,0,0]=4 20432 B15R2.79185 CNC(=O)CSC1Cc2c1cccc2 62a_100009813401_100000183359 [0,1,0,1,0,0|2,0,0]=4 20433 B15R2.79185 COC(=O)CSC1Cc2c1cccc2 62a_100000747449_100009813401 [0,1,0,1,0,0|1,0,0]=3 20434 B15R2.79185 COC(=O)CSC1Cc2c1cccc2 62a_100009813401_100000747449 [0,1,0,1,0,0|1,0,0]=3 20435 B15R2.79765 CCC(=O)C1CCCc2c1cccc2 1458a_100011198263_100000210202 [0,1,0,1,0,0|1,0,0]=3 20436 B15R2.79765 CCC(=O)C1OCCc2c1cccc2 1458a_100000026751_100000210202 [0,1,0,1,0,0|2,0,0]=4 20437 B15R2.79765 CNC(=O)C1CCCc2c1cccc2 11a_106832991635_100011198263 [0,1,0,1,0,0|1,0,0]=3 20438 B15R2.79765 CNC(=O)C1CCCc2c1cccc2 1626a_100102657272_100011198263 [0,1,0,1,0,0|1,0,0]=3 20439 B15R2.79765 CNC(=O)C1CCCc2c1cccc2 240690a_100102657272_100011198263 [0,1,0,1,0,0|1,0,0]=3 20440 B15R2.79765 CNC(=O)C1CCCc2c1cccc2 527a_100102657272_100011198263 [0,1,0,1,0,0|1,0,0]=3 20441 B15R2.79765 CNC(=O)C1OCCc2c1cccc2 11a_106832991635_100000026751 [0,1,0,1,0,0|2,0,0]=4 20442 B15R2.79765 CNC(=O)C1OCCc2c1cccc2 1626a_100102657272_100000026751 [0,1,0,1,0,0|2,0,0]=4 20443 B15R2.79765 CNC(=O)C1OCCc2c1cccc2 240690a_100102657272_100000026751 [0,1,0,1,0,0|2,0,0]=4 20444 B15R2.79765 CNC(=O)C1OCCc2c1cccc2 527a_100102657272_100000026751 [0,1,0,1,0,0|2,0,0]=4 20445 B15R2.79765 O=C(CF)C1CCCc2c1cccc2 1458a_100011198263_100015361967 [0,1,0,1,0,0|1,0,0]=3 20446 B15R2.79765 O=C(CF)C1OCCc2c1cccc2 1458a_100000026751_100015361967 [0,1,0,1,0,0|2,0,0]=4 20447 B15R2.1162 CN1CCc2ccccc2[C@@H]1C(=O)O 269956a_103496528863_200000210301 [0,1,0,1,0,0|1,0,0]=3 20448 B15R2.1162 [13CH3]N1CCc2ccccc2[C@@H]1C(=O)O 269956a_103496528863_200025704644 [0,1,0,1,0,0|1,0,0]=3 20449 B15R2.133568 CN(CC(=O)O)C1Cc2c1cccc2 269956a_100000746989_100009813401 [0,1,0,1,0,0|1,0,0]=3 20450 B15R2.133568 NC(=O)CC(=O)C1Cc2c1cccc2 1458a_200000238571_100000187820 [0,1,0,1,0,0|1,0,1]=4 20451 B15R2.133568 O=C([O-])CC(=O)C1Cc2c1cccc2 1458a_200000238571_100020667443 [0,1,0,1,0,0|0,0,2]=4 20452 B15R2.107888 CC(=O)C(C)SC1Cc2c1cccc2 62a_100009813401_100009814033 [0,1,0,1,0,0|2,0,0]=4 20453 B15R2.107888 CC(=O)C(C)SC1Cc2c1cccc2 62a_100009814033_100009813401 [0,1,0,1,0,0|2,0,0]=4 20454 B15R2.107888 CC(SC1Cc2c1cccc2)C(=O)N 62a_100000702099_100009813401 [0,1,0,1,0,0|2,0,0]=4 20455 B15R2.107888 CC(SC1Cc2c1cccc2)C(=O)N 62a_100009813401_100000702099 [0,1,0,1,0,0|2,0,0]=4 20456 B15R2.107888 C[C@@H](OC1Cc2c1cccc2)C(=O)N 7a_100000731257_100009813401 [0,1,0,1,0,0|2,0,0]=4 20457 B15R2.107888 C[C@H](NC1Cc2c1cccc2)C(=O)O 269956a_100000743915_100009813401 [0,1,0,1,0,0|1,0,0]=3 20458 B15R2.107888 C[C@H](OC1Cc2c1cccc2)C(=O)[O-] 7a_217856618621_100009813401 [0,1,0,1,0,0|1,0,1]=4 20459 B15R2.107888 NC(=O)C(F)SC1Cc2c1cccc2 62a_100009813401_100009813875 [0,1,0,1,0,0|2,0,0]=4 20460 B15R2.107888 NC(=O)C(F)SC1Cc2c1cccc2 62a_100009813875_100009813401 [0,1,0,1,0,0|2,0,0]=4 20461 B15R2.107888 O=C([O-])C(F)SC1Cc2c1cccc2 62a_100009813401_100020610796 [0,1,0,1,0,0|1,0,1]=4 20462 B15R2.107888 O=C([O-])C(F)SC1Cc2c1cccc2 62a_100020610796_100009813401 [0,1,0,1,0,0|1,0,1]=4 20463 B11R0.147 C=CC=CC(=O)CCCC(=O)C 1458a_100016291481_100011215641 [0,0,1,0,1,0|2,0,0]=4 20464 B11R0.147 C=CC=CC(=O)CCCC(=O)N 1458a_100016291481_100102525003 [0,0,1,0,1,0|2,0,0]=4 20465 B11R1.4 O=CCCCOc1ccsc1 7a_100000106738_200011292268 [1,0,0,0,1,0|2,0,0]=4 20466 B11R1.4 O=CCCCSc1ccco1 62a_100009814098_200011292268 [1,0,0,0,1,0|2,0,0]=4 20467 B11R1.4 O=CCCCSc1ccco1 62a_200011292268_100009814098 [1,0,0,0,1,0|2,0,0]=4 20468 B11R1.4 O=CCCCSc1cccs1 62a_100011215356_200011292268 [1,0,0,0,1,0|2,0,0]=4 20469 B11R1.4 O=CCCCSc1cccs1 62a_200011292268_100011215356 [1,0,0,0,1,0|2,0,0]=4 20470 B11R1.4 O=CCCCSc1ccoc1 62a_100011215275_200011292268 [1,0,0,0,1,0|2,0,0]=4 20471 B11R1.4 O=CCCCSc1ccoc1 62a_200011292268_100011215275 [1,0,0,0,1,0|2,0,0]=4 20472 B11R1.4 O=CCCCSc1ccsc1 62a_100000738268_200011292268 [1,0,0,0,1,0|2,0,0]=4 20473 B11R1.4 O=CCCCSc1ccsc1 62a_200011292268_100000738268 [1,0,0,0,1,0|2,0,0]=4 20474 B11R1.4 O=CCNCCc1ccco1 2230a_100000694680_200015260668 [1,0,0,0,1,0|2,0,0]=4 20475 B11R1.4 O=CCNCCc1ccco1 34a_100000694680_200009817547 [1,0,0,0,1,0|2,0,0]=4 20476 B11R1.4 O=CCNCCc1cccs1 2230a_100000203755_200015260668 [1,0,0,0,1,0|2,0,0]=4 20477 B11R1.4 O=CCNCCc1cccs1 34a_100000203755_200009817547 [1,0,0,0,1,0|2,0,0]=4 20478 B11R1.4 O=CCNCCc1ccsc1 2230a_100000692642_200015260668 [1,0,0,0,1,0|2,0,0]=4 20479 B11R1.4 O=CCNCCc1ccsc1 34a_100000692642_200009817547 [1,0,0,0,1,0|2,0,0]=4 20480 B11R1.4 O=CCNCCn1cccc1 34a_100011368172_200009817547 [1,0,0,0,1,0|2,0,0]=4 20481 B11R1.4 O=CCOCCc1cccs1 34a_100011216825_200009817547 [1,0,0,0,1,0|2,0,0]=4 20482 B11R1.4 O=CCOCCc1cccs1 7a_100011216825_200015260668 [1,0,0,0,1,0|2,0,0]=4 20483 B11R1.4 O=CCOCCc1ccsc1 34a_100000748821_200009817547 [1,0,0,0,1,0|2,0,0]=4 20484 B11R1.4 O=CCOCCn1cccc1 34a_100000179382_200009817547 [1,0,0,0,1,0|2,0,0]=4 20485 B11R1.4 O=CCSCCc1cccs1 62a_100000748579_200015260668 [1,0,0,0,1,0|2,0,0]=4 20486 B11R1.4 O=CCSCCc1cccs1 62a_200015260668_100000748579 [1,0,0,0,1,0|2,0,0]=4 20487 B11R1.4 O=CCSCCn1cccc1 62a_200009811947_200015260668 [1,0,0,0,1,0|2,0,0]=4 20488 B11R1.4 O=CCSCCn1cccc1 62a_200015260668_200000035178 [1,0,0,0,1,0|2,0,0]=4 20489 B11R1.91 CC(=O)CCc1ccccc1 1458a_100000070787_100000765856 [0,0,0,0,2,0|1,0,0]=3 20490 B11R1.91 CC(=O)CCc1ccccc1 1458a_100000185753_200000210301 [0,0,0,0,2,0|1,0,0]=3 20491 B11R1.91 CC(=O)CCc1ccccn1 1458a_100000070787_100015183660 [0,0,0,0,2,0|2,0,0]=4 20492 B11R1.91 CC(=O)CCc1ccccn1 1458a_100015195070_200000210301 [0,0,0,0,2,0|2,0,0]=4 20493 B11R1.91 CC(=O)CCc1cccnc1 1458a_100000070787_200011713674 [0,0,0,0,2,0|2,0,0]=4 20494 B11R1.91 CC(=O)CCc1cccnc1 1458a_100000198484_200000210301 [0,0,0,0,2,0|2,0,0]=4 20495 B11R1.91 CC(=O)CCc1ccncc1 1458a_100000070787_100000723409 [0,0,0,0,2,0|2,0,0]=4 20496 B11R1.91 CC(=O)CCc1ccncc1 1458a_100011225043_200000210301 [0,0,0,0,2,0|2,0,0]=4 20497 B11R1.91 CC(=O)COc1ccccc1 1458a_100000186222_200000210301 [0,0,0,0,2,0|2,0,0]=4 20498 B11R1.91 CC(=O)CSc1ccccc1 1458a_100000211596_200000210301 [0,0,0,0,2,0|2,0,0]=4 20499 B11R1.91 CC(=O)NCc1ccccc1 11a_100015324214_100015343762 [0,0,0,0,2,0|2,0,0]=4 20500 B11R1.91 CC(=O)NCc1ccccc1 1626a_100015324214_100015343762 [0,0,0,0,2,0|2,0,0]=4 20501 B11R1.91 CC(=O)NCc1ccccc1 240690a_100015324214_100015343762 [0,0,0,0,2,0|2,0,0]=4 20502 B11R1.91 CC(=O)NCc1ccccc1 527a_100015324214_100103153847 [0,0,0,0,2,0|2,0,0]=4 20503 B11R1.91 NC(=O)CNc1ccccc1 34a_100000106764_100000187820 [0,0,0,0,2,0|2,0,0]=4 20504 B11R1.91 NC(=O)COc1ccccc1 34a_100000210340_100000187820 [0,0,0,0,2,0|2,0,0]=4 20505 B11R1.91 NC(=O)COc1ccccc1 7a_100000210340_100000187820 [0,0,0,0,2,0|2,0,0]=4 20506 B11R1.91 NC(=O)CSc1ccccc1 62a_100000719477_100000747473 [0,0,0,0,2,0|2,0,0]=4 20507 B11R1.91 NC(=O)CSc1ccccc1 62a_100000747473_100000041952 [0,0,0,0,2,0|2,0,0]=4 20508 B11R1.91 O=C([O-])CNc1ccccc1 34a_100000106764_100020667443 [0,0,0,0,2,0|1,0,1]=4 20509 B11R1.91 O=C([O-])COc1ccccc1 34a_100000210340_100020667443 [0,0,0,0,2,0|1,0,1]=4 20510 B11R1.91 O=C([O-])CSc1ccccc1 62a_100000719477_100020667443 [0,0,0,0,2,0|1,0,1]=4 20511 B11R1.91 O=C([O-])CSc1ccccc1 62a_100020667443_100000041952 [0,0,0,0,2,0|1,0,1]=4 20512 B11R1.91 [13CH3]C(=O)CCc1ccccc1 1458a_100000185753_200025704644 [0,0,0,0,2,0|1,0,0]=3 20513 B11R1.91 [13CH3]C(=O)CCc1ccccn1 1458a_100015195070_200025704644 [0,0,0,0,2,0|2,0,0]=4 20514 B11R1.91 [13CH3]C(=O)CCc1cccnc1 1458a_100000198484_200025704644 [0,0,0,0,2,0|2,0,0]=4 20515 B11R1.91 [13CH3]C(=O)CCc1ccncc1 1458a_100011225043_200025704644 [0,0,0,0,2,0|2,0,0]=4 20516 B11R1.91 [13CH3]C(=O)COc1ccccc1 1458a_100000186222_200025704644 [0,0,0,0,2,0|2,0,0]=4 20517 B11R1.91 [13CH3]C(=O)CSc1ccccc1 1458a_100000211596_200025704644 [0,0,0,0,2,0|2,0,0]=4 20518 B11R1.172 CC(=O)CCCc1cccs1 1458a_100000070787_100010992444 [0,0,0,0,2,0|2,0,0]=4 20519 B11R1.172 CC(=O)CCCc1cccs1 1458a_100000184482_200000210301 [0,0,0,0,2,0|2,0,0]=4 20520 B11R1.172 CC(=O)CCCn1cccc1 1458a_100000070787_200009814367 [0,0,0,0,2,0|2,0,0]=4 20521 B11R1.172 CC(=O)CCCn1cccc1 1458a_100000691410_200000210301 [0,0,0,0,2,0|2,0,0]=4 20522 B11R1.172 O=C(O)CNCc1ccsc1 269956a_100016091260_100011261437 [0,0,0,0,2,0|2,0,0]=4 20523 B11R1.172 [13CH3]C(=O)CCCc1cccs1 1458a_100000184482_200025704644 [0,0,0,0,2,0|2,0,0]=4 20524 B11R1.172 [13CH3]C(=O)CCCn1cccc1 1458a_100000691410_200025704644 [0,0,0,0,2,0|2,0,0]=4 20525 B15R1.504 C=C(Br)CCOCCCc1ccccc1 34a_100009813270_100000211621 [0,0,0,0,0,2|2,0,0]=4 20526 B15R1.504 C=C(Br)CCOCCOc1ccccc1 34a_100009813270_100000184471 [0,0,0,0,0,2|2,0,0]=4 20527 B15R1.504 C=C(Br)CCOCCSc1ccccc1 34a_100009813270_100000246102 [0,0,0,0,0,2|2,0,0]=4 20528 B15R1.504 C=C(Br)CCOCOCc1ccccc1 34a_100009813270_100000763385 [0,0,0,0,0,2|2,0,0]=4 20529 B15R1.504 C=C(Br)CCOCSCc1ccccc1 34a_100009813270_200011217039 [0,0,0,0,0,2|2,0,0]=4 20530 B15R1.504 C=C(C)CCNCCCc1ccccc1 2230a_100000211184_100000730704 [0,0,0,0,0,2|2,0,0]=4 20531 B15R1.504 C=C(C)CCNCCCc1ccccc1 34a_100000211184_100000730704 [0,0,0,0,0,2|2,0,0]=4 20532 B15R1.504 C=C(C)CCNCCOc1ccccc1 2230a_100000174943_100000730704 [0,0,0,0,0,2|2,0,0]=4 20533 B15R1.504 C=C(C)CCNCCOc1ccccc1 34a_100000174943_100000730704 [0,0,0,0,0,2|2,0,0]=4 20534 B15R1.504 C=C(C)CCNCCSc1ccccc1 2230a_100000189519_100000730704 [0,0,0,0,0,2|2,0,0]=4 20535 B15R1.504 C=C(C)CCOCCCc1ccccc1 34a_100000210828_100000730704 [0,0,0,0,0,2|2,0,0]=4 20536 B15R1.504 C=C(C)CCOCCCc1ccccc1 34a_100000764851_100000211621 [0,0,0,0,0,2|2,0,0]=4 20537 B15R1.504 C=C(C)CCOCCCc1ccccc1 7a_100000210828_100000730704 [0,0,0,0,0,2|2,0,0]=4 20538 B15R1.504 C=C(C)CCOCCNc1ccccc1 34a_100000211345_100000730704 [0,0,0,0,0,2|2,0,0]=4 20539 B15R1.504 C=C(C)CCOCCOc1ccccc1 34a_100000210260_100000730704 [0,0,0,0,0,2|2,0,0]=4 20540 B15R1.504 C=C(C)CCOCCOc1ccccc1 34a_100000764851_100000184471 [0,0,0,0,0,2|2,0,0]=4 20541 B15R1.504 C=C(C)CCOCCOc1ccccc1 7a_100000210260_100000730704 [0,0,0,0,0,2|2,0,0]=4 20542 B15R1.504 C=C(C)CCOCCSc1ccccc1 34a_100000764851_100000246102 [0,0,0,0,0,2|2,0,0]=4 20543 B15R1.504 C=C(C)CCOCCSc1ccccc1 7a_100000230494_100000730704 [0,0,0,0,0,2|2,0,0]=4 20544 B15R1.504 C=C(C)CCOCOCc1ccccc1 34a_100000764851_100000763385 [0,0,0,0,0,2|2,0,0]=4 20545 B15R1.504 C=C(C)CCOCSCc1ccccc1 34a_100000764851_200011217039 [0,0,0,0,0,2|2,0,0]=4 20546 B15R1.504 C=C(C)CCSCCCc1ccccc1 62a_100000211621_100000730704 [0,0,0,0,0,2|2,0,0]=4 20547 B15R1.504 C=C(C)CCSCCCc1ccccc1 62a_100000730704_100000211621 [0,0,0,0,0,2|2,0,0]=4 20548 B15R1.504 C=C(C)CCSCCOc1ccccc1 62a_100000184471_100000730704 [0,0,0,0,0,2|2,0,0]=4 20549 B15R1.504 C=C(C)CCSCCOc1ccccc1 62a_100000730704_100000184471 [0,0,0,0,0,2|2,0,0]=4 20550 B15R1.504 C=C(C)CCSCCSc1ccccc1 62a_100000246102_100000730704 [0,0,0,0,0,2|2,0,0]=4 20551 B15R1.504 C=C(C)CCSCCSc1ccccc1 62a_100000730704_100000246102 [0,0,0,0,0,2|2,0,0]=4 20552 B15R1.504 C=C(C)CCSCOCc1ccccc1 62a_100000730704_100000763385 [0,0,0,0,0,2|2,0,0]=4 20553 B15R1.504 C=C(C)CCSCOCc1ccccc1 62a_100000763385_100000730704 [0,0,0,0,0,2|2,0,0]=4 20554 B15R1.504 C=C(C)CCSCSCc1ccccc1 62a_100000730704_200011217039 [0,0,0,0,0,2|2,0,0]=4 20555 B15R1.504 C=C(C)CCSCSCc1ccccc1 62a_200011217039_100000730704 [0,0,0,0,0,2|2,0,0]=4 20556 B15R1.504 C=C(C)CNCCCCc1ccccc1 2230a_100015280158_100000748629 [0,0,0,0,0,2|2,0,0]=4 20557 B15R1.504 C=C(C)CNCCCCc1ccccc1 34a_100015280158_100000748629 [0,0,0,0,0,2|2,0,0]=4 20558 B15R1.504 C=C(C)CNCCCOc1ccccc1 2230a_100000216521_100000748629 [0,0,0,0,0,2|2,0,0]=4 20559 B15R1.504 C=C(C)CNCCCOc1ccccc1 34a_100000216521_100000748629 [0,0,0,0,0,2|2,0,0]=4 20560 B15R1.504 C=C(C)CNCCCSc1ccccc1 2230a_100000184639_100000748629 [0,0,0,0,0,2|2,0,0]=4 20561 B15R1.504 C=C(C)CNCCOCc1ccccc1 2230a_100000753106_100000748629 [0,0,0,0,0,2|2,0,0]=4 20562 B15R1.504 C=C(C)CNCCOCc1ccccc1 34a_100000753106_100000748629 [0,0,0,0,0,2|2,0,0]=4 20563 B15R1.504 C=C(C)CNCCSCc1ccccc1 2230a_100000189534_100000748629 [0,0,0,0,0,2|2,0,0]=4 20564 B15R1.504 C=C(C)CNCCSCc1ccccc1 34a_100000189534_100000748629 [0,0,0,0,0,2|2,0,0]=4 20565 B15R1.504 C=C(C)CNCCSCc1ccccc1 7a_100000189534_100000748629 [0,0,0,0,0,2|2,0,0]=4 20566 B15R1.504 C=C(C)COCCCCc1ccccc1 34a_100000210245_100000701786 [0,0,0,0,0,2|2,0,0]=4 20567 B15R1.504 C=C(C)COCCCCc1ccccc1 34a_100000703073_100000748629 [0,0,0,0,0,2|2,0,0]=4 20568 B15R1.504 C=C(C)COCCCCc1ccccc1 7a_100000703073_100000748629 [0,0,0,0,0,2|2,0,0]=4 20569 B15R1.504 C=C(C)COCCCNc1ccccc1 34a_100000212590_100000748629 [0,0,0,0,0,2|2,0,0]=4 20570 B15R1.504 C=C(C)COCCCOc1ccccc1 34a_100000210245_100000199009 [0,0,0,0,0,2|2,0,0]=4 20571 B15R1.504 C=C(C)COCCCOc1ccccc1 34a_100011215863_100000748629 [0,0,0,0,0,2|2,0,0]=4 20572 B15R1.504 C=C(C)COCCCOc1ccccc1 7a_100011215863_100000748629 [0,0,0,0,0,2|2,0,0]=4 20573 B15R1.504 C=C(C)COCCCSc1ccccc1 34a_100000210245_200011203293 [0,0,0,0,0,2|2,0,0]=4 20574 B15R1.504 C=C(C)COCCNCc1ccccc1 34a_100000180844_100000748629 [0,0,0,0,0,2|2,0,0]=4 20575 B15R1.504 C=C(C)COCCOCc1ccccc1 34a_100000210245_100000234347 [0,0,0,0,0,2|2,0,0]=4 20576 B15R1.504 C=C(C)COCCOCc1ccccc1 34a_100000759325_100000748629 [0,0,0,0,0,2|2,0,0]=4 20577 B15R1.504 C=C(C)COCCOCc1ccccc1 7a_100000759325_100000748629 [0,0,0,0,0,2|2,0,0]=4 20578 B15R1.504 C=C(C)COCCSCc1ccccc1 34a_100000210245_200011297719 [0,0,0,0,0,2|2,0,0]=4 20579 B15R1.504 C=C(C)COCCSCc1ccccc1 34a_100011205989_100000748629 [0,0,0,0,0,2|2,0,0]=4 20580 B15R1.504 C=C(C)COCCSCc1ccccc1 7a_100011205989_100000748629 [0,0,0,0,0,2|2,0,0]=4 20581 B15R1.504 C=C(C)CSCCCCc1ccccc1 62a_100000701786_100000211660 [0,0,0,0,0,2|2,0,0]=4 20582 B15R1.504 C=C(C)CSCCCCc1ccccc1 62a_100000748629_100000701786 [0,0,0,0,0,2|2,0,0]=4 20583 B15R1.504 C=C(C)CSCCCOc1ccccc1 62a_100000199009_100000211660 [0,0,0,0,0,2|2,0,0]=4 20584 B15R1.504 C=C(C)CSCCCOc1ccccc1 62a_100000748629_100000199009 [0,0,0,0,0,2|2,0,0]=4 20585 B15R1.504 C=C(C)CSCCCSc1ccccc1 62a_100000748629_200011203293 [0,0,0,0,0,2|2,0,0]=4 20586 B15R1.504 C=C(C)CSCCCSc1ccccc1 62a_200011203293_100000211660 [0,0,0,0,0,2|2,0,0]=4 20587 B15R1.504 C=C(C)CSCCOCc1ccccc1 62a_100000234347_100000211660 [0,0,0,0,0,2|2,0,0]=4 20588 B15R1.504 C=C(C)CSCCOCc1ccccc1 62a_100000748629_100000234347 [0,0,0,0,0,2|2,0,0]=4 20589 B15R1.504 C=C(C)CSCCSCc1ccccc1 62a_100000748629_200011297719 [0,0,0,0,0,2|2,0,0]=4 20590 B15R1.504 C=C(C)CSCCSCc1ccccc1 62a_200011297719_100000211660 [0,0,0,0,0,2|2,0,0]=4 20591 B15R1.504 C=C(F)CNCCCCc1ccccc1 2230a_100015280158_100009893438 [0,0,0,0,0,2|2,0,0]=4 20592 B15R1.504 C=C(F)CNCCCCc1ccccc1 34a_100015280158_100009893438 [0,0,0,0,0,2|2,0,0]=4 20593 B15R1.504 C=C(F)CNCCCOc1ccccc1 2230a_100000216521_100009893438 [0,0,0,0,0,2|2,0,0]=4 20594 B15R1.504 C=C(F)CNCCCOc1ccccc1 34a_100000216521_100009893438 [0,0,0,0,0,2|2,0,0]=4 20595 B15R1.504 C=C(F)CNCCCSc1ccccc1 2230a_100000184639_100009893438 [0,0,0,0,0,2|2,0,0]=4 20596 B15R1.504 C=C(F)CNCCOCc1ccccc1 2230a_100000753106_100009893438 [0,0,0,0,0,2|2,0,0]=4 20597 B15R1.504 C=C(F)CNCCOCc1ccccc1 34a_100000753106_100009893438 [0,0,0,0,0,2|2,0,0]=4 20598 B15R1.504 C=C(F)CNCCSCc1ccccc1 2230a_100000189534_100009893438 [0,0,0,0,0,2|2,0,0]=4 20599 B15R1.504 C=C(F)CNCCSCc1ccccc1 34a_100000189534_100009893438 [0,0,0,0,0,2|2,0,0]=4 20600 B15R1.504 C=C(F)CNCCSCc1ccccc1 7a_100000189534_100000042424 [0,0,0,0,0,2|2,0,0]=4 20601 B15R1.504 C=C(F)COCCCCc1ccccc1 34a_100000703073_100009893438 [0,0,0,0,0,2|2,0,0]=4 20602 B15R1.504 C=C(F)COCCCCc1ccccc1 34a_200010262243_100000701786 [0,0,0,0,0,2|2,0,0]=4 20603 B15R1.504 C=C(F)COCCCCc1ccccc1 7a_100000703073_100000042424 [0,0,0,0,0,2|2,0,0]=4 20604 B15R1.504 C=C(F)COCCCNc1ccccc1 34a_100000212590_100009893438 [0,0,0,0,0,2|2,0,0]=4 20605 B15R1.504 C=C(F)COCCCOc1ccccc1 34a_100011215863_100009893438 [0,0,0,0,0,2|2,0,0]=4 20606 B15R1.504 C=C(F)COCCCOc1ccccc1 34a_200010262243_100000199009 [0,0,0,0,0,2|2,0,0]=4 20607 B15R1.504 C=C(F)COCCCOc1ccccc1 7a_100011215863_100000042424 [0,0,0,0,0,2|2,0,0]=4 20608 B15R1.504 C=C(F)COCCCSc1ccccc1 34a_200010262243_200011203293 [0,0,0,0,0,2|2,0,0]=4 20609 B15R1.504 C=C(F)COCCNCc1ccccc1 34a_100000180844_100009893438 [0,0,0,0,0,2|2,0,0]=4 20610 B15R1.504 C=C(F)COCCOCc1ccccc1 34a_100000759325_100009893438 [0,0,0,0,0,2|2,0,0]=4 20611 B15R1.504 C=C(F)COCCOCc1ccccc1 34a_200010262243_100000234347 [0,0,0,0,0,2|2,0,0]=4 20612 B15R1.504 C=C(F)COCCOCc1ccccc1 7a_100000759325_100000042424 [0,0,0,0,0,2|2,0,0]=4 20613 B15R1.504 C=C(F)COCCSCc1ccccc1 34a_100011205989_100009893438 [0,0,0,0,0,2|2,0,0]=4 20614 B15R1.504 C=C(F)COCCSCc1ccccc1 34a_200010262243_200011297719 [0,0,0,0,0,2|2,0,0]=4 20615 B15R1.504 C=C(F)COCCSCc1ccccc1 7a_100011205989_100000042424 [0,0,0,0,0,2|2,0,0]=4 20616 B15R1.504 C=C(F)CSCCCCc1ccccc1 62a_100000042424_100000701786 [0,0,0,0,0,2|2,0,0]=4 20617 B15R1.504 C=C(F)CSCCCCc1ccccc1 62a_100000701786_100000042424 [0,0,0,0,0,2|2,0,0]=4 20618 B15R1.504 C=C(F)CSCCCOc1ccccc1 62a_100000042424_100000199009 [0,0,0,0,0,2|2,0,0]=4 20619 B15R1.504 C=C(F)CSCCCOc1ccccc1 62a_100000199009_100000042424 [0,0,0,0,0,2|2,0,0]=4 20620 B15R1.504 C=C(F)CSCCCSc1ccccc1 62a_100000042424_200011203293 [0,0,0,0,0,2|2,0,0]=4 20621 B15R1.504 C=C(F)CSCCCSc1ccccc1 62a_200011203293_100000042424 [0,0,0,0,0,2|2,0,0]=4 20622 B15R1.504 C=C(F)CSCCOCc1ccccc1 62a_100000042424_100000234347 [0,0,0,0,0,2|2,0,0]=4 20623 B15R1.504 C=C(F)CSCCOCc1ccccc1 62a_100000234347_100000042424 [0,0,0,0,0,2|2,0,0]=4 20624 B15R1.504 C=C(F)CSCCSCc1ccccc1 62a_100000042424_200011297719 [0,0,0,0,0,2|2,0,0]=4 20625 B15R1.504 C=C(F)CSCCSCc1ccccc1 62a_200011297719_100000042424 [0,0,0,0,0,2|2,0,0]=4 20626 B15R1.504 CC(=CCCNCCc1ccccc1)C 2230a_100000106460_100011217483 [0,0,0,0,0,2|2,0,0]=4 20627 B15R1.504 CC(=CCCNCCc1ccccc1)C 34a_100000106460_100011217483 [0,0,0,0,0,2|2,0,0]=4 20628 B15R1.504 CC(=CCCOCCc1ccccc1)C 34a_100000210268_100011217483 [0,0,0,0,0,2|2,0,0]=4 20629 B15R1.504 CC(=CCCOCCc1ccccc1)C 7a_100000210268_100011217483 [0,0,0,0,0,2|2,0,0]=4 20630 B15R1.504 CC(=CCCSCCc1ccccc1)C 62a_100000765856_100011217483 [0,0,0,0,0,2|2,0,0]=4 20631 B15R1.504 CC(=CCCSCCc1ccccc1)C 62a_100011217483_100011218657 [0,0,0,0,0,2|2,0,0]=4 20632 B15R1.504 CC(=CCNCCCc1ccccc1)C 2230a_100000211184_100000761012 [0,0,0,0,0,2|2,0,0]=4 20633 B15R1.504 CC(=CCNCCCc1ccccc1)C 34a_100000211184_100000761012 [0,0,0,0,0,2|2,0,0]=4 20634 B15R1.504 CC(=CCNCCCc1ccccc1)C 34a_100000718196_100000211621 [0,0,0,0,0,2|2,0,0]=4 20635 B15R1.504 CC(=CCOCCCc1ccccc1)C 34a_100000210828_100000761012 [0,0,0,0,0,2|2,0,0]=4 20636 B15R1.504 CC(=CCOCCCc1ccccc1)C 34a_100000753907_100000211621 [0,0,0,0,0,2|2,0,0]=4 20637 B15R1.504 CC(=CCOCCCc1ccccc1)C 7a_100000210828_100000761012 [0,0,0,0,0,2|2,0,0]=4 20638 B15R1.504 CC(=CCSCCCc1ccccc1)C 62a_100000211621_100000761012 [0,0,0,0,0,2|2,0,0]=4 20639 B15R1.504 CC(=CCSCCCc1ccccc1)C 62a_100000761012_100000211621 [0,0,0,0,0,2|2,0,0]=4 20640 B15R1.504 CC(=O)CCCCCCc1ccccc1 1458a_100000036270_200000210301 [0,0,0,0,0,2|1,0,0]=3 20641 B15R1.504 CC(=O)CCCCCCc1ccccc1 1458a_100000070787_100011218729 [0,0,0,0,0,2|1,0,0]=3 20642 B15R1.504 CC(=O)CCCCCOc1ccccc1 1458a_100000070787_200011777167 [0,0,0,0,0,2|1,0,0]=3 20643 B15R1.504 CC(=O)CCCCNCc1ccccc1 34a_100015324214_100009817362 [0,0,0,0,0,2|1,0,0]=3 20644 B15R1.504 CC(=O)CCCCOCc1ccccc1 1458a_100000070787_100011219843 [0,0,0,0,0,2|1,0,0]=3 20645 B15R1.504 CC(=O)CCCCOCc1ccccc1 34a_100000210790_100009817362 [0,0,0,0,0,2|1,0,0]=3 20646 B15R1.504 CC(=O)CCCCOCc1ccccc1 7a_100000210790_100000735457 [0,0,0,0,0,2|1,0,0]=3 20647 B15R1.504 CC(=O)CCCCSCc1ccccc1 62a_100000211182_100000735457 [0,0,0,0,0,2|1,0,0]=3 20648 B15R1.504 CC(=O)CCCCSCc1ccccc1 62a_100000735457_100015291786 [0,0,0,0,0,2|1,0,0]=3 20649 B15R1.504 CC(=O)CCCCSCc1ccccn1 62a_100000721315_100000735457 [0,0,0,0,0,2|2,0,0]=4 20650 B15R1.504 CC(=O)CCCCSCc1ccccn1 62a_100000735457_100000721315 [0,0,0,0,0,2|2,0,0]=4 20651 B15R1.504 CC(=O)CCCCSCc1cccnc1 62a_100000735457_100000741622 [0,0,0,0,0,2|2,0,0]=4 20652 B15R1.504 CC(=O)CCCCSCc1cccnc1 62a_100000741622_100000735457 [0,0,0,0,0,2|2,0,0]=4 20653 B15R1.504 CC(=O)CCCCSCc1ccncc1 62a_100000735457_100015193705 [0,0,0,0,0,2|2,0,0]=4 20654 B15R1.504 CC(=O)CCCCSCc1ccncc1 62a_100015193705_100000735457 [0,0,0,0,0,2|2,0,0]=4 20655 B15R1.504 CC(=O)CCCCSSc1ccccn1 1458a_200010996202_200000210301 [0,0,0,0,0,2|2,0,0]=4 20656 B15R1.504 CC(=O)CCCNCCc1ccccc1 34a_100000106460_100000685027 [0,0,0,0,0,2|1,0,0]=3 20657 B15R1.504 CC(=O)CCCOCCc1ccccc1 34a_100000210268_100000685027 [0,0,0,0,0,2|1,0,0]=3 20658 B15R1.504 CC(=O)CCCOCCc1ccccc1 34a_100000759063_100000765856 [0,0,0,0,0,2|1,0,0]=3 20659 B15R1.504 CC(=O)CCCOCCc1ccccc1 7a_100000210268_100011215641 [0,0,0,0,0,2|1,0,0]=3 20660 B15R1.504 CC(=O)CCCOCCc1ccccc1 7a_100000759063_100000765856 [0,0,0,0,0,2|1,0,0]=3 20661 B15R1.504 CC(=O)CCCOCCc1ccccn1 34a_100000210271_100000685027 [0,0,0,0,0,2|2,0,0]=4 20662 B15R1.504 CC(=O)CCCOCCc1ccccn1 7a_100000759063_100015183660 [0,0,0,0,0,2|2,0,0]=4 20663 B15R1.504 CC(=O)CCCOCCc1cccnc1 34a_100011217484_100000685027 [0,0,0,0,0,2|2,0,0]=4 20664 B15R1.504 CC(=O)CCCOCCc1cccnc1 7a_100000759063_200011713674 [0,0,0,0,0,2|2,0,0]=4 20665 B15R1.504 CC(=O)CCCOCCc1ccncc1 34a_100011216225_100000685027 [0,0,0,0,0,2|2,0,0]=4 20666 B15R1.504 CC(=O)CCCOCCc1ccncc1 7a_100000759063_100000723409 [0,0,0,0,0,2|2,0,0]=4 20667 B15R1.504 CC(=O)CCCSCCc1ccccc1 62a_100000765856_100011215641 [0,0,0,0,0,2|1,0,0]=3 20668 B15R1.504 CC(=O)CCCSCCc1ccccc1 62a_100011215641_100011218657 [0,0,0,0,0,2|1,0,0]=3 20669 B15R1.504 CC(=O)CCCSCCc1ccccn1 62a_100011215641_100015183660 [0,0,0,0,0,2|2,0,0]=4 20670 B15R1.504 CC(=O)CCCSCCc1ccccn1 62a_100015183660_100011215641 [0,0,0,0,0,2|2,0,0]=4 20671 B15R1.504 CC(=O)CCCSCCc1cccnc1 62a_100011215641_200011713674 [0,0,0,0,0,2|2,0,0]=4 20672 B15R1.504 CC(=O)CCCSCCc1cccnc1 62a_200011713674_100011215641 [0,0,0,0,0,2|2,0,0]=4 20673 B15R1.504 CC(=O)CCCSCCc1ccncc1 62a_100000723409_100011215641 [0,0,0,0,0,2|2,0,0]=4 20674 B15R1.504 CC(=O)CCCSCCc1ccncc1 62a_100011215641_100000723409 [0,0,0,0,0,2|2,0,0]=4 20675 B15R1.504 CC(=O)CCCSCSc1ccccc1 62a_100011215641_100011218342 [0,0,0,0,0,2|1,0,0]=3 20676 B15R1.504 CC(=O)CCCSCSc1ccccc1 62a_100011218342_100011215641 [0,0,0,0,0,2|1,0,0]=3 20677 B15R1.504 CC(=O)CCOC/C=C/c1ccccc1 34a_100000759926_100016265936 [0,0,0,0,0,2|1,0,1]=4 20678 B15R1.504 CC(=O)CCOC/C=C/c1ccccc1 7a_100000759926_100016265936 [0,0,0,0,0,2|1,0,1]=4 20679 B15R1.504 CC(=O)CCOCC#Cc1ccccc1 34a_100000759926_100011352542 [0,0,0,0,0,2|1,0,1]=4 20680 B15R1.504 CC(=O)CCOCC#Cc1ccccc1 7a_100000759926_100011352542 [0,0,0,0,0,2|1,0,1]=4 20681 B15R1.504 CC(=O)CCOCC#Cc1ccccc1 7a_100011217464_100000053229 [0,0,0,0,0,2|1,0,1]=4 20682 B15R1.504 CC(=O)CCOCCCc1ccccc1 34a_100000759926_100000211621 [0,0,0,0,0,2|1,0,0]=3 20683 B15R1.504 CC(=O)CCOCCCc1ccccc1 7a_100000210828_100000053229 [0,0,0,0,0,2|1,0,0]=3 20684 B15R1.504 CC(=O)CCOCCCc1ccccc1 7a_100000759926_100000211621 [0,0,0,0,0,2|1,0,0]=3 20685 B15R1.504 CC(=O)CCOCCOc1ccccc1 34a_100000759926_100000184471 [0,0,0,0,0,2|1,0,0]=3 20686 B15R1.504 CC(=O)CCOCCOc1ccccc1 7a_100000210260_100000053229 [0,0,0,0,0,2|1,0,0]=3 20687 B15R1.504 CC(=O)CCOCCOc1ccccc1 7a_100000759926_100000184471 [0,0,0,0,0,2|1,0,0]=3 20688 B15R1.504 CC(=O)CCOCCSc1ccccc1 34a_100000759926_100000246102 [0,0,0,0,0,2|1,0,0]=3 20689 B15R1.504 CC(=O)CCOCCSc1ccccc1 7a_100000230494_100000053229 [0,0,0,0,0,2|1,0,0]=3 20690 B15R1.504 CC(=O)CCOCCSc1ccccc1 7a_100000759926_100000246102 [0,0,0,0,0,2|1,0,0]=3 20691 B15R1.504 CC(=O)CCOCCSc1ccccn1 7a_100000156319_100000053229 [0,0,0,0,0,2|2,0,0]=4 20692 B15R1.504 CC(=O)CCOCOCc1ccccc1 34a_100000759926_100000763385 [0,0,0,0,0,2|1,0,0]=3 20693 B15R1.504 CC(=O)CCOCSCc1ccccc1 34a_100000759926_200011217039 [0,0,0,0,0,2|1,0,0]=3 20694 B15R1.504 CC(=O)CCSC/C=C/c1ccccc1 62a_100000053229_100016265936 [0,0,0,0,0,2|1,0,1]=4 20695 B15R1.504 CC(=O)CCSC/C=C/c1ccccc1 62a_100016265936_100000053229 [0,0,0,0,0,2|1,0,1]=4 20696 B15R1.504 CC(=O)CCSCC#Cc1ccccc1 62a_100000053229_100011352542 [0,0,0,0,0,2|1,0,1]=4 20697 B15R1.504 CC(=O)CCSCCCc1ccccc1 62a_100000053229_100000211621 [0,0,0,0,0,2|1,0,0]=3 20698 B15R1.504 CC(=O)CCSCCCc1ccccc1 62a_100000211621_100000053229 [0,0,0,0,0,2|1,0,0]=3 20699 B15R1.504 CC(=O)CCSCCOc1ccccc1 62a_100000053229_100000184471 [0,0,0,0,0,2|1,0,0]=3 20700 B15R1.504 CC(=O)CCSCCOc1ccccc1 62a_100000184471_100000053229 [0,0,0,0,0,2|1,0,0]=3 20701 B15R1.504 CC(=O)CCSCCSc1ccccc1 62a_100000053229_100000246102 [0,0,0,0,0,2|1,0,0]=3 20702 B15R1.504 CC(=O)CCSCCSc1ccccc1 62a_100000246102_100000053229 [0,0,0,0,0,2|1,0,0]=3 20703 B15R1.504 CC(=O)CCSCOCc1ccccc1 62a_100000053229_100000763385 [0,0,0,0,0,2|1,0,0]=3 20704 B15R1.504 CC(=O)CCSCOCc1ccccc1 62a_100000763385_100000053229 [0,0,0,0,0,2|1,0,0]=3 20705 B15R1.504 CC(=O)CCSCSCc1ccccc1 62a_100000053229_200011217039 [0,0,0,0,0,2|1,0,0]=3 20706 B15R1.504 CC(=O)CCSCSCc1ccccc1 62a_200011217039_100000053229 [0,0,0,0,0,2|1,0,0]=3 20707 B15R1.504 CC(=O)COCCCCc1ccccc1 34a_100000211253_100000701786 [0,0,0,0,0,2|1,0,0]=3 20708 B15R1.504 CC(=O)COCCCOc1ccccc1 34a_100000211253_100000199009 [0,0,0,0,0,2|1,0,0]=3 20709 B15R1.504 CC(=O)COCCCSc1ccccc1 34a_100000211253_200011203293 [0,0,0,0,0,2|1,0,0]=3 20710 B15R1.504 CC(=O)COCCOCc1ccccc1 1458a_100012357824_200000210301 [0,0,0,0,0,2|1,0,0]=3 20711 B15R1.504 CC(=O)COCCOCc1ccccc1 34a_100000211253_100000234347 [0,0,0,0,0,2|1,0,0]=3 20712 B15R1.504 CC(=O)COCCSCc1ccccc1 34a_100000211253_200011297719 [0,0,0,0,0,2|1,0,0]=3 20713 B15R1.504 CC(=O)NCCCCCc1ccccc1 11a_100000750932_100015343762 [0,0,0,0,0,2|1,0,0]=3 20714 B15R1.504 CC(=O)NCCCCCc1ccccc1 1626a_100000750932_100015343762 [0,0,0,0,0,2|1,0,0]=3 20715 B15R1.504 CC(=O)NCCCCCc1ccccc1 240690a_100000750932_100015343762 [0,0,0,0,0,2|1,0,0]=3 20716 B15R1.504 CC(=O)NCCCCCc1ccccc1 527a_100000750932_100103153847 [0,0,0,0,0,2|1,0,0]=3 20717 B15R1.504 CC(=O)NCCCNCc1ccccc1 207a_100000736810_100015611070 [0,0,0,0,0,2|1,0,0]=3 20718 B15R1.504 CC(=O)NCCCNCc1ccccc1 270004a_100000736810_100015611070 [0,0,0,0,0,2|1,0,0]=3 20719 B15R1.504 CC(=O)NCCCNCc1ccccc1 34a_100000736810_100015291786 [0,0,0,0,0,2|1,0,0]=3 20720 B15R1.504 CC(=O)NCCCNCc1ccccn1 207a_100000736810_100000209966 [0,0,0,0,0,2|2,0,0]=4 20721 B15R1.504 CC(=O)NCCCNCc1ccccn1 270004a_100000736810_100000209966 [0,0,0,0,0,2|2,0,0]=4 20722 B15R1.504 CC(=O)NCCCNCc1ccccn1 34a_100000736810_100000721315 [0,0,0,0,0,2|2,0,0]=4 20723 B15R1.504 CC(=O)NCCCNCc1cccnc1 207a_100000736810_100000209961 [0,0,0,0,0,2|2,0,0]=4 20724 B15R1.504 CC(=O)NCCCNCc1cccnc1 270004a_100000736810_100000209961 [0,0,0,0,0,2|2,0,0]=4 20725 B15R1.504 CC(=O)NCCCNCc1cccnc1 34a_100000736810_100000733263 [0,0,0,0,0,2|2,0,0]=4 20726 B15R1.504 CC(=O)NCCCNCc1ccncc1 207a_100000736810_100000186114 [0,0,0,0,0,2|2,0,0]=4 20727 B15R1.504 CC(=O)NCCCOCc1ccccc1 11a_200000206031_100015343762 [0,0,0,0,0,2|1,0,0]=3 20728 B15R1.504 CC(=O)NCCCOCc1ccccc1 1626a_200000206031_100015343762 [0,0,0,0,0,2|1,0,0]=3 20729 B15R1.504 CC(=O)NCCCOCc1ccccc1 240690a_200000206031_100015343762 [0,0,0,0,0,2|1,0,0]=3 20730 B15R1.504 CC(=O)NCCCOCc1ccccc1 34a_100000752032_100015291786 [0,0,0,0,0,2|1,0,0]=3 20731 B15R1.504 CC(=O)NCCCOCc1ccccc1 527a_200000206031_100103153847 [0,0,0,0,0,2|1,0,0]=3 20732 B15R1.504 CC(=O)NCCCOCc1ccccn1 34a_100000752032_100000721315 [0,0,0,0,0,2|2,0,0]=4 20733 B15R1.504 CC(=O)NCCCOCc1cccnc1 34a_100000752032_100000733263 [0,0,0,0,0,2|2,0,0]=4 20734 B15R1.504 CC(=O)NCCNCCc1ccccc1 2230a_100000106460_100000189650 [0,0,0,0,0,2|1,0,0]=3 20735 B15R1.504 CC(=O)NCCNCCc1ccccc1 2230a_100000209853_100000765856 [0,0,0,0,0,2|1,0,0]=3 20736 B15R1.504 CC(=O)NCCNCCc1ccccn1 2230a_100000209853_100015183660 [0,0,0,0,0,2|2,0,0]=4 20737 B15R1.504 CC(=O)NCCNCCc1cccnc1 2230a_100000209853_200011713674 [0,0,0,0,0,2|2,0,0]=4 20738 B15R1.504 CC(=O)NCCNCCc1cccnc1 2230a_100000736294_100000189650 [0,0,0,0,0,2|2,0,0]=4 20739 B15R1.504 CC(=O)NCCNCCc1ccncc1 2230a_100000209853_100000723409 [0,0,0,0,0,2|2,0,0]=4 20740 B15R1.504 CC(=O)NCCNCSc1ccccc1 2230a_100000209853_100011218342 [0,0,0,0,0,2|2,0,0]=4 20741 B15R1.504 CC(=O)NCCOCCc1ccccc1 34a_100000158858_100000765856 [0,0,0,0,0,2|1,0,0]=3 20742 B15R1.504 CC(=O)NCCOCCc1ccccc1 7a_100000210268_100000189650 [0,0,0,0,0,2|1,0,0]=3 20743 B15R1.504 CC(=O)NCCSCCc1ccccc1 62a_100000189650_100011218657 [0,0,0,0,0,2|1,0,0]=3 20744 B15R1.504 CC(=O)NCCSCCc1ccccc1 62a_100000765856_100000189650 [0,0,0,0,0,2|1,0,0]=3 20745 B15R1.504 CC(=O)NCCSCCc1ccccn1 62a_100000189650_100015183660 [0,0,0,0,0,2|2,0,0]=4 20746 B15R1.504 CC(=O)NCCSCCc1ccccn1 62a_100015183660_100000189650 [0,0,0,0,0,2|2,0,0]=4 20747 B15R1.504 CC(=O)NCCSCCc1cccnc1 62a_100000189650_200011713674 [0,0,0,0,0,2|2,0,0]=4 20748 B15R1.504 CC(=O)NCCSCCc1cccnc1 62a_200011713674_100000189650 [0,0,0,0,0,2|2,0,0]=4 20749 B15R1.504 CC(=O)NCCSCCc1ccncc1 62a_100000189650_100000723409 [0,0,0,0,0,2|2,0,0]=4 20750 B15R1.504 CC(=O)NCCSCCc1ccncc1 62a_100000723409_100000189650 [0,0,0,0,0,2|2,0,0]=4 20751 B15R1.504 CC(=O)NCCSCSc1ccccc1 62a_100000189650_100011218342 [0,0,0,0,0,2|2,0,0]=4 20752 B15R1.504 CC(=O)NCCSCSc1ccccc1 62a_100011218342_100000189650 [0,0,0,0,0,2|2,0,0]=4 20753 B15R1.504 CC(=O)NN=CCCCc1ccccc1 4a_100000189765_100011361547 [0,0,0,0,0,2|1,0,1]=4 20754 B15R1.504 CC(=O)OCCCCNc1ccccc1 34a_100000106764_100000033659 [0,0,0,0,0,2|1,0,0]=3 20755 B15R1.504 CC(=O)OCCCCOc1ccccc1 34a_100000210340_100000033659 [0,0,0,0,0,2|1,0,0]=3 20756 B15R1.504 CC(=O)OCCCCOc1ccccc1 7a_100000210340_100000033659 [0,0,0,0,0,2|1,0,0]=3 20757 B15R1.504 CC(=O)OCCCCOc1cccnc1 34a_100000210849_100000033659 [0,0,0,0,0,2|2,0,0]=4 20758 B15R1.504 CC(=O)OCCCCOc1cccnc1 7a_100000210849_100000033659 [0,0,0,0,0,2|2,0,0]=4 20759 B15R1.504 CC(=O)OCCCCOc1ccncc1 34a_100000212176_100000033659 [0,0,0,0,0,2|2,0,0]=4 20760 B15R1.504 CC(=O)OCCCCSc1ccccc1 62a_100000033659_100000041952 [0,0,0,0,0,2|1,0,0]=3 20761 B15R1.504 CC(=O)OCCCCSc1ccccc1 62a_100000719477_100000033659 [0,0,0,0,0,2|1,0,0]=3 20762 B15R1.504 CC(=O)OCCCCSc1ccccn1 62a_100000033659_100011216584 [0,0,0,0,0,2|2,0,0]=4 20763 B15R1.504 CC(=O)OCCCCSc1ccccn1 62a_100011216584_100000033659 [0,0,0,0,0,2|2,0,0]=4 20764 B15R1.504 CC(=O)OCCCCSc1cccnc1 62a_100000033659_100000210063 [0,0,0,0,0,2|2,0,0]=4 20765 B15R1.504 CC(=O)OCCCCSc1cccnc1 62a_100000210063_100000033659 [0,0,0,0,0,2|2,0,0]=4 20766 B15R1.504 CC(=O)OCCCCSc1ccncc1 62a_100000033659_100000728582 [0,0,0,0,0,2|2,0,0]=4 20767 B15R1.504 CC(=O)OCCCCSc1ccncc1 62a_100000728582_100000033659 [0,0,0,0,0,2|2,0,0]=4 20768 B15R1.504 CC(=O)OCCCNCc1ccccc1 34a_100015324214_100000042594 [0,0,0,0,0,2|1,0,0]=3 20769 B15R1.504 CC(=O)OCCCOCc1ccccc1 34a_100000210790_100000042594 [0,0,0,0,0,2|1,0,0]=3 20770 B15R1.504 CC(=O)OCCCOCc1ccccc1 7a_100000210790_100000042594 [0,0,0,0,0,2|1,0,0]=3 20771 B15R1.504 CC(=O)OCCCSCc1ccccc1 62a_100000042594_100015291786 [0,0,0,0,0,2|1,0,0]=3 20772 B15R1.504 CC(=O)OCCCSCc1ccccc1 62a_100000211182_100000042594 [0,0,0,0,0,2|1,0,0]=3 20773 B15R1.504 CC(=O)OCCCSCc1ccccn1 62a_100000042594_100000721315 [0,0,0,0,0,2|2,0,0]=4 20774 B15R1.504 CC(=O)OCCCSCc1ccccn1 62a_100000721315_100000042594 [0,0,0,0,0,2|2,0,0]=4 20775 B15R1.504 CC(=O)OCCCSCc1cccnc1 62a_100000042594_100000741622 [0,0,0,0,0,2|2,0,0]=4 20776 B15R1.504 CC(=O)OCCCSCc1cccnc1 62a_100000741622_100000042594 [0,0,0,0,0,2|2,0,0]=4 20777 B15R1.504 CC(=O)OCCCSCc1ccncc1 62a_100000042594_100015193705 [0,0,0,0,0,2|2,0,0]=4 20778 B15R1.504 CC(=O)OCCCSCc1ccncc1 62a_100015193705_100000042594 [0,0,0,0,0,2|2,0,0]=4 20779 B15R1.504 CC(=O)OCCNCCc1ccccc1 34a_100000106460_100009814007 [0,0,0,0,0,2|1,0,0]=3 20780 B15R1.504 CC(=O)OCCOCCc1ccccc1 34a_100000210268_100009814007 [0,0,0,0,0,2|1,0,0]=3 20781 B15R1.504 CC(=O)OCCOCCc1ccccc1 7a_100000210268_100009814007 [0,0,0,0,0,2|1,0,0]=3 20782 B15R1.504 CC(=O)OCCOCCc1ccccn1 34a_100000210271_100009814007 [0,0,0,0,0,2|2,0,0]=4 20783 B15R1.504 CC(=O)OCCOCCc1cccnc1 34a_100011217484_100009814007 [0,0,0,0,0,2|2,0,0]=4 20784 B15R1.504 CC(=O)OCCOCCc1ccncc1 34a_100011216225_100009814007 [0,0,0,0,0,2|2,0,0]=4 20785 B15R1.504 CC(=O)OCCOCNc1ccccc1 34a_100000106764_100000076355 [0,0,0,0,0,2|2,0,0]=4 20786 B15R1.504 CC(=O)OCCOCOc1ccccc1 34a_100000210340_100000076355 [0,0,0,0,0,2|2,0,0]=4 20787 B15R1.504 CC(=O)OCCOCSc1ccccc1 62a_100000076355_100000041952 [0,0,0,0,0,2|2,0,0]=4 20788 B15R1.504 CC(=O)OCCOCSc1ccccc1 62a_100000719477_100000076355 [0,0,0,0,0,2|2,0,0]=4 20789 B15R1.504 CC(=O)OCCSCCc1ccccc1 62a_100000765856_100009814007 [0,0,0,0,0,2|1,0,0]=3 20790 B15R1.504 CC(=O)OCCSCCc1ccccc1 62a_100009814007_100011218657 [0,0,0,0,0,2|1,0,0]=3 20791 B15R1.504 CC(=O)OCCSCCc1ccccn1 62a_100009814007_100015183660 [0,0,0,0,0,2|2,0,0]=4 20792 B15R1.504 CC(=O)OCCSCCc1ccccn1 62a_100015183660_100009814007 [0,0,0,0,0,2|2,0,0]=4 20793 B15R1.504 CC(=O)OCCSCCc1cccnc1 62a_100009814007_200011713674 [0,0,0,0,0,2|2,0,0]=4 20794 B15R1.504 CC(=O)OCCSCCc1cccnc1 62a_200011713674_100009814007 [0,0,0,0,0,2|2,0,0]=4 20795 B15R1.504 CC(=O)OCCSCCc1ccncc1 62a_100000723409_100009814007 [0,0,0,0,0,2|2,0,0]=4 20796 B15R1.504 CC(=O)OCCSCCc1ccncc1 62a_100009814007_100000723409 [0,0,0,0,0,2|2,0,0]=4 20797 B15R1.504 CC(=O)OCCSCSc1ccccc1 62a_100009814007_100011218342 [0,0,0,0,0,2|2,0,0]=4 20798 B15R1.504 CC(=O)OCCSCSc1ccccc1 62a_100011218342_100009814007 [0,0,0,0,0,2|2,0,0]=4 20799 B15R1.504 CC(=O)OCNCCCc1ccccc1 34a_100000211184_100009813279 [0,0,0,0,0,2|1,0,0]=3 20800 B15R1.504 CC(=O)OCNCCCc1cccnc1 34a_100011532358_100009813279 [0,0,0,0,0,2|2,0,0]=4 20801 B15R1.504 CC(=O)OCNCCOc1ccccc1 34a_100000174943_100009813279 [0,0,0,0,0,2|2,0,0]=4 20802 B15R1.504 CC(=O)OCOCCCc1ccccc1 34a_100000210828_100009813279 [0,0,0,0,0,2|1,0,0]=3 20803 B15R1.504 CC(=O)OCOCCCc1ccccn1 34a_100011215068_100009813279 [0,0,0,0,0,2|2,0,0]=4 20804 B15R1.504 CC(=O)OCOCCCc1cccnc1 34a_100000211284_100009813279 [0,0,0,0,0,2|2,0,0]=4 20805 B15R1.504 CC(=O)OCOCCCc1ccncc1 34a_100000210659_100009813279 [0,0,0,0,0,2|2,0,0]=4 20806 B15R1.504 CC(=O)OCOCCNc1ccccc1 34a_100000211345_100009813279 [0,0,0,0,0,2|2,0,0]=4 20807 B15R1.504 CC(=O)OCOCCOc1ccccc1 34a_100000210260_100009813279 [0,0,0,0,0,2|2,0,0]=4 20808 B15R1.504 CC(=O)OCSCCCc1ccccc1 62a_100000076356_100000211621 [0,0,0,0,0,2|1,0,0]=3 20809 B15R1.504 CC(=O)OCSCCCc1ccccc1 62a_100000211621_100000076356 [0,0,0,0,0,2|1,0,0]=3 20810 B15R1.504 CC(=O)OCSCCOc1ccccc1 62a_100000076356_100000184471 [0,0,0,0,0,2|2,0,0]=4 20811 B15R1.504 CC(=O)OCSCCOc1ccccc1 62a_100000184471_100000076356 [0,0,0,0,0,2|2,0,0]=4 20812 B15R1.504 CC(=O)OCSCCSc1ccccc1 62a_100000076356_100000246102 [0,0,0,0,0,2|2,0,0]=4 20813 B15R1.504 CC(=O)OCSCCSc1ccccc1 62a_100000246102_100000076356 [0,0,0,0,0,2|2,0,0]=4 20814 B15R1.504 CC(=O)OCSCOCc1ccccc1 62a_100000076356_100000763385 [0,0,0,0,0,2|2,0,0]=4 20815 B15R1.504 CC(=O)OCSCOCc1ccccc1 62a_100000763385_100000076356 [0,0,0,0,0,2|2,0,0]=4 20816 B15R1.504 CC(=O)OCSCSCc1ccccc1 62a_100000076356_200011217039 [0,0,0,0,0,2|2,0,0]=4 20817 B15R1.504 CC(=O)OCSCSCc1ccccc1 62a_200011217039_100000076356 [0,0,0,0,0,2|2,0,0]=4 20818 B15R1.504 CC(=O)SCCCCNc1ccccc1 34a_100000106764_200010402107 [0,0,0,0,0,2|1,0,0]=3 20819 B15R1.504 CC(=O)SCCCCOc1ccccc1 34a_100000210340_200010402107 [0,0,0,0,0,2|1,0,0]=3 20820 B15R1.504 CC(=O)SCCCCOc1ccccc1 7a_100000210340_200010402107 [0,0,0,0,0,2|1,0,0]=3 20821 B15R1.504 CC(=O)SCCCCOc1cccnc1 34a_100000210849_200010402107 [0,0,0,0,0,2|2,0,0]=4 20822 B15R1.504 CC(=O)SCCCCOc1cccnc1 7a_100000210849_200010402107 [0,0,0,0,0,2|2,0,0]=4 20823 B15R1.504 CC(=O)SCCCCOc1ccncc1 34a_100000212176_200010402107 [0,0,0,0,0,2|2,0,0]=4 20824 B15R1.504 CC(=O)SCCCCSc1ccccc1 62a_100000719477_200010402107 [0,0,0,0,0,2|1,0,0]=3 20825 B15R1.504 CC(=O)SCCCCSc1ccccc1 62a_200010402107_100000041952 [0,0,0,0,0,2|1,0,0]=3 20826 B15R1.504 CC(=O)SCCCCSc1ccccn1 62a_100011216584_200010402107 [0,0,0,0,0,2|2,0,0]=4 20827 B15R1.504 CC(=O)SCCCCSc1ccccn1 62a_200010402107_100011216584 [0,0,0,0,0,2|2,0,0]=4 20828 B15R1.504 CC(=O)SCCCCSc1cccnc1 62a_100000210063_200010402107 [0,0,0,0,0,2|2,0,0]=4 20829 B15R1.504 CC(=O)SCCCCSc1cccnc1 62a_200010402107_100000210063 [0,0,0,0,0,2|2,0,0]=4 20830 B15R1.504 CC(=O)SCCCCSc1ccncc1 62a_100000728582_200010402107 [0,0,0,0,0,2|2,0,0]=4 20831 B15R1.504 CC(=O)SCCCCSc1ccncc1 62a_200010402107_100000728582 [0,0,0,0,0,2|2,0,0]=4 20832 B15R1.504 CC(=O)SCCCNCc1ccccc1 2230a_100015324214_100000038929 [0,0,0,0,0,2|1,0,0]=3 20833 B15R1.504 CC(=O)SCCCNCc1ccccc1 34a_100015324214_100000038929 [0,0,0,0,0,2|1,0,0]=3 20834 B15R1.504 CC(=O)SCCCOCc1ccccc1 34a_100000210790_100000038929 [0,0,0,0,0,2|1,0,0]=3 20835 B15R1.504 CC(=O)SCCCOCc1ccccc1 7a_100000210790_100000038929 [0,0,0,0,0,2|1,0,0]=3 20836 B15R1.504 CC(=O)SCCCSCc1ccccc1 62a_100000038929_100015291786 [0,0,0,0,0,2|1,0,0]=3 20837 B15R1.504 CC(=O)SCCCSCc1ccccc1 62a_100000211182_100000038929 [0,0,0,0,0,2|1,0,0]=3 20838 B15R1.504 CC(=O)SCCCSCc1ccccn1 62a_100000038929_100000721315 [0,0,0,0,0,2|2,0,0]=4 20839 B15R1.504 CC(=O)SCCCSCc1ccccn1 62a_100000721315_100000038929 [0,0,0,0,0,2|2,0,0]=4 20840 B15R1.504 CC(=O)SCCCSCc1cccnc1 62a_100000038929_100000741622 [0,0,0,0,0,2|2,0,0]=4 20841 B15R1.504 CC(=O)SCCCSCc1cccnc1 62a_100000741622_100000038929 [0,0,0,0,0,2|2,0,0]=4 20842 B15R1.504 CC(=O)SCCCSCc1ccncc1 62a_100000038929_100015193705 [0,0,0,0,0,2|2,0,0]=4 20843 B15R1.504 CC(=O)SCCCSCc1ccncc1 62a_100015193705_100000038929 [0,0,0,0,0,2|2,0,0]=4 20844 B15R1.504 CC(=S)OCCCNCc1ccccc1 2230a_100015324214_200135323944 [0,0,0,0,0,2|1,1,0]=4 20845 B15R1.504 CC(=S)OCCCNCc1ccccc1 34a_100015324214_200135323944 [0,0,0,0,0,2|1,1,0]=4 20846 B15R1.504 CC(=S)OCCCOCc1ccccc1 34a_100000210790_200135323944 [0,0,0,0,0,2|1,1,0]=4 20847 B15R1.504 CC(=S)OCCCOCc1ccccc1 7a_100000210790_200135323944 [0,0,0,0,0,2|1,1,0]=4 20848 B15R1.504 CC(=S)OCCCSCc1ccccc1 62a_100000211182_200135323944 [0,0,0,0,0,2|1,1,0]=4 20849 B15R1.504 CC(=S)OCCCSCc1ccccc1 62a_200135323944_100015291786 [0,0,0,0,0,2|1,1,0]=4 20850 B15R1.504 CC(O)CCCNCCc1ccccc1 2230a_100000106460_200000718107 [0,0,0,0,0,2|1,0,1]=4 20851 B15R1.504 CC(O)CCCNCCc1ccccc1 34a_100000106460_200000718107 [0,0,0,0,0,2|1,0,1]=4 20852 B15R1.504 CC(O)CCCOCCc1ccccc1 34a_100000210268_200000718107 [0,0,0,0,0,2|1,0,1]=4 20853 B15R1.504 CC(O)CCCOCCc1ccccc1 7a_100000210268_200000718107 [0,0,0,0,0,2|1,0,1]=4 20854 B15R1.504 CC(O)CCCSCCc1ccccc1 62a_100000765856_200000718107 [0,0,0,0,0,2|1,0,1]=4 20855 B15R1.504 CC(O)CCCSCCc1ccccc1 62a_200000718107_100011218657 [0,0,0,0,0,2|1,0,1]=4 20856 B15R1.504 CC(O)CCCSCSc1ccccc1 62a_100011218342_200000718107 [0,0,0,0,0,2|1,0,1]=4 20857 B15R1.504 CC(O)CCCSCSc1ccccc1 62a_200000718107_100011218342 [0,0,0,0,0,2|1,0,1]=4 20858 B15R1.504 CC(O)CCNCCCc1ccccc1 2230a_100000211184_100012276601 [0,0,0,0,0,2|1,0,1]=4 20859 B15R1.504 CC(O)CCNCCCc1ccccc1 2230a_200000755665_100000211621 [0,0,0,0,0,2|1,0,1]=4 20860 B15R1.504 CC(O)CCNCCCc1ccccc1 34a_100000211184_100012276601 [0,0,0,0,0,2|1,0,1]=4 20861 B15R1.504 CC(O)CCNCCOc1ccccc1 2230a_100000174943_100012276601 [0,0,0,0,0,2|1,0,1]=4 20862 B15R1.504 CC(O)CCNCCOc1ccccc1 2230a_200000755665_100000184471 [0,0,0,0,0,2|1,0,1]=4 20863 B15R1.504 CC(O)CCNCCOc1ccccc1 270004a_200000755665_100000758736 [0,0,0,0,0,2|1,0,1]=4 20864 B15R1.504 CC(O)CCNCCOc1ccccc1 34a_100000174943_100012276601 [0,0,0,0,0,2|1,0,1]=4 20865 B15R1.504 CC(O)CCNCCSc1ccccc1 2230a_100000189519_100012276601 [0,0,0,0,0,2|1,0,1]=4 20866 B15R1.504 CC(O)CCNCCSc1ccccc1 2230a_200000755665_100000246102 [0,0,0,0,0,2|1,0,1]=4 20867 B15R1.504 CC(O)CCNCOCc1ccccc1 2230a_200000755665_100000763385 [0,0,0,0,0,2|1,0,1]=4 20868 B15R1.504 CC(O)CCNCSCc1ccccc1 2230a_200000755665_200011217039 [0,0,0,0,0,2|1,0,1]=4 20869 B15R1.504 CC(O)CCOCCCc1ccccc1 34a_100000210828_100012276601 [0,0,0,0,0,2|1,0,1]=4 20870 B15R1.504 CC(O)CCOCCCc1ccccc1 7a_100000210828_100012276601 [0,0,0,0,0,2|1,0,1]=4 20871 B15R1.504 CC(O)CCOCCNc1ccccc1 34a_100000211345_100012276601 [0,0,0,0,0,2|1,0,1]=4 20872 B15R1.504 CC(O)CCOCCOc1ccccc1 34a_100000210260_100012276601 [0,0,0,0,0,2|1,0,1]=4 20873 B15R1.504 CC(O)CCOCCOc1ccccc1 7a_100000210260_100012276601 [0,0,0,0,0,2|1,0,1]=4 20874 B15R1.504 CC(O)CCOCCSc1ccccc1 7a_100000230494_100012276601 [0,0,0,0,0,2|1,0,1]=4 20875 B15R1.504 CC(O)CCSCCCc1ccccc1 62a_100000211621_100012276601 [0,0,0,0,0,2|1,0,1]=4 20876 B15R1.504 CC(O)CCSCCCc1ccccc1 62a_100012276601_100000211621 [0,0,0,0,0,2|1,0,1]=4 20877 B15R1.504 CC(O)CCSCCOc1ccccc1 62a_100000184471_100012276601 [0,0,0,0,0,2|1,0,1]=4 20878 B15R1.504 CC(O)CCSCCOc1ccccc1 62a_100012276601_100000184471 [0,0,0,0,0,2|1,0,1]=4 20879 B15R1.504 CC(O)CCSCCSc1ccccc1 62a_100000246102_100012276601 [0,0,0,0,0,2|1,0,1]=4 20880 B15R1.504 CC(O)CCSCCSc1ccccc1 62a_100012276601_100000246102 [0,0,0,0,0,2|1,0,1]=4 20881 B15R1.504 CC(O)CCSCOCc1ccccc1 62a_100000763385_100012276601 [0,0,0,0,0,2|1,0,1]=4 20882 B15R1.504 CC(O)CCSCOCc1ccccc1 62a_100012276601_100000763385 [0,0,0,0,0,2|1,0,1]=4 20883 B15R1.504 CC(O)CCSCSCc1ccccc1 62a_100012276601_200011217039 [0,0,0,0,0,2|1,0,1]=4 20884 B15R1.504 CC(O)CCSCSCc1ccccc1 62a_200011217039_100012276601 [0,0,0,0,0,2|1,0,1]=4 20885 B15R1.504 CC(O)CNCCCCc1ccccc1 2230a_100000210904_100000701786 [0,0,0,0,0,2|1,0,1]=4 20886 B15R1.504 CC(O)CNCCCCc1ccccc1 2230a_100015280158_100011218427 [0,0,0,0,0,2|1,0,1]=4 20887 B15R1.504 CC(O)CNCCCCc1ccccc1 34a_100000210904_100000701786 [0,0,0,0,0,2|1,0,1]=4 20888 B15R1.504 CC(O)CNCCCCc1ccccc1 34a_100015280158_100011218427 [0,0,0,0,0,2|1,0,1]=4 20889 B15R1.504 CC(O)CNCCCOc1ccccc1 2230a_100000210904_100000199009 [0,0,0,0,0,2|1,0,1]=4 20890 B15R1.504 CC(O)CNCCCOc1ccccc1 2230a_100000216521_100011218427 [0,0,0,0,0,2|1,0,1]=4 20891 B15R1.504 CC(O)CNCCCOc1ccccc1 34a_100000210904_100000199009 [0,0,0,0,0,2|1,0,1]=4 20892 B15R1.504 CC(O)CNCCCOc1ccccc1 34a_100000216521_100011218427 [0,0,0,0,0,2|1,0,1]=4 20893 B15R1.504 CC(O)CNCCCSc1ccccc1 2230a_100000184639_100011218427 [0,0,0,0,0,2|1,0,1]=4 20894 B15R1.504 CC(O)CNCCCSc1ccccc1 2230a_100000210904_200011203293 [0,0,0,0,0,2|1,0,1]=4 20895 B15R1.504 CC(O)CNCCCSc1ccccc1 34a_100000210904_200011203293 [0,0,0,0,0,2|1,0,1]=4 20896 B15R1.504 CC(O)CNCCOCc1ccccc1 2230a_100000210904_100000234347 [0,0,0,0,0,2|1,0,1]=4 20897 B15R1.504 CC(O)CNCCOCc1ccccc1 2230a_100000753106_100011218427 [0,0,0,0,0,2|1,0,1]=4 20898 B15R1.504 CC(O)CNCCOCc1ccccc1 34a_100000210904_100000234347 [0,0,0,0,0,2|1,0,1]=4 20899 B15R1.504 CC(O)CNCCOCc1ccccc1 34a_100000753106_100011218427 [0,0,0,0,0,2|1,0,1]=4 20900 B15R1.504 CC(O)CNCCSCc1ccccc1 2230a_100000189534_100011218427 [0,0,0,0,0,2|1,0,1]=4 20901 B15R1.504 CC(O)CNCCSCc1ccccc1 2230a_100000210904_200011297719 [0,0,0,0,0,2|1,0,1]=4 20902 B15R1.504 CC(O)CNCCSCc1ccccc1 34a_100000189534_100011218427 [0,0,0,0,0,2|1,0,1]=4 20903 B15R1.504 CC(O)CNCCSCc1ccccc1 34a_100000210904_200011297719 [0,0,0,0,0,2|1,0,1]=4 20904 B15R1.504 CC(O)CNCCSCc1ccccc1 7a_100000189534_100011218427 [0,0,0,0,0,2|1,0,1]=4 20905 B15R1.504 CC(O)COCCCCc1ccccc1 34a_100000703073_100011218427 [0,0,0,0,0,2|1,0,1]=4 20906 B15R1.504 CC(O)COCCCCc1ccccc1 7a_100000703073_100011218427 [0,0,0,0,0,2|1,0,1]=4 20907 B15R1.504 CC(O)COCCCNc1ccccc1 34a_100000212590_100011218427 [0,0,0,0,0,2|1,0,1]=4 20908 B15R1.504 CC(O)COCCCOc1ccccc1 34a_100011215863_100011218427 [0,0,0,0,0,2|1,0,1]=4 20909 B15R1.504 CC(O)COCCCOc1ccccc1 7a_100011215863_100011218427 [0,0,0,0,0,2|1,0,1]=4 20910 B15R1.504 CC(O)COCCNCc1ccccc1 34a_100000180844_100011218427 [0,0,0,0,0,2|1,0,1]=4 20911 B15R1.504 CC(O)COCCOCc1ccccc1 34a_100000759325_100011218427 [0,0,0,0,0,2|1,0,1]=4 20912 B15R1.504 CC(O)COCCOCc1ccccc1 7a_100000759325_100011218427 [0,0,0,0,0,2|1,0,1]=4 20913 B15R1.504 CC(O)COCCSCc1ccccc1 34a_100011205989_100011218427 [0,0,0,0,0,2|1,0,1]=4 20914 B15R1.504 CC(O)COCCSCc1ccccc1 7a_100011205989_100011218427 [0,0,0,0,0,2|1,0,1]=4 20915 B15R1.504 CC(O)CSCCCCc1ccccc1 62a_100000701786_100011218427 [0,0,0,0,0,2|1,0,1]=4 20916 B15R1.504 CC(O)CSCCCCc1ccccc1 62a_100011218427_100000701786 [0,0,0,0,0,2|1,0,1]=4 20917 B15R1.504 CC(O)CSCCCOc1ccccc1 62a_100000199009_100011218427 [0,0,0,0,0,2|1,0,1]=4 20918 B15R1.504 CC(O)CSCCCOc1ccccc1 62a_100011218427_100000199009 [0,0,0,0,0,2|1,0,1]=4 20919 B15R1.504 CC(O)CSCCCSc1ccccc1 62a_100011218427_200011203293 [0,0,0,0,0,2|1,0,1]=4 20920 B15R1.504 CC(O)CSCCCSc1ccccc1 62a_200011203293_100011218427 [0,0,0,0,0,2|1,0,1]=4 20921 B15R1.504 CC(O)CSCCOCc1ccccc1 62a_100000234347_100011218427 [0,0,0,0,0,2|1,0,1]=4 20922 B15R1.504 CC(O)CSCCOCc1ccccc1 62a_100011218427_100000234347 [0,0,0,0,0,2|1,0,1]=4 20923 B15R1.504 CC(O)CSCCSCc1ccccc1 62a_100011218427_200011297719 [0,0,0,0,0,2|1,0,1]=4 20924 B15R1.504 CC(O)CSCCSCc1ccccc1 62a_200011297719_100011218427 [0,0,0,0,0,2|1,0,1]=4 20925 B15R1.504 CS(=O)CCCNCCc1ccccc1 2230a_200000753449_100000765856 [0,0,0,0,0,2|2,0,0]=4 20926 B15R1.504 CS(=O)CCCNCSc1ccccc1 2230a_200000753449_100011218342 [0,0,0,0,0,2|2,0,0]=4 20927 B15R1.504 C[C@@H](O)CNCCCCc1ccccc1 2230a_100015280158_100009817552 [0,0,0,0,0,2|1,0,1]=4 20928 B15R1.504 C[C@@H](O)CNCCCCc1ccccc1 34a_100015280158_100009817552 [0,0,0,0,0,2|1,0,1]=4 20929 B15R1.504 C[C@@H](O)CNCCCOc1ccccc1 2230a_100000216521_100009817552 [0,0,0,0,0,2|1,0,1]=4 20930 B15R1.504 C[C@@H](O)CNCCCOc1ccccc1 34a_100000216521_100009817552 [0,0,0,0,0,2|1,0,1]=4 20931 B15R1.504 C[C@@H](O)CNCCCSc1ccccc1 2230a_100000184639_100009817552 [0,0,0,0,0,2|1,0,1]=4 20932 B15R1.504 C[C@@H](O)CNCCOCc1ccccc1 2230a_100000753106_100009817552 [0,0,0,0,0,2|1,0,1]=4 20933 B15R1.504 C[C@@H](O)CNCCOCc1ccccc1 34a_100000753106_100009817552 [0,0,0,0,0,2|1,0,1]=4 20934 B15R1.504 C[C@@H](O)CNCCSCc1ccccc1 2230a_100000189534_100009817552 [0,0,0,0,0,2|1,0,1]=4 20935 B15R1.504 C[C@@H](O)CNCCSCc1ccccc1 34a_100000189534_100009817552 [0,0,0,0,0,2|1,0,1]=4 20936 B15R1.504 C[C@@H](O)CNCCSCc1ccccc1 7a_100000189534_100009817552 [0,0,0,0,0,2|1,0,1]=4 20937 B15R1.504 C[C@@H](O)COCCCCc1ccccc1 34a_100000703073_100009817552 [0,0,0,0,0,2|1,0,1]=4 20938 B15R1.504 C[C@@H](O)COCCCCc1ccccc1 7a_100000703073_100009817552 [0,0,0,0,0,2|1,0,1]=4 20939 B15R1.504 C[C@@H](O)COCCCNc1ccccc1 34a_100000212590_100009817552 [0,0,0,0,0,2|1,0,1]=4 20940 B15R1.504 C[C@@H](O)COCCCOc1ccccc1 34a_100011215863_100009817552 [0,0,0,0,0,2|1,0,1]=4 20941 B15R1.504 C[C@@H](O)COCCCOc1ccccc1 7a_100011215863_100009817552 [0,0,0,0,0,2|1,0,1]=4 20942 B15R1.504 C[C@@H](O)COCCNCc1ccccc1 34a_100000180844_100009817552 [0,0,0,0,0,2|1,0,1]=4 20943 B15R1.504 C[C@@H](O)COCCOCc1ccccc1 34a_100000759325_100009817552 [0,0,0,0,0,2|1,0,1]=4 20944 B15R1.504 C[C@@H](O)COCCOCc1ccccc1 7a_100000759325_100009817552 [0,0,0,0,0,2|1,0,1]=4 20945 B15R1.504 C[C@@H](O)COCCSCc1ccccc1 34a_100011205989_100009817552 [0,0,0,0,0,2|1,0,1]=4 20946 B15R1.504 C[C@@H](O)COCCSCc1ccccc1 7a_100011205989_100009817552 [0,0,0,0,0,2|1,0,1]=4 20947 B15R1.504 C[C@@H](O)CSCCCCc1ccccc1 62a_100000701786_100009817552 [0,0,0,0,0,2|1,0,1]=4 20948 B15R1.504 C[C@@H](O)CSCCCCc1ccccc1 62a_100009817552_100000701786 [0,0,0,0,0,2|1,0,1]=4 20949 B15R1.504 C[C@@H](O)CSCCCOc1ccccc1 62a_100000199009_100009817552 [0,0,0,0,0,2|1,0,1]=4 20950 B15R1.504 C[C@@H](O)CSCCCOc1ccccc1 62a_100009817552_100000199009 [0,0,0,0,0,2|1,0,1]=4 20951 B15R1.504 C[C@@H](O)CSCCCSc1ccccc1 62a_100009817552_200011203293 [0,0,0,0,0,2|1,0,1]=4 20952 B15R1.504 C[C@@H](O)CSCCCSc1ccccc1 62a_200011203293_100009817552 [0,0,0,0,0,2|1,0,1]=4 20953 B15R1.504 C[C@@H](O)CSCCOCc1ccccc1 62a_100000234347_100009817552 [0,0,0,0,0,2|1,0,1]=4 20954 B15R1.504 C[C@@H](O)CSCCOCc1ccccc1 62a_100009817552_100000234347 [0,0,0,0,0,2|1,0,1]=4 20955 B15R1.504 C[C@@H](O)CSCCSCc1ccccc1 62a_100009817552_200011297719 [0,0,0,0,0,2|1,0,1]=4 20956 B15R1.504 C[C@@H](O)CSCCSCc1ccccc1 62a_200011297719_100009817552 [0,0,0,0,0,2|1,0,1]=4 20957 B15R1.504 FC(=CCCNCCc1ccccc1)F 2230a_100000106460_200009816681 [0,0,0,0,0,2|2,0,0]=4 20958 B15R1.504 FC(=CCCNCCc1ccccc1)F 34a_100000106460_200009816681 [0,0,0,0,0,2|2,0,0]=4 20959 B15R1.504 FC(=CCCOCCc1ccccc1)F 34a_100000210268_200009816681 [0,0,0,0,0,2|2,0,0]=4 20960 B15R1.504 FC(=CCCOCCc1ccccc1)F 7a_100000210268_200009816681 [0,0,0,0,0,2|2,0,0]=4 20961 B15R1.504 FC(=CCCSCCc1ccccc1)F 62a_100000765856_200009816681 [0,0,0,0,0,2|2,0,0]=4 20962 B15R1.504 FC(=CCCSCCc1ccccc1)F 62a_200009816681_100011218657 [0,0,0,0,0,2|2,0,0]=4 20963 B15R1.504 NC(=O)CCCCCNc1ccccc1 34a_100000106764_100009817443 [0,0,0,0,0,2|1,0,0]=3 20964 B15R1.504 NC(=O)CCCCCOc1ccccc1 34a_100000210340_100009817443 [0,0,0,0,0,2|1,0,0]=3 20965 B15R1.504 NC(=O)CCCCCOc1ccccc1 7a_100000210340_100009817443 [0,0,0,0,0,2|1,0,0]=3 20966 B15R1.504 NC(=O)CCCCCOc1cccnc1 34a_100000210849_100009817443 [0,0,0,0,0,2|2,0,0]=4 20967 B15R1.504 NC(=O)CCCCCOc1cccnc1 7a_100000210849_100009817443 [0,0,0,0,0,2|2,0,0]=4 20968 B15R1.504 NC(=O)CCCCCOc1ccncc1 34a_100000212176_100009817443 [0,0,0,0,0,2|2,0,0]=4 20969 B15R1.504 NC(=O)CCCCCSc1ccccc1 62a_100000719477_100009817443 [0,0,0,0,0,2|1,0,0]=3 20970 B15R1.504 NC(=O)CCCCCSc1ccccc1 62a_100009817443_100000041952 [0,0,0,0,0,2|1,0,0]=3 20971 B15R1.504 NC(=O)CCCCCSc1ccccn1 62a_100009817443_100011216584 [0,0,0,0,0,2|2,0,0]=4 20972 B15R1.504 NC(=O)CCCCCSc1ccccn1 62a_100011216584_100009817443 [0,0,0,0,0,2|2,0,0]=4 20973 B15R1.504 NC(=O)CCCCCSc1cccnc1 62a_100000210063_100009817443 [0,0,0,0,0,2|2,0,0]=4 20974 B15R1.504 NC(=O)CCCCCSc1cccnc1 62a_100009817443_100000210063 [0,0,0,0,0,2|2,0,0]=4 20975 B15R1.504 NC(=O)CCCCCSc1ccncc1 62a_100000728582_100009817443 [0,0,0,0,0,2|2,0,0]=4 20976 B15R1.504 NC(=O)CCCCCSc1ccncc1 62a_100009817443_100000728582 [0,0,0,0,0,2|2,0,0]=4 20977 B15R1.504 NC(=O)CCCCNCc1ccccc1 207a_100000696515_100015611070 [0,0,0,0,0,2|1,0,0]=3 20978 B15R1.504 NC(=O)CCCCNCc1ccccc1 270004a_100000696515_100015611070 [0,0,0,0,0,2|1,0,0]=3 20979 B15R1.504 NC(=O)CCCCNCc1ccccc1 34a_100000696515_100015291786 [0,0,0,0,0,2|1,0,0]=3 20980 B15R1.504 NC(=O)CCCCNCc1ccccn1 207a_100000696515_100000209966 [0,0,0,0,0,2|2,0,0]=4 20981 B15R1.504 NC(=O)CCCCNCc1ccccn1 270004a_100000696515_100000209966 [0,0,0,0,0,2|2,0,0]=4 20982 B15R1.504 NC(=O)CCCCNCc1ccccn1 34a_100000696515_100000721315 [0,0,0,0,0,2|2,0,0]=4 20983 B15R1.504 NC(=O)CCCCNCc1cccnc1 207a_100000696515_100000209961 [0,0,0,0,0,2|2,0,0]=4 20984 B15R1.504 NC(=O)CCCCNCc1cccnc1 270004a_100000696515_100000209961 [0,0,0,0,0,2|2,0,0]=4 20985 B15R1.504 NC(=O)CCCCNCc1cccnc1 34a_100000696515_100000733263 [0,0,0,0,0,2|2,0,0]=4 20986 B15R1.504 NC(=O)CCCCNCc1ccncc1 207a_100000696515_100000186114 [0,0,0,0,0,2|2,0,0]=4 20987 B15R1.504 NC(=O)CCCCOCc1ccccc1 34a_100012022536_100015291786 [0,0,0,0,0,2|1,0,0]=3 20988 B15R1.504 NC(=O)CCCCOCc1ccccc1 7a_100012022536_100000211182 [0,0,0,0,0,2|1,0,0]=3 20989 B15R1.504 NC(=O)CCCCOCc1ccccn1 34a_100012022536_100000721315 [0,0,0,0,0,2|2,0,0]=4 20990 B15R1.504 NC(=O)CCCCOCc1ccccn1 7a_100012022536_100000721315 [0,0,0,0,0,2|2,0,0]=4 20991 B15R1.504 NC(=O)CCCCOCc1cccnc1 34a_100012022536_100000733263 [0,0,0,0,0,2|2,0,0]=4 20992 B15R1.504 NC(=O)CCCCOCc1cccnc1 7a_100012022536_100000741622 [0,0,0,0,0,2|2,0,0]=4 20993 B15R1.504 NC(=O)CCCCOCc1ccncc1 7a_100012022536_100015193705 [0,0,0,0,0,2|2,0,0]=4 20994 B15R1.504 NC(=O)CCCNCCc1ccccc1 34a_100000106460_100102525003 [0,0,0,0,0,2|1,0,0]=3 20995 B15R1.504 NC(=O)CCCNCCc1ccccc1 34a_100000739312_100000765856 [0,0,0,0,0,2|1,0,0]=3 20996 B15R1.504 NC(=O)CCCOCCc1ccccc1 34a_100000210268_100102525003 [0,0,0,0,0,2|1,0,0]=3 20997 B15R1.504 NC(=O)CCCOCCc1ccccc1 7a_100000210268_100102525003 [0,0,0,0,0,2|1,0,0]=3 20998 B15R1.504 NC(=O)CCCOCCc1ccccn1 34a_100000210271_100102525003 [0,0,0,0,0,2|2,0,0]=4 20999 B15R1.504 NC(=O)CCCOCCc1cccnc1 34a_100011217484_100102525003 [0,0,0,0,0,2|2,0,0]=4 21000 B15R1.504 NC(=O)CCCOCCc1ccncc1 34a_100011216225_100102525003 [0,0,0,0,0,2|2,0,0]=4 21001 B15R1.504 NC(=O)CCCSCCc1ccccc1 62a_100000765856_100102525003 [0,0,0,0,0,2|1,0,0]=3 21002 B15R1.504 NC(=O)CCCSCCc1ccccc1 62a_100102525003_100011218657 [0,0,0,0,0,2|1,0,0]=3 21003 B15R1.504 NC(=O)CCCSCCc1ccccn1 62a_100015183660_100102525003 [0,0,0,0,0,2|2,0,0]=4 21004 B15R1.504 NC(=O)CCCSCCc1ccccn1 62a_100102525003_100015183660 [0,0,0,0,0,2|2,0,0]=4 21005 B15R1.504 NC(=O)CCCSCCc1cccnc1 62a_100102525003_200011713674 [0,0,0,0,0,2|2,0,0]=4 21006 B15R1.504 NC(=O)CCCSCCc1cccnc1 62a_200011713674_100102525003 [0,0,0,0,0,2|2,0,0]=4 21007 B15R1.504 NC(=O)CCCSCCc1ccncc1 62a_100000723409_100102525003 [0,0,0,0,0,2|2,0,0]=4 21008 B15R1.504 NC(=O)CCCSCCc1ccncc1 62a_100102525003_100000723409 [0,0,0,0,0,2|2,0,0]=4 21009 B15R1.504 NC(=O)CCCSCSc1ccccc1 62a_100011218342_100102525003 [0,0,0,0,0,2|1,0,0]=3 21010 B15R1.504 NC(=O)CCCSCSc1ccccc1 62a_100102525003_100011218342 [0,0,0,0,0,2|1,0,0]=3 21011 B15R1.504 NC(=O)CCNC/C=C/c1ccccc1 2230a_100020603302_100000744528 [0,0,0,0,0,2|1,0,1]=4 21012 B15R1.504 NC(=O)CCNC/C=C/c1ccccc1 34a_100020603302_100000731001 [0,0,0,0,0,2|1,0,1]=4 21013 B15R1.504 NC(=O)CCNCC#Cc1ccccc1 34a_100000735379_100000731001 [0,0,0,0,0,2|1,0,1]=4 21014 B15R1.504 NC(=O)CCNCCCc1ccccc1 2230a_100000211184_100000744528 [0,0,0,0,0,2|1,0,0]=3 21015 B15R1.504 NC(=O)CCNCCCc1ccccc1 34a_100000211184_100000731001 [0,0,0,0,0,2|1,0,0]=3 21016 B15R1.504 NC(=O)CCNCCCc1cccnc1 2230a_100011532358_100000744528 [0,0,0,0,0,2|2,0,0]=4 21017 B15R1.504 NC(=O)CCNCCCc1cccnc1 34a_100011532358_100000731001 [0,0,0,0,0,2|2,0,0]=4 21018 B15R1.504 NC(=O)CCNCCCc1ccncc1 2230a_100011275580_100000744528 [0,0,0,0,0,2|2,0,0]=4 21019 B15R1.504 NC(=O)CCNCCOc1ccccc1 2230a_100000174943_100000744528 [0,0,0,0,0,2|1,0,0]=3 21020 B15R1.504 NC(=O)CCNCCOc1ccccc1 34a_100000174943_100000731001 [0,0,0,0,0,2|1,0,0]=3 21021 B15R1.504 NC(=O)CCNCCOc1ccccn1 2230a_106741647558_100000744528 [0,0,0,0,0,2|2,0,0]=4 21022 B15R1.504 NC(=O)CCNCCOc1cccnc1 2230a_100000754688_100000744528 [0,0,0,0,0,2|2,0,0]=4 21023 B15R1.504 NC(=O)CCNCCSc1ccccc1 2230a_100000189519_100000744528 [0,0,0,0,0,2|1,0,0]=3 21024 B15R1.504 NC(=O)CCOC/C=C/c1ccccc1 34a_100000210256_100000731001 [0,0,0,0,0,2|1,0,1]=4 21025 B15R1.504 NC(=O)CCOC/C=C/c1ccccc1 34a_100000757172_100016265936 [0,0,0,0,0,2|1,0,1]=4 21026 B15R1.504 NC(=O)CCOC/C=C/c1ccccc1 7a_100000757172_100016265936 [0,0,0,0,0,2|1,0,1]=4 21027 B15R1.504 NC(=O)CCOCC#Cc1ccccc1 34a_100000757172_100011352542 [0,0,0,0,0,2|1,0,1]=4 21028 B15R1.504 NC(=O)CCOCC#Cc1ccccc1 34a_100011217464_100000731001 [0,0,0,0,0,2|1,0,1]=4 21029 B15R1.504 NC(=O)CCOCC#Cc1ccccc1 7a_100000757172_100011352542 [0,0,0,0,0,2|1,0,1]=4 21030 B15R1.504 NC(=O)CCOCC#Cc1ccccc1 7a_100011217464_100000744528 [0,0,0,0,0,2|1,0,1]=4 21031 B15R1.504 NC(=O)CCOCCCc1ccccc1 34a_100000210828_100000731001 [0,0,0,0,0,2|1,0,0]=3 21032 B15R1.504 NC(=O)CCOCCCc1ccccc1 34a_100000757172_100000211621 [0,0,0,0,0,2|1,0,0]=3 21033 B15R1.504 NC(=O)CCOCCCc1ccccc1 7a_100000210828_100000744528 [0,0,0,0,0,2|1,0,0]=3 21034 B15R1.504 NC(=O)CCOCCCc1ccccc1 7a_100000757172_100000211621 [0,0,0,0,0,2|1,0,0]=3 21035 B15R1.504 NC(=O)CCOCCCc1ccccn1 34a_100011215068_100000731001 [0,0,0,0,0,2|2,0,0]=4 21036 B15R1.504 NC(=O)CCOCCCc1cccnc1 34a_100000211284_100000731001 [0,0,0,0,0,2|2,0,0]=4 21037 B15R1.504 NC(=O)CCOCCCc1ccncc1 34a_100000210659_100000731001 [0,0,0,0,0,2|2,0,0]=4 21038 B15R1.504 NC(=O)CCOCCNc1ccccc1 34a_100000211345_100000731001 [0,0,0,0,0,2|1,0,0]=3 21039 B15R1.504 NC(=O)CCOCCNc1ccncc1 34a_200011243140_100000731001 [0,0,0,0,0,2|2,0,0]=4 21040 B15R1.504 NC(=O)CCOCCOc1ccccc1 34a_100000210260_100000731001 [0,0,0,0,0,2|1,0,0]=3 21041 B15R1.504 NC(=O)CCOCCOc1ccccc1 34a_100000757172_100000184471 [0,0,0,0,0,2|1,0,0]=3 21042 B15R1.504 NC(=O)CCOCCOc1ccccc1 7a_100000210260_100000744528 [0,0,0,0,0,2|1,0,0]=3 21043 B15R1.504 NC(=O)CCOCCOc1ccccc1 7a_100000757172_100000184471 [0,0,0,0,0,2|1,0,0]=3 21044 B15R1.504 NC(=O)CCOCCSc1ccccc1 34a_100000757172_100000246102 [0,0,0,0,0,2|1,0,0]=3 21045 B15R1.504 NC(=O)CCOCCSc1ccccc1 7a_100000230494_100000744528 [0,0,0,0,0,2|1,0,0]=3 21046 B15R1.504 NC(=O)CCOCCSc1ccccc1 7a_100000757172_100000246102 [0,0,0,0,0,2|1,0,0]=3 21047 B15R1.504 NC(=O)CCOCCSc1ccccn1 7a_100000156319_100000744528 [0,0,0,0,0,2|2,0,0]=4 21048 B15R1.504 NC(=O)CCOCOCc1ccccc1 34a_100000757172_100000763385 [0,0,0,0,0,2|1,0,0]=3 21049 B15R1.504 NC(=O)CCOCSCc1ccccc1 34a_100000757172_200011217039 [0,0,0,0,0,2|1,0,0]=3 21050 B15R1.504 NC(=O)CCSC/C=C/c1ccccc1 62a_100000744528_100016265936 [0,0,0,0,0,2|1,0,1]=4 21051 B15R1.504 NC(=O)CCSC/C=C/c1ccccc1 62a_100016265936_100000744528 [0,0,0,0,0,2|1,0,1]=4 21052 B15R1.504 NC(=O)CCSCC#Cc1ccccc1 62a_100000744528_100011352542 [0,0,0,0,0,2|1,0,1]=4 21053 B15R1.504 NC(=O)CCSCCCc1ccccc1 62a_100000211621_100000744528 [0,0,0,0,0,2|1,0,0]=3 21054 B15R1.504 NC(=O)CCSCCCc1ccccc1 62a_100000744528_100000211621 [0,0,0,0,0,2|1,0,0]=3 21055 B15R1.504 NC(=O)CCSCCOc1ccccc1 62a_100000184471_100000744528 [0,0,0,0,0,2|1,0,0]=3 21056 B15R1.504 NC(=O)CCSCCOc1ccccc1 62a_100000744528_100000184471 [0,0,0,0,0,2|1,0,0]=3 21057 B15R1.504 NC(=O)CCSCCSc1ccccc1 62a_100000246102_100000744528 [0,0,0,0,0,2|1,0,0]=3 21058 B15R1.504 NC(=O)CCSCCSc1ccccc1 62a_100000744528_100000246102 [0,0,0,0,0,2|1,0,0]=3 21059 B15R1.504 NC(=O)CCSCOCc1ccccc1 62a_100000744528_100000763385 [0,0,0,0,0,2|1,0,0]=3 21060 B15R1.504 NC(=O)CCSCOCc1ccccc1 62a_100000763385_100000744528 [0,0,0,0,0,2|1,0,0]=3 21061 B15R1.504 NC(=O)CCSCSCc1ccccc1 62a_100000744528_200011217039 [0,0,0,0,0,2|1,0,0]=3 21062 B15R1.504 NC(=O)CCSCSCc1ccccc1 62a_200011217039_100000744528 [0,0,0,0,0,2|1,0,0]=3 21063 B15R1.504 NC(=O)CNCCCCc1ccccc1 2230a_100000711301_100000701786 [0,0,0,0,0,2|1,0,0]=3 21064 B15R1.504 NC(=O)CNCCCCc1ccccc1 2230a_100015280158_100000747473 [0,0,0,0,0,2|1,0,0]=3 21065 B15R1.504 NC(=O)CNCCCCc1ccccc1 34a_100015280158_100000187820 [0,0,0,0,0,2|1,0,0]=3 21066 B15R1.504 NC(=O)CNCCCCc1ccncc1 2230a_100000711301_100020630000 [0,0,0,0,0,2|2,0,0]=4 21067 B15R1.504 NC(=O)CNCCCOc1ccccc1 2230a_100000216521_100000747473 [0,0,0,0,0,2|1,0,0]=3 21068 B15R1.504 NC(=O)CNCCCOc1ccccc1 2230a_100000711301_100000199009 [0,0,0,0,0,2|1,0,0]=3 21069 B15R1.504 NC(=O)CNCCCOc1ccccc1 34a_100000216521_100000187820 [0,0,0,0,0,2|1,0,0]=3 21070 B15R1.504 NC(=O)CNCCCSc1ccccc1 2230a_100000184639_100000747473 [0,0,0,0,0,2|1,0,0]=3 21071 B15R1.504 NC(=O)CNCCCSc1ccccc1 2230a_100000711301_200011203293 [0,0,0,0,0,2|1,0,0]=3 21072 B15R1.504 NC(=O)CNCCOCc1ccccc1 2230a_100000711301_100000234347 [0,0,0,0,0,2|1,0,0]=3 21073 B15R1.504 NC(=O)CNCCOCc1ccccc1 2230a_100000753106_100000747473 [0,0,0,0,0,2|1,0,0]=3 21074 B15R1.504 NC(=O)CNCCOCc1ccccc1 34a_100000753106_100000187820 [0,0,0,0,0,2|1,0,0]=3 21075 B15R1.504 NC(=O)CNCCSCc1ccccc1 2230a_100000189534_100000747473 [0,0,0,0,0,2|1,0,0]=3 21076 B15R1.504 NC(=O)CNCCSCc1ccccc1 2230a_100000711301_200011297719 [0,0,0,0,0,2|1,0,0]=3 21077 B15R1.504 NC(=O)CNCCSCc1ccccc1 34a_100000189534_100000187820 [0,0,0,0,0,2|1,0,0]=3 21078 B15R1.504 NC(=O)CNCCSCc1ccccc1 7a_100000189534_100000187820 [0,0,0,0,0,2|1,0,0]=3 21079 B15R1.504 NC(=O)COCCC#Cc1ccccc1 34a_100000760064_100000187820 [0,0,0,0,0,2|1,0,1]=4 21080 B15R1.504 NC(=O)COCCC#Cc1ccccc1 7a_100000760064_100000187820 [0,0,0,0,0,2|1,0,1]=4 21081 B15R1.504 NC(=O)COCCCCc1ccccc1 34a_100000703073_100000187820 [0,0,0,0,0,2|1,0,0]=3 21082 B15R1.504 NC(=O)COCCCCc1ccccc1 7a_100000703073_100000187820 [0,0,0,0,0,2|1,0,0]=3 21083 B15R1.504 NC(=O)COCCCCc1ccccn1 34a_100012186994_100000187820 [0,0,0,0,0,2|2,0,0]=4 21084 B15R1.504 NC(=O)COCCCCc1cccnc1 34a_100012039607_100000187820 [0,0,0,0,0,2|2,0,0]=4 21085 B15R1.504 NC(=O)COCCCCc1cccnc1 7a_100012039607_100000187820 [0,0,0,0,0,2|2,0,0]=4 21086 B15R1.504 NC(=O)COCCCCc1ccncc1 34a_100011787716_100000187820 [0,0,0,0,0,2|2,0,0]=4 21087 B15R1.504 NC(=O)COCCCNc1ccccc1 34a_100000212590_100000187820 [0,0,0,0,0,2|1,0,0]=3 21088 B15R1.504 NC(=O)COCCCOc1ccccc1 34a_100011215863_100000187820 [0,0,0,0,0,2|1,0,0]=3 21089 B15R1.504 NC(=O)COCCCOc1ccccc1 7a_100011215863_100000187820 [0,0,0,0,0,2|1,0,0]=3 21090 B15R1.504 NC(=O)COCCNCc1ccccc1 2230a_100015324214_100000076697 [0,0,0,0,0,2|1,0,0]=3 21091 B15R1.504 NC(=O)COCCNCc1ccccc1 34a_100000180844_100000187820 [0,0,0,0,0,2|1,0,0]=3 21092 B15R1.504 NC(=O)COCCNCc1ccccc1 34a_100015324214_100000076697 [0,0,0,0,0,2|1,0,0]=3 21093 B15R1.504 NC(=O)COCCOCc1ccccc1 34a_100000210790_100000076697 [0,0,0,0,0,2|1,0,0]=3 21094 B15R1.504 NC(=O)COCCOCc1ccccc1 34a_100000759325_100000187820 [0,0,0,0,0,2|1,0,0]=3 21095 B15R1.504 NC(=O)COCCOCc1ccccc1 7a_100000210790_100000076697 [0,0,0,0,0,2|1,0,0]=3 21096 B15R1.504 NC(=O)COCCOCc1ccccc1 7a_100000759325_100000187820 [0,0,0,0,0,2|1,0,0]=3 21097 B15R1.504 NC(=O)COCCSCc1ccccc1 34a_100011205989_100000187820 [0,0,0,0,0,2|1,0,0]=3 21098 B15R1.504 NC(=O)COCCSCc1ccccc1 62a_100000076697_100015291786 [0,0,0,0,0,2|1,0,0]=3 21099 B15R1.504 NC(=O)COCCSCc1ccccc1 62a_100000211182_100000076697 [0,0,0,0,0,2|1,0,0]=3 21100 B15R1.504 NC(=O)COCCSCc1ccccc1 7a_100011205989_100000187820 [0,0,0,0,0,2|1,0,0]=3 21101 B15R1.504 NC(=O)COCCSCc1ccccn1 62a_100000076697_100000721315 [0,0,0,0,0,2|2,0,0]=4 21102 B15R1.504 NC(=O)COCCSCc1ccccn1 62a_100000721315_100000076697 [0,0,0,0,0,2|2,0,0]=4 21103 B15R1.504 NC(=O)COCCSCc1cccnc1 62a_100000076697_100000741622 [0,0,0,0,0,2|2,0,0]=4 21104 B15R1.504 NC(=O)COCCSCc1cccnc1 62a_100000741622_100000076697 [0,0,0,0,0,2|2,0,0]=4 21105 B15R1.504 NC(=O)COCCSCc1ccncc1 62a_100000076697_100015193705 [0,0,0,0,0,2|2,0,0]=4 21106 B15R1.504 NC(=O)COCCSCc1ccncc1 62a_100015193705_100000076697 [0,0,0,0,0,2|2,0,0]=4 21107 B15R1.504 NC(=O)CSCCCCc1ccccc1 62a_100000701786_100000747473 [0,0,0,0,0,2|1,0,0]=3 21108 B15R1.504 NC(=O)CSCCCCc1ccccc1 62a_100000747473_100000701786 [0,0,0,0,0,2|1,0,0]=3 21109 B15R1.504 NC(=O)CSCCCCc1ccncc1 62a_100000747473_100020630000 [0,0,0,0,0,2|2,0,0]=4 21110 B15R1.504 NC(=O)CSCCCCc1ccncc1 62a_100020630000_100000747473 [0,0,0,0,0,2|2,0,0]=4 21111 B15R1.504 NC(=O)CSCCCOc1ccccc1 62a_100000199009_100000747473 [0,0,0,0,0,2|1,0,0]=3 21112 B15R1.504 NC(=O)CSCCCOc1ccccc1 62a_100000747473_100000199009 [0,0,0,0,0,2|1,0,0]=3 21113 B15R1.504 NC(=O)CSCCCSc1ccccc1 62a_100000747473_200011203293 [0,0,0,0,0,2|1,0,0]=3 21114 B15R1.504 NC(=O)CSCCCSc1ccccc1 62a_200011203293_100000747473 [0,0,0,0,0,2|1,0,0]=3 21115 B15R1.504 NC(=O)CSCCOCc1ccccc1 62a_100000234347_100000747473 [0,0,0,0,0,2|1,0,0]=3 21116 B15R1.504 NC(=O)CSCCOCc1ccccc1 62a_100000747473_100000234347 [0,0,0,0,0,2|1,0,0]=3 21117 B15R1.504 NC(=O)CSCCSCc1ccccc1 62a_100000747473_200011297719 [0,0,0,0,0,2|1,0,0]=3 21118 B15R1.504 NC(=O)CSCCSCc1ccccc1 62a_200011297719_100000747473 [0,0,0,0,0,2|1,0,0]=3 21119 B15R1.504 NC(=O)NCCNCCc1ccccc1 2230a_100000106460_200000034859 [0,0,0,0,0,2|1,0,0]=3 21120 B15R1.504 NC(=O)NCCNCCc1ccccc1 34a_100020590234_100000765856 [0,0,0,0,0,2|1,0,0]=3 21121 B15R1.504 NC(=O)NCCNCCc1cccnc1 2230a_100000736294_200000034859 [0,0,0,0,0,2|2,0,0]=4 21122 B15R1.504 NC(=O)NCCOCCc1ccccc1 34a_100000181757_100000765856 [0,0,0,0,0,2|1,0,0]=3 21123 B15R1.504 NC(=O)NCCOCCc1ccccc1 7a_100000210268_200000034859 [0,0,0,0,0,2|1,0,0]=3 21124 B15R1.504 NC(=O)NCCSCCc1ccccc1 62a_100000765856_200000034859 [0,0,0,0,0,2|1,0,0]=3 21125 B15R1.504 NC(=O)NCCSCCc1ccccc1 62a_200000034859_100011218657 [0,0,0,0,0,2|1,0,0]=3 21126 B15R1.504 NC(=O)NCCSCCc1ccccn1 62a_100015183660_200000034859 [0,0,0,0,0,2|2,0,0]=4 21127 B15R1.504 NC(=O)NCCSCCc1ccccn1 62a_200000034859_100015183660 [0,0,0,0,0,2|2,0,0]=4 21128 B15R1.504 NC(=O)NCCSCCc1cccnc1 62a_200000034859_200011713674 [0,0,0,0,0,2|2,0,0]=4 21129 B15R1.504 NC(=O)NCCSCCc1cccnc1 62a_200011713674_200000034859 [0,0,0,0,0,2|2,0,0]=4 21130 B15R1.504 NC(=O)NCCSCCc1ccncc1 62a_100000723409_200000034859 [0,0,0,0,0,2|2,0,0]=4 21131 B15R1.504 NC(=O)NCCSCCc1ccncc1 62a_200000034859_100000723409 [0,0,0,0,0,2|2,0,0]=4 21132 B15R1.504 NC(=O)NCCSCSc1ccccc1 62a_100011218342_200000034859 [0,0,0,0,0,2|2,0,0]=4 21133 B15R1.504 NC(=O)NCCSCSc1ccccc1 62a_200000034859_100011218342 [0,0,0,0,0,2|2,0,0]=4 21134 B15R1.504 NC(=O)OCCNCCc1ccccc1 34a_100000106460_200011214921 [0,0,0,0,0,2|1,0,0]=3 21135 B15R1.504 NC(=O)OCCOCCc1ccccc1 34a_100000210268_200011214921 [0,0,0,0,0,2|1,0,0]=3 21136 B15R1.504 NC(=O)OCCOCCc1ccccc1 7a_100000210268_200011214921 [0,0,0,0,0,2|1,0,0]=3 21137 B15R1.504 NC(=O)OCCOCCc1ccccc1 7a_100000766696_100000765856 [0,0,0,0,0,2|1,0,0]=3 21138 B15R1.504 NC(=O)OCCOCCc1ccccn1 34a_100000210271_200011214921 [0,0,0,0,0,2|2,0,0]=4 21139 B15R1.504 NC(=O)OCCOCCc1ccccn1 7a_100000766696_100015183660 [0,0,0,0,0,2|2,0,0]=4 21140 B15R1.504 NC(=O)OCCOCCc1cccnc1 34a_100011217484_200011214921 [0,0,0,0,0,2|2,0,0]=4 21141 B15R1.504 NC(=O)OCCOCCc1cccnc1 7a_100000766696_200011713674 [0,0,0,0,0,2|2,0,0]=4 21142 B15R1.504 NC(=O)OCCOCCc1ccncc1 34a_100011216225_200011214921 [0,0,0,0,0,2|2,0,0]=4 21143 B15R1.504 NC(=O)OCCOCCc1ccncc1 7a_100000766696_100000723409 [0,0,0,0,0,2|2,0,0]=4 21144 B15R1.504 NC(=O)OCCSCCc1ccccc1 62a_100000765856_200011214921 [0,0,0,0,0,2|1,0,0]=3 21145 B15R1.504 NC(=O)OCCSCCc1ccccc1 62a_200011214921_100011218657 [0,0,0,0,0,2|1,0,0]=3 21146 B15R1.504 NC(=O)OCCSCCc1ccccn1 62a_100015183660_200011214921 [0,0,0,0,0,2|2,0,0]=4 21147 B15R1.504 NC(=O)OCCSCCc1ccccn1 62a_200011214921_100015183660 [0,0,0,0,0,2|2,0,0]=4 21148 B15R1.504 NC(=O)OCCSCCc1cccnc1 62a_200011214921_200011713674 [0,0,0,0,0,2|2,0,0]=4 21149 B15R1.504 NC(=O)OCCSCCc1cccnc1 62a_200011713674_200011214921 [0,0,0,0,0,2|2,0,0]=4 21150 B15R1.504 NC(=O)OCCSCCc1ccncc1 62a_100000723409_200011214921 [0,0,0,0,0,2|2,0,0]=4 21151 B15R1.504 NC(=O)OCCSCCc1ccncc1 62a_200011214921_100000723409 [0,0,0,0,0,2|2,0,0]=4 21152 B15R1.504 NC(=O)OCCSCSc1ccccc1 62a_100011218342_200011214921 [0,0,0,0,0,2|2,0,0]=4 21153 B15R1.504 NC(=O)OCCSCSc1ccccc1 62a_200011214921_100011218342 [0,0,0,0,0,2|2,0,0]=4 21154 B15R1.504 O=C(O)CNCCCCc1ccccc1 269956a_100016091260_100000701786 [0,0,0,0,0,2|0,0,0]=2 21155 B15R1.504 O=C(O)CNCCCCc1ccncc1 269956a_100016091260_100020630000 [0,0,0,0,0,2|1,0,0]=3 21156 B15R1.504 O=C(O)CNCCCOc1ccccc1 269956a_100016091260_100000199009 [0,0,0,0,0,2|0,0,0]=2 21157 B15R1.504 O=C(O)CNCCCSc1ccccc1 269956a_100016091260_200011203293 [0,0,0,0,0,2|0,0,0]=2 21158 B15R1.504 O=C(O)CNCCOCc1ccccc1 269956a_100016091260_100000234347 [0,0,0,0,0,2|0,0,0]=2 21159 B15R1.504 O=C(O)CNCCSCc1ccccc1 269956a_100016091260_200011297719 [0,0,0,0,0,2|0,0,0]=2 21160 B15R1.504 O=C(O)COCCNCc1ccccc1 269956a_100000700818_100015291786 [0,0,0,0,0,2|0,0,0]=2 21161 B15R1.504 O=C(O)COCCNCc1ccccn1 269956a_100000700818_100000721315 [0,0,0,0,0,2|1,0,0]=3 21162 B15R1.504 O=C(O)COCCNCc1cccnc1 269956a_100000700818_100000733263 [0,0,0,0,0,2|1,0,0]=3 21163 B15R1.504 O=C(O)COCCNCc1cccnn1 269956a_100000700818_100016990269 [0,0,0,0,0,2|2,0,0]=4 21164 B15R1.504 O=C(O)COCCNCc1ccncc1 269956a_100000700818_100015193705 [0,0,0,0,0,2|1,0,0]=3 21165 B15R1.504 O=C(O)COCCNCc1cnccn1 269956a_100000700818_100016995436 [0,0,0,0,0,2|2,0,0]=4 21166 B15R1.504 O=C(O)COCCNCc1cncnc1 269956a_100000700818_100016991940 [0,0,0,0,0,2|2,0,0]=4 21167 B15R1.504 O=C(O)COCCNCc1ncccn1 269956a_100000700818_100000703007 [0,0,0,0,0,2|2,0,0]=4 21168 B15R1.504 O=C(O)CONC/C=C/c1ccccc1 269956a_100000106656_100016265936 [0,0,0,0,0,2|0,0,2]=4 21169 B15R1.504 O=C(O)CONCC#Cc1ccccc1 269956a_100000106656_100011352542 [0,0,0,0,0,2|0,0,2]=4 21170 B15R1.504 O=C(O)CONCCCc1ccccc1 269956a_100000106656_100000211621 [0,0,0,0,0,2|0,0,0]=2 21171 B15R1.504 O=C(O)CONCCOc1ccccc1 269956a_100000106656_100000184471 [0,0,0,0,0,2|1,0,0]=3 21172 B15R1.504 O=C(O)CONCCSc1ccccc1 269956a_100000106656_100000246102 [0,0,0,0,0,2|1,0,0]=3 21173 B15R1.504 O=C(O)CONCOCc1ccccc1 269956a_100000106656_100000763385 [0,0,0,0,0,2|1,0,0]=3 21174 B15R1.504 O=C(O)CONCSCc1ccccc1 269956a_100000106656_200011217039 [0,0,0,0,0,2|1,0,0]=3 21175 B15R1.504 O=C([O-])CNCCCCc1ccccc1 34a_100015280158_100020667443 [0,0,0,0,0,2|0,0,1]=3 21176 B15R1.504 O=C([O-])CNCCCOc1ccccc1 34a_100000216521_100020667443 [0,0,0,0,0,2|0,0,1]=3 21177 B15R1.504 O=C([O-])CNCCOCc1ccccc1 34a_100000753106_100020667443 [0,0,0,0,0,2|0,0,1]=3 21178 B15R1.504 O=C([O-])CNCCSCc1ccccc1 34a_100000189534_100020667443 [0,0,0,0,0,2|0,0,1]=3 21179 B15R1.504 O=C([O-])COCCC#Cc1ccccc1 34a_100000760064_100020667443 [0,0,0,0,0,2|0,0,2]=4 21180 B15R1.504 O=C([O-])COCCCCc1ccccc1 34a_100000703073_100020667443 [0,0,0,0,0,2|0,0,1]=3 21181 B15R1.504 O=C([O-])COCCCCc1ccccn1 34a_100012186994_100020667443 [0,0,0,0,0,2|1,0,1]=4 21182 B15R1.504 O=C([O-])COCCCCc1cccnc1 34a_100012039607_100020667443 [0,0,0,0,0,2|1,0,1]=4 21183 B15R1.504 O=C([O-])COCCCCc1ccncc1 34a_100011787716_100020667443 [0,0,0,0,0,2|1,0,1]=4 21184 B15R1.504 O=C([O-])COCCCNc1ccccc1 34a_100000212590_100020667443 [0,0,0,0,0,2|0,0,1]=3 21185 B15R1.504 O=C([O-])COCCCOc1ccccc1 34a_100011215863_100020667443 [0,0,0,0,0,2|0,0,1]=3 21186 B15R1.504 O=C([O-])COCCNCc1ccccc1 34a_100000180844_100020667443 [0,0,0,0,0,2|0,0,1]=3 21187 B15R1.504 O=C([O-])COCCOCc1ccccc1 34a_100000759325_100020667443 [0,0,0,0,0,2|0,0,1]=3 21188 B15R1.504 O=C([O-])COCCSCc1ccccc1 34a_100011205989_100020667443 [0,0,0,0,0,2|0,0,1]=3 21189 B15R1.504 O=C([O-])CSCCCCc1ccccc1 62a_100000701786_100020667443 [0,0,0,0,0,2|0,0,1]=3 21190 B15R1.504 O=C([O-])CSCCCCc1ccccc1 62a_100020667443_100000701786 [0,0,0,0,0,2|0,0,1]=3 21191 B15R1.504 O=C([O-])CSCCCCc1ccncc1 62a_100020630000_100020667443 [0,0,0,0,0,2|1,0,1]=4 21192 B15R1.504 O=C([O-])CSCCCCc1ccncc1 62a_100020667443_100020630000 [0,0,0,0,0,2|1,0,1]=4 21193 B15R1.504 O=C([O-])CSCCCOc1ccccc1 62a_100000199009_100020667443 [0,0,0,0,0,2|0,0,1]=3 21194 B15R1.504 O=C([O-])CSCCCOc1ccccc1 62a_100020667443_100000199009 [0,0,0,0,0,2|0,0,1]=3 21195 B15R1.504 O=C([O-])CSCCCSc1ccccc1 62a_100020667443_200011203293 [0,0,0,0,0,2|0,0,1]=3 21196 B15R1.504 O=C([O-])CSCCCSc1ccccc1 62a_200011203293_100020667443 [0,0,0,0,0,2|0,0,1]=3 21197 B15R1.504 O=C([O-])CSCCOCc1ccccc1 62a_100000234347_100020667443 [0,0,0,0,0,2|0,0,1]=3 21198 B15R1.504 O=C([O-])CSCCOCc1ccccc1 62a_100020667443_100000234347 [0,0,0,0,0,2|0,0,1]=3 21199 B15R1.504 O=C([O-])CSCCSCc1ccccc1 62a_100020667443_200011297719 [0,0,0,0,0,2|0,0,1]=3 21200 B15R1.504 O=C([O-])CSCCSCc1ccccc1 62a_200011297719_100020667443 [0,0,0,0,0,2|0,0,1]=3 21201 B15R1.504 O=[N+]([O-])CCCCOCc1ccccc1 34a_200015379883_100015291786 [0,0,0,0,0,2|1,0,1]=4 21202 B15R1.504 O=[N+]([O-])CCCCOCc1ccccc1 7a_200015379883_100000211182 [0,0,0,0,0,2|1,0,1]=4 21203 B15R1.504 O=[N+]([O-])CCCOCCc1ccccc1 34a_200000037920_100000765856 [0,0,0,0,0,2|1,0,1]=4 21204 B15R1.504 O=[N+]([O-])CNCCCCc1ccccc1 34a_100015280158_100000761209 [0,0,0,0,0,2|1,0,1]=4 21205 B15R1.504 O=[N+]([O-])CNCCCOc1ccccc1 34a_100000216521_100000761209 [0,0,0,0,0,2|1,0,1]=4 21206 B15R1.504 O=[N+]([O-])CNCCOCc1ccccc1 34a_100000753106_100000761209 [0,0,0,0,0,2|1,0,1]=4 21207 B15R1.504 O=[N+]([O-])CNCCSCc1ccccc1 34a_100000189534_100000761209 [0,0,0,0,0,2|1,0,1]=4 21208 B15R1.504 O=[N+]([O-])COCCCCc1ccccc1 34a_100000703073_100000761209 [0,0,0,0,0,2|1,0,1]=4 21209 B15R1.504 O=[N+]([O-])COCCCNc1ccccc1 34a_100000212590_100000761209 [0,0,0,0,0,2|1,0,1]=4 21210 B15R1.504 O=[N+]([O-])COCCCOc1ccccc1 34a_100011215863_100000761209 [0,0,0,0,0,2|1,0,1]=4 21211 B15R1.504 O=[N+]([O-])COCCNCc1ccccc1 34a_100000180844_100000761209 [0,0,0,0,0,2|1,0,1]=4 21212 B15R1.504 O=[N+]([O-])COCCOCc1ccccc1 34a_100000759325_100000761209 [0,0,0,0,0,2|1,0,1]=4 21213 B15R1.504 O=[N+]([O-])COCCSCc1ccccc1 34a_100011205989_100000761209 [0,0,0,0,0,2|1,0,1]=4 21214 B15R1.504 O=[N+]([O-])CSCCCCc1ccccc1 62a_100000701786_100000761209 [0,0,0,0,0,2|1,0,1]=4 21215 B15R1.504 O=[N+]([O-])CSCCCOc1ccccc1 62a_100000199009_100000761209 [0,0,0,0,0,2|1,0,1]=4 21216 B15R1.504 O=[N+]([O-])CSCCCSc1ccccc1 62a_200011203293_100000761209 [0,0,0,0,0,2|1,0,1]=4 21217 B15R1.504 O=[N+]([O-])CSCCOCc1ccccc1 62a_100000234347_100000761209 [0,0,0,0,0,2|1,0,1]=4 21218 B15R1.504 O=[N+]([O-])CSCCSCc1ccccc1 62a_200011297719_100000761209 [0,0,0,0,0,2|1,0,1]=4 21219 B15R1.504 O=[N+]([O-])OCCCCNc1ccccc1 34a_100000106764_100015694321 [0,0,0,0,0,2|1,0,1]=4 21220 B15R1.504 O=[N+]([O-])OCCCCOc1ccccc1 34a_100000210340_100015694321 [0,0,0,0,0,2|1,0,1]=4 21221 B15R1.504 O=[N+]([O-])OCCCCOc1ccccc1 7a_100000210340_100015694321 [0,0,0,0,0,2|1,0,1]=4 21222 B15R1.504 O=[N+]([O-])OCCCCSc1ccccc1 62a_100000719477_100015694321 [0,0,0,0,0,2|1,0,1]=4 21223 B15R1.504 OB(O)CCCCCNc1ccccc1 34a_100000106764_200009817188 [0,0,0,0,0,2|1,0,1]=4 21224 B15R1.504 OB(O)CCCCCOc1ccccc1 34a_100000210340_200009817188 [0,0,0,0,0,2|1,0,1]=4 21225 B15R1.504 OB(O)CCCCCOc1ccccc1 7a_100000210340_200009817188 [0,0,0,0,0,2|1,0,1]=4 21226 B15R1.504 OB(O)CCCCCSc1ccccc1 62a_100000719477_200009817188 [0,0,0,0,0,2|1,0,1]=4 21227 B15R1.504 OB(O)CCCCCSc1ccccc1 62a_200009817188_100000041952 [0,0,0,0,0,2|1,0,1]=4 21228 B15R1.504 OB(O)CCCCNCc1ccccc1 2230a_100015324214_200009817182 [0,0,0,0,0,2|1,0,1]=4 21229 B15R1.504 OB(O)CCCCNCc1ccccc1 34a_100015324214_200009817182 [0,0,0,0,0,2|1,0,1]=4 21230 B15R1.504 OB(O)CCCCOCc1ccccc1 34a_100000210790_200009817182 [0,0,0,0,0,2|1,0,1]=4 21231 B15R1.504 OB(O)CCCCOCc1ccccc1 7a_100000210790_200009817182 [0,0,0,0,0,2|1,0,1]=4 21232 B15R1.504 OB(O)CCCCSCc1ccccc1 62a_100000211182_200009817182 [0,0,0,0,0,2|1,0,1]=4 21233 B15R1.504 OB(O)CCCCSCc1ccccc1 62a_200009817182_100015291786 [0,0,0,0,0,2|1,0,1]=4 21234 B15R1.504 [13CH3]C(=O)CCCCCCc1ccccc1 1458a_100000036270_200025704644 [0,0,0,0,0,2|1,0,0]=3 21235 B15R1.504 [13CH3]C(=O)CCCCSSc1ccccn1 1458a_200010996202_200025704644 [0,0,0,0,0,2|2,0,0]=4 21236 B15R1.504 [13CH3]C(=O)COCCOCc1ccccc1 1458a_100012357824_200025704644 [0,0,0,0,0,2|1,0,0]=3