0 B12R1.194 C=CC(F)(F)Sc1ccccc1 62a_100000719477_100009814244 [0,0,0,0,0,0|3,1,0]=4 1 B12R1.194 C=CC(F)(F)Sc1ccccc1 62a_100009814244_100000041952 [0,0,0,0,0,0|3,1,0]=4 2 B12R1.194 CCS(=O)(=O)Nc1ccccc1 232682a_100000106764_100000211323 [0,0,0,0,0,0|1,0,2]=3 3 B12R1.194 CNS(=O)(=O)Cc1ccccc1 270084a_100102657272_100000211737 [0,0,0,0,0,0|2,0,1]=3 4 B12R1.194 CNS(=O)(=O)Cc1ccccc1 274078a_100102657272_100000211737 [0,0,0,0,0,0|2,0,1]=3 5 B12R1.194 CNS(=O)(=O)Cc1ccccc1 40a_100102657272_100000235865 [0,0,0,0,0,0|2,0,1]=3 6 B11R1.40 C=CC(=O)Cc1ccccc1 1458a_100000185746_100015291786 [1,0,0,0,0,0|2,0,0]=3 7 B11R1.40 C=CC(=O)Cc1ccccn1 1458a_100000185746_100000721315 [1,0,0,0,0,0|3,0,0]=4 8 B11R1.40 C=CC(=O)Cc1cccnc1 1458a_100000185746_100000733263 [1,0,0,0,0,0|3,0,0]=4 9 B11R1.40 C=CC(=O)Cc1ccncc1 1458a_100000185746_100000705612 [1,0,0,0,0,0|3,0,0]=4 10 B11R1.40 C=CC(=O)Nc1ccccc1 1626a_100000106764_100000185746 [1,0,0,0,0,0|2,0,0]=3 11 B11R1.40 C=CC(=O)Nc1ccccc1 22a_100000106764_100000185746 [1,0,0,0,0,0|2,0,0]=3 12 B11R1.40 C=CC(C)Sc1ccccc1 62a_100011215867_100000041952 [1,0,0,0,0,0|2,1,0]=4 13 B13R1.249 CCS(=O)(=O)Nc1ccc(cc1)Br 232682a_100000210018_100000211323 [0,1,0,0,0,0|1,0,2]=4 14 B13R1.249 CCS(=O)(=O)Nc1ccc(cc1)C 232682a_100000124888_100000211323 [0,1,0,0,0,0|1,0,2]=4 15 B13R1.249 CCS(=O)(=O)Nc1ccc(cc1)C 40a_100000124888_100000053943 [0,1,0,0,0,0|1,0,2]=4 16 B13R1.249 CCS(=O)(=O)Nc1ccc(cc1)Cl 232682a_100000210052_100000211323 [0,1,0,0,0,0|1,0,2]=4 17 B13R1.249 CCS(=O)(=O)Nc1ccc(cc1)Cl 40a_100000210052_100000053943 [0,1,0,0,0,0|1,0,2]=4 18 B13R1.249 CCS(=O)(=O)Nc1ccc(cc1)F 232682a_100000185862_100000211323 [0,1,0,0,0,0|1,0,2]=4 19 B13R1.249 CCS(=O)(=O)Nc1ccc(cc1)F 40a_100000185862_100000053943 [0,1,0,0,0,0|1,0,2]=4 20 B13R1.249 CCS(=O)(=O)Nc1ccc(cc1)I 232682a_100000185761_100000211323 [0,1,0,0,0,0|1,0,2]=4 21 B13R1.249 CCS(=O)(=O)Nc1ccc(cc1)I 40a_100000185761_100000053943 [0,1,0,0,0,0|1,0,2]=4 22 B13R1.249 CCS(=O)(=O)Nc1ccc(cc1)O 232682a_100000185829_100000211323 [0,1,0,0,0,0|1,0,2]=4 23 B13R1.249 CNS(=O)(=O)Cc1ccc(cc1)Br 270084a_100102657272_100000764255 [0,1,0,0,0,0|2,0,1]=4 24 B13R1.249 CNS(=O)(=O)Cc1ccc(cc1)Br 274078a_100102657272_100000764255 [0,1,0,0,0,0|2,0,1]=4 25 B13R1.249 CNS(=O)(=O)Cc1ccc(cc1)C 270084a_100102657272_100000689310 [0,1,0,0,0,0|2,0,1]=4 26 B13R1.249 CNS(=O)(=O)Cc1ccc(cc1)C 274078a_100102657272_100000689310 [0,1,0,0,0,0|2,0,1]=4 27 B13R1.249 CNS(=O)(=O)Cc1ccc(cc1)Cl 270084a_100102657272_100011198069 [0,1,0,0,0,0|2,0,1]=4 28 B13R1.249 CNS(=O)(=O)Cc1ccc(cc1)Cl 274078a_100102657272_100011198069 [0,1,0,0,0,0|2,0,1]=4 29 B13R1.249 CNS(=O)(=O)Cc1ccc(cc1)F 270084a_100102657272_100000735682 [0,1,0,0,0,0|2,0,1]=4 30 B13R1.249 CNS(=O)(=O)Cc1ccc(cc1)F 274078a_100102657272_100000735682 [0,1,0,0,0,0|2,0,1]=4 31 B13R1.250 CCS(=O)(=O)Nc1cccc(c1)Br 232682a_100000210019_100000211323 [0,1,0,0,0,0|1,0,2]=4 32 B13R1.250 CCS(=O)(=O)Nc1cccc(c1)Br 40a_100000210019_100000053943 [0,1,0,0,0,0|1,0,2]=4 33 B13R1.250 CCS(=O)(=O)Nc1cccc(c1)C 232682a_100000188690_100000211323 [0,1,0,0,0,0|1,0,2]=4 34 B13R1.250 CCS(=O)(=O)Nc1cccc(c1)C 40a_100000188690_100000053943 [0,1,0,0,0,0|1,0,2]=4 35 B13R1.250 CCS(=O)(=O)Nc1cccc(c1)Cl 232682a_100000185859_100000211323 [0,1,0,0,0,0|1,0,2]=4 36 B13R1.250 CCS(=O)(=O)Nc1cccc(c1)Cl 40a_100000185859_100000053943 [0,1,0,0,0,0|1,0,2]=4 37 B13R1.250 CCS(=O)(=O)Nc1cccc(c1)F 232682a_100000210047_100000211323 [0,1,0,0,0,0|1,0,2]=4 38 B13R1.250 CCS(=O)(=O)Nc1cccc(c1)F 40a_100000210047_100000053943 [0,1,0,0,0,0|1,0,2]=4 39 B13R1.250 CCS(=O)(=O)Nc1cccc(c1)I 232682a_100000211102_100000211323 [0,1,0,0,0,0|1,0,2]=4 40 B13R1.250 CCS(=O)(=O)Nc1cccc(c1)I 40a_100000211102_100000053943 [0,1,0,0,0,0|1,0,2]=4 41 B13R1.250 CCS(=O)(=O)Nc1cccc(c1)O 232682a_100000210217_100000211323 [0,1,0,0,0,0|1,0,2]=4 42 B13R1.250 CCS(=O)(=O)Nc1cccc(c1)O 40a_100000210217_100000053943 [0,1,0,0,0,0|1,0,2]=4 43 B13R1.250 CNS(=O)(=O)Cc1cccc(c1)Br 270084a_100102657272_100000726588 [0,1,0,0,0,0|2,0,1]=4 44 B13R1.250 CNS(=O)(=O)Cc1cccc(c1)Br 274078a_100102657272_100000726588 [0,1,0,0,0,0|2,0,1]=4 45 B13R1.250 CNS(=O)(=O)Cc1cccc(c1)C 270084a_100102657272_100000743697 [0,1,0,0,0,0|2,0,1]=4 46 B13R1.250 CNS(=O)(=O)Cc1cccc(c1)C 274078a_100102657272_100000743697 [0,1,0,0,0,0|2,0,1]=4 47 B13R1.250 CNS(=O)(=O)Cc1cccc(c1)C 40a_100102657272_100015207158 [0,1,0,0,0,0|2,0,1]=4 48 B13R1.250 CNS(=O)(=O)Cc1cccc(c1)Cl 270084a_100102657272_100000725668 [0,1,0,0,0,0|2,0,1]=4 49 B13R1.250 CNS(=O)(=O)Cc1cccc(c1)Cl 274078a_100102657272_100000725668 [0,1,0,0,0,0|2,0,1]=4 50 B13R1.250 CNS(=O)(=O)Cc1cccc(c1)F 270084a_100102657272_100000750188 [0,1,0,0,0,0|2,0,1]=4 51 B13R1.250 CNS(=O)(=O)Cc1cccc(c1)F 274078a_100102657272_100000750188 [0,1,0,0,0,0|2,0,1]=4 52 B13R1.275 CCS(=O)(=O)Nc1ccccc1Br 232682a_100000210017_100000211323 [0,1,0,0,0,0|1,0,2]=4 53 B13R1.275 CCS(=O)(=O)Nc1ccccc1C 232682a_100015192222_100000211323 [0,1,0,0,0,0|1,0,2]=4 54 B13R1.275 CCS(=O)(=O)Nc1ccccc1Cl 232682a_100000185783_100000211323 [0,1,0,0,0,0|1,0,2]=4 55 B13R1.275 CCS(=O)(=O)Nc1ccccc1F 232682a_100000210422_100000211323 [0,1,0,0,0,0|1,0,2]=4 56 B13R1.275 CCS(=O)(=O)Nc1ccccc1I 232682a_100000210053_100000211323 [0,1,0,0,0,0|1,0,2]=4 57 B13R1.275 CCS(=O)(=O)Nc1ccccc1I 40a_100000210053_100000053943 [0,1,0,0,0,0|1,0,2]=4 58 B13R1.275 CNS(=O)(=O)Cc1ccccc1Br 270084a_100102657272_100000765529 [0,1,0,0,0,0|2,0,1]=4 59 B13R1.275 CNS(=O)(=O)Cc1ccccc1Br 274078a_100102657272_100000765529 [0,1,0,0,0,0|2,0,1]=4 60 B13R1.275 CNS(=O)(=O)Cc1ccccc1C 270084a_100102657272_100000750338 [0,1,0,0,0,0|2,0,1]=4 61 B13R1.275 CNS(=O)(=O)Cc1ccccc1C 274078a_100102657272_100000750338 [0,1,0,0,0,0|2,0,1]=4 62 B13R1.275 CNS(=O)(=O)Cc1ccccc1Cl 270084a_100102657272_100000750118 [0,1,0,0,0,0|2,0,1]=4 63 B13R1.275 CNS(=O)(=O)Cc1ccccc1Cl 274078a_100102657272_100000750118 [0,1,0,0,0,0|2,0,1]=4 64 B13R1.275 CNS(=O)(=O)Cc1ccccc1F 270084a_100102657272_100000739656 [0,1,0,0,0,0|2,0,1]=4 65 B13R1.275 CNS(=O)(=O)Cc1ccccc1F 274078a_100102657272_100000739656 [0,1,0,0,0,0|2,0,1]=4 66 B13R1.1073 CC(C)S(=O)(=O)Nc1ccccc1 20a_100000106764_100000742656 [0,1,0,0,0,0|1,0,2]=4 67 B13R1.1073 CC(C)S(=O)(=O)Nc1ccccc1 232682a_100000106764_100000742656 [0,1,0,0,0,0|1,0,2]=4 68 B13R1.1073 CN(C)S(=O)(=O)Cc1ccccc1 270084a_100102631434_100000211737 [0,1,0,0,0,0|2,0,1]=4 69 B13R1.1073 CN(C)S(=O)(=O)Cc1ccccc1 274078a_100102631434_100000211737 [0,1,0,0,0,0|2,0,1]=4 70 B13R1.1073 CN(C)S(=O)(=O)Cc1ccccc1 40a_100102631434_100000235865 [0,1,0,0,0,0|2,0,1]=4 71 B13R1.1327 CCCS(=O)(=O)Nc1ccccc1 232682a_100000106764_100000211391 [0,1,0,0,0,0|1,0,2]=4 72 B13R1.1327 CCNS(=O)(=O)Cc1ccccc1 270084a_100015525214_100000211737 [0,1,0,0,0,0|1,0,2]=4 73 B13R1.1327 CCNS(=O)(=O)Cc1ccccc1 274078a_100015525214_100000211737 [0,1,0,0,0,0|1,0,2]=4 74 B13R1.1327 CCNS(=O)(=O)Cc1ccccc1 40a_100015525214_100000235865 [0,1,0,0,0,0|1,0,2]=4 75 B13R1.1327 CNNS(=O)(=O)Cc1ccccc1 40a_100016993582_100000235865 [0,1,0,0,0,0|2,0,1]=4 76 B11R1.7 CNS(=O)(=O)c1ccccc1 270084a_100102657272_100000210345 [0,0,0,0,1,0|1,0,1]=3 77 B11R1.7 CNS(=O)(=O)c1ccccc1 274078a_100102657272_100000210345 [0,0,0,0,1,0|1,0,1]=3 78 B11R1.7 CNS(=O)(=O)c1ccccc1 40a_100102657272_100000032697 [0,0,0,0,1,0|1,0,1]=3 79 B11R1.7 CNS(=O)(=O)c1ccccn1 270084a_100102657272_100016994956 [0,0,0,0,1,0|2,0,1]=4 80 B11R1.7 CNS(=O)(=O)c1ccccn1 274078a_100102657272_100016994956 [0,0,0,0,1,0|2,0,1]=4 81 B11R1.7 CNS(=O)(=O)c1ccccn1 40a_100102657272_100000070048 [0,0,0,0,1,0|2,0,1]=4 82 B11R1.7 CNS(=O)(=O)c1cccnc1 270084a_100102657272_100000736704 [0,0,0,0,1,0|2,0,1]=4 83 B11R1.7 CNS(=O)(=O)c1cccnc1 274078a_100102657272_100000736704 [0,0,0,0,1,0|2,0,1]=4 84 B13R1.254 C=CC(C)(C)OCc1ccccc1 34a_100011215311_100015291786 [0,0,0,0,0,1|3,0,0]=4 85 B13R1.254 C=CC(C)(C)OCc1ccccc1 7a_100011215311_100000211182 [0,0,0,0,0,1|3,0,0]=4 86 B13R1.254 CCS(=O)(=O)NCc1ccccc1 270084a_100015324214_100000211323 [0,0,0,0,0,1|1,0,2]=4 87 B13R1.254 CCS(=O)(=O)NCc1ccccc1 274078a_100015324214_100000211323 [0,0,0,0,0,1|1,0,2]=4 88 B13R1.254 CCS(=O)(=O)NCc1ccccc1 40a_100015324214_100000053943 [0,0,0,0,0,1|1,0,2]=4 89 B13R1.254 CCS(=O)(=O)NNc1ccccc1 40a_100015195140_100000053943 [0,0,0,0,0,1|1,0,2]=4 90 B13R1.254 CNS(=O)(=O)C=Cc1ccccc1 40a_100102657272_100011098038 [0,0,0,0,0,1|2,0,1]=4 91 B13R1.254 CNS(=O)(=O)CCc1ccccc1 270084a_100102657272_100000738789 [0,0,0,0,0,1|2,0,1]=4 92 B13R1.254 CNS(=O)(=O)CCc1ccccc1 274078a_100102657272_100000738789 [0,0,0,0,0,1|2,0,1]=4 93 B13R1.254 O=S(=O)(CCl)NCc1ccccc1 270084a_100015324214_100000031410 [0,0,0,0,0,1|2,0,1]=4 94 B13R1.254 O=S(=O)(CCl)NCc1ccccc1 274078a_100015324214_100000031410 [0,0,0,0,0,1|2,0,1]=4 95 B10R1.17 C=CCNc1ccccc1 34a_100000106764_100015514636 [2,0,0,0,0,0|2,0,0]=4 96 B10R1.17 C=CCOc1ccccc1 34a_100000210340_100015514636 [2,0,0,0,0,0|1,0,0]=3 97 B10R1.17 C=CCOc1ccccc1 7a_100000210340_100015514636 [2,0,0,0,0,0|1,0,0]=3 98 B10R1.17 C=CCOc1cccnc1 34a_100000210849_100015514636 [2,0,0,0,0,0|2,0,0]=4 99 B10R1.17 C=CCOc1cccnc1 7a_100000210849_100015514636 [2,0,0,0,0,0|2,0,0]=4 100 B10R1.17 C=CCOc1ccncc1 34a_100000212176_100015514636 [2,0,0,0,0,0|2,0,0]=4 101 B10R1.17 C=CCSc1ccccc1 62a_100000210623_100000041952 [2,0,0,0,0,0|1,1,0]=4 102 B10R1.17 C=CCSc1ccccc1 62a_100000719477_100000210623 [2,0,0,0,0,0|1,1,0]=4 103 B10R1.17 O=CCOc1ccccc1 34a_100000210340_200009817547 [2,0,0,0,0,0|2,0,0]=4 104 B10R1.17 O=CCOc1ccccc1 7a_100000210340_200015260668 [2,0,0,0,0,0|2,0,0]=4 105 B12R0.453 C=CC=CC(=O)NS(=O)(=O)CC=C 2740a_100000694456_100016291481 [0,1,1,0,0,0|2,0,0]=4 106 B12R1.32 C=CCC(=O)Cc1ccccc1 1458a_100000210193_100015291786 [1,1,0,0,0,0|2,0,0]=4 107 B12R1.32 C=CCC(=O)Nc1ccccc1 11a_100000106764_100000210193 [1,1,0,0,0,0|2,0,0]=4 108 B12R1.32 C=CCC(=O)Nc1ccccc1 1626a_100000106764_100000210193 [1,1,0,0,0,0|2,0,0]=4 109 B12R1.32 C=CCC(=O)Nc1ccccc1 22a_100000106764_100000210193 [1,1,0,0,0,0|2,0,0]=4 110 B12R1.32 C=CCC(=O)Nc1ccccc1 527a_100000106764_100000210193 [1,1,0,0,0,0|2,0,0]=4 111 B12R1.32 CC=CC(=O)Cc1ccccc1 1458a_100000210699_100015291786 [1,1,0,0,0,0|2,0,0]=4 112 B12R1.32 CC=CC(=O)Nc1ccccc1 11a_100000106764_100000210699 [1,1,0,0,0,0|2,0,0]=4 113 B12R1.32 CC=CC(=O)Nc1ccccc1 1626a_100000106764_100000210699 [1,1,0,0,0,0|2,0,0]=4 114 B12R1.32 CC=CC(=O)Nc1ccccc1 22a_100000106764_100000210699 [1,1,0,0,0,0|2,0,0]=4 115 B12R1.32 O=C(C=CBr)Cc1ccccc1 1458a_100016273825_100015291786 [1,1,0,0,0,0|2,0,0]=4 116 B12R1.32 O=C(C=CBr)Nc1ccccc1 1626a_100000106764_100016273825 [1,1,0,0,0,0|2,0,0]=4 117 B12R1.32 O=C(C=CCl)Cc1ccccc1 1458a_200016279998_100015291786 [1,1,0,0,0,0|2,0,0]=4 118 B12R1.32 O=C(C=CCl)Nc1ccccc1 11a_100000106764_200016279998 [1,1,0,0,0,0|2,0,0]=4 119 B12R1.32 O=C(C=CCl)Nc1ccccc1 1626a_100000106764_200016279998 [1,1,0,0,0,0|2,0,0]=4 120 B12R1.32 O=C(C=CI)Cc1ccccc1 1458a_100016256311_100015291786 [1,1,0,0,0,0|2,0,0]=4 121 B12R1.32 O=C(C=CI)Nc1ccccc1 1626a_100000106764_100016256311 [1,1,0,0,0,0|2,0,0]=4 122 B12R1.34 C=CC(=O)C(C)c1ccccc1 1458a_100000185746_100000230085 [1,1,0,0,0,0|2,0,0]=4 123 B12R1.34 C=CC(=O)N(C)c1ccccc1 1626a_100000210012_100000185746 [1,1,0,0,0,0|2,0,0]=4 124 B12R1.34 C=CC(=O)N(C)c1ccccc1 22a_100000210012_100000185746 [1,1,0,0,0,0|2,0,0]=4 125 B12R1.43 C=C(Br)C(=O)Nc1ccccc1 11a_100000106764_100009813364 [1,1,0,0,0,0|2,0,0]=4 126 B12R1.43 C=C(Br)C(=O)Nc1ccccc1 1626a_100000106764_100009813364 [1,1,0,0,0,0|2,0,0]=4 127 B12R1.43 C=C(C)C(=O)Cc1ccccc1 1458a_100000185857_100015291786 [1,1,0,0,0,0|2,0,0]=4 128 B12R1.43 C=C(C)C(=O)Nc1ccccc1 11a_100000106764_100000185857 [1,1,0,0,0,0|2,0,0]=4 129 B12R1.43 C=C(C)C(=O)Nc1ccccc1 1626a_100000106764_100000185857 [1,1,0,0,0,0|2,0,0]=4 130 B12R1.43 C=C(C)C(=O)Nc1ccccc1 22a_100000106764_100000185857 [1,1,0,0,0,0|2,0,0]=4 131 B12R1.43 C=C(Cl)C(=O)Nc1ccccc1 11a_100000106764_100000039160 [1,1,0,0,0,0|2,0,0]=4 132 B12R1.43 C=C(Cl)C(=O)Nc1ccccc1 1626a_100000106764_100000039160 [1,1,0,0,0,0|2,0,0]=4 133 B12R1.43 C=C(Cl)C(=O)Nc1ccccc1 22a_100000106764_100000039160 [1,1,0,0,0,0|2,0,0]=4 134 B12R1.43 C=C(F)C(=O)Nc1ccccc1 11a_100000106764_100000036797 [1,1,0,0,0,0|2,0,0]=4 135 B12R1.43 C=C(F)C(=O)Nc1ccccc1 1626a_100000106764_100000036797 [1,1,0,0,0,0|2,0,0]=4 136 B12R1.43 C=C(F)C(=O)Nc1ccccc1 22a_100000106764_100000036797 [1,1,0,0,0,0|2,0,0]=4 137 B12R1.49 C=CC(=O)Cc1ccc(cc1)Br 1458a_100000185746_100000189115 [1,1,0,0,0,0|2,0,0]=4 138 B12R1.49 C=CC(=O)Cc1ccc(cc1)C 1458a_100000185746_100000210814 [1,1,0,0,0,0|2,0,0]=4 139 B12R1.49 C=CC(=O)Cc1ccc(cc1)Cl 1458a_100000185746_100000694040 [1,1,0,0,0,0|2,0,0]=4 140 B12R1.49 C=CC(=O)Cc1ccc(cc1)F 1458a_100000185746_100000198546 [1,1,0,0,0,0|2,0,0]=4 141 B12R1.49 C=CC(=O)Cc1ccc(cc1)I 1458a_100000185746_100000189116 [1,1,0,0,0,0|2,0,0]=4 142 B12R1.49 C=CC(=O)Nc1ccc(cc1)Br 1626a_100000210018_100000185746 [1,1,0,0,0,0|2,0,0]=4 143 B12R1.49 C=CC(=O)Nc1ccc(cc1)Br 22a_100000210018_100000185746 [1,1,0,0,0,0|2,0,0]=4 144 B12R1.49 C=CC(=O)Nc1ccc(cc1)C 1626a_100000124888_100000185746 [1,1,0,0,0,0|2,0,0]=4 145 B12R1.49 C=CC(=O)Nc1ccc(cc1)C 22a_100000124888_100000185746 [1,1,0,0,0,0|2,0,0]=4 146 B12R1.49 C=CC(=O)Nc1ccc(cc1)Cl 1626a_100000210052_100000185746 [1,1,0,0,0,0|2,0,0]=4 147 B12R1.49 C=CC(=O)Nc1ccc(cc1)Cl 22a_100000210052_100000185746 [1,1,0,0,0,0|2,0,0]=4 148 B12R1.49 C=CC(=O)Nc1ccc(cc1)F 1626a_100000185862_100000185746 [1,1,0,0,0,0|2,0,0]=4 149 B12R1.49 C=CC(=O)Nc1ccc(cc1)F 22a_100000185862_100000185746 [1,1,0,0,0,0|2,0,0]=4 150 B12R1.49 C=CC(=O)Nc1ccc(cc1)I 1626a_100000185761_100000185746 [1,1,0,0,0,0|2,0,0]=4 151 B12R1.49 C=CC(=O)Nc1ccc(cc1)I 22a_100000185761_100000185746 [1,1,0,0,0,0|2,0,0]=4 152 B12R1.49 C=CC(=O)Nc1ccc(cc1)O 22a_100000185829_100000185746 [1,1,0,0,0,0|2,0,0]=4 153 B12R1.50 C=CC(=O)Cc1cccc(c1)Br 1458a_100000185746_100000211773 [1,1,0,0,0,0|2,0,0]=4 154 B12R1.50 C=CC(=O)Cc1cccc(c1)C 1458a_100000185746_100000211840 [1,1,0,0,0,0|2,0,0]=4 155 B12R1.50 C=CC(=O)Cc1cccc(c1)Cl 1458a_100000185746_100000181238 [1,1,0,0,0,0|2,0,0]=4 156 B12R1.50 C=CC(=O)Cc1cccc(c1)F 1458a_100000185746_100000230114 [1,1,0,0,0,0|2,0,0]=4 157 B12R1.50 C=CC(=O)Cc1cccc(c1)I 1458a_100000185746_100011218688 [1,1,0,0,0,0|2,0,0]=4 158 B12R1.50 C=CC(=O)Cc1cccc(c1)O 1458a_100000185746_100011660834 [1,1,0,0,0,0|2,0,0]=4 159 B12R1.50 C=CC(=O)Nc1cccc(c1)Br 1626a_100000210019_100000185746 [1,1,0,0,0,0|2,0,0]=4 160 B12R1.50 C=CC(=O)Nc1cccc(c1)Br 22a_100000210019_100000185746 [1,1,0,0,0,0|2,0,0]=4 161 B12R1.50 C=CC(=O)Nc1cccc(c1)C 1626a_100000188690_100000185746 [1,1,0,0,0,0|2,0,0]=4 162 B12R1.50 C=CC(=O)Nc1cccc(c1)C 22a_100000188690_100000185746 [1,1,0,0,0,0|2,0,0]=4 163 B12R1.50 C=CC(=O)Nc1cccc(c1)Cl 1626a_100000185859_100000185746 [1,1,0,0,0,0|2,0,0]=4 164 B12R1.50 C=CC(=O)Nc1cccc(c1)Cl 22a_100000185859_100000185746 [1,1,0,0,0,0|2,0,0]=4 165 B12R1.50 C=CC(=O)Nc1cccc(c1)F 1626a_100000210047_100000185746 [1,1,0,0,0,0|2,0,0]=4 166 B12R1.50 C=CC(=O)Nc1cccc(c1)F 22a_100000210047_100000185746 [1,1,0,0,0,0|2,0,0]=4 167 B12R1.50 C=CC(=O)Nc1cccc(c1)I 1626a_100000211102_100000185746 [1,1,0,0,0,0|2,0,0]=4 168 B12R1.50 C=CC(=O)Nc1cccc(c1)I 22a_100000211102_100000185746 [1,1,0,0,0,0|2,0,0]=4 169 B12R1.50 C=CC(=O)Nc1cccc(c1)O 1626a_100000210217_100000185746 [1,1,0,0,0,0|2,0,0]=4 170 B12R1.50 C=CC(=O)Nc1cccc(c1)O 22a_100000210217_100000185746 [1,1,0,0,0,0|2,0,0]=4 171 B12R1.118 O=CC(C=O)Oc1ccccc1 34a_100000210340_100000736813 [1,1,0,0,0,0|2,0,0]=4 172 B12R1.371 C=CC(=O)Cc1ccccc1Br 1458a_100000185746_100000184730 [1,1,0,0,0,0|2,0,0]=4 173 B12R1.371 C=CC(=O)Cc1ccccc1C 1458a_100000185746_100000211839 [1,1,0,0,0,0|2,0,0]=4 174 B12R1.371 C=CC(=O)Cc1ccccc1Cl 1458a_100000185746_100000187162 [1,1,0,0,0,0|2,0,0]=4 175 B12R1.371 C=CC(=O)Cc1ccccc1F 1458a_100000185746_100000187165 [1,1,0,0,0,0|2,0,0]=4 176 B12R1.371 C=CC(=O)Cc1ccccc1I 1458a_100000185746_100011216222 [1,1,0,0,0,0|2,0,0]=4 177 B12R1.371 C=CC(=O)Nc1ccccc1Br 1626a_100000210017_100000185746 [1,1,0,0,0,0|2,0,0]=4 178 B12R1.371 C=CC(=O)Nc1ccccc1C 1626a_100015192222_100000185746 [1,1,0,0,0,0|2,0,0]=4 179 B12R1.371 C=CC(=O)Nc1ccccc1C 22a_100015192222_100000185746 [1,1,0,0,0,0|2,0,0]=4 180 B12R1.371 C=CC(=O)Nc1ccccc1Cl 1626a_100000185783_100000185746 [1,1,0,0,0,0|2,0,0]=4 181 B12R1.371 C=CC(=O)Nc1ccccc1Cl 22a_100000185783_100000185746 [1,1,0,0,0,0|2,0,0]=4 182 B12R1.371 C=CC(=O)Nc1ccccc1F 1626a_100000210422_100000185746 [1,1,0,0,0,0|2,0,0]=4 183 B12R1.371 C=CC(=O)Nc1ccccc1F 22a_100000210422_100000185746 [1,1,0,0,0,0|2,0,0]=4 184 B12R1.371 C=CC(=O)Nc1ccccc1I 1626a_100000210053_100000185746 [1,1,0,0,0,0|2,0,0]=4 185 B12R1.371 C=CC(=O)Nc1ccccc1O 22a_100000185747_100000185746 [1,1,0,0,0,0|2,0,0]=4 186 B12R1.106 CS(=O)(=O)Cc1ccc(cc1)O 271570a_203496583355_100009814647 [1,1,0,0,0,0|1,0,1]=4 187 B12R1.106 CS(=O)(=O)Nc1ccc(cc1)Cl 40a_100000210052_100000738038 [1,1,0,0,0,0|1,0,1]=4 188 B12R1.106 CS(=O)(=O)Nc1ccc(cc1)F 40a_100000185862_100000738038 [1,1,0,0,0,0|1,0,1]=4 189 B12R1.106 CS(=O)(=O)Nc1ccc(cc1)I 40a_100000185761_100000738038 [1,1,0,0,0,0|1,0,1]=4 190 B12R1.106 CS(=O)(=O)Nc1ccc(cc1)O 271570a_203496583355_200000165602 [1,1,0,0,0,0|1,0,1]=4 191 B12R1.106 Cc1ccc(cc1)NS(=O)(=O)C 40a_100000124888_100000738038 [1,1,0,0,0,0|1,0,1]=4 192 B12R1.106 NS(=O)(=O)Cc1ccc(cc1)O 271570a_203496583355_100000764258 [1,1,0,0,0,0|2,0,0]=4 193 B12R1.119 CS(=O)(=O)Cc1cccc(c1)O 271570a_203496583355_200009814643 [1,1,0,0,0,0|1,0,1]=4 194 B12R1.119 CS(=O)(=O)Nc1cccc(c1)Br 40a_100000210019_100000738038 [1,1,0,0,0,0|1,0,1]=4 195 B12R1.119 CS(=O)(=O)Nc1cccc(c1)Cl 40a_100000185859_100000738038 [1,1,0,0,0,0|1,0,1]=4 196 B12R1.119 CS(=O)(=O)Nc1cccc(c1)F 40a_100000210047_100000738038 [1,1,0,0,0,0|1,0,1]=4 197 B12R1.119 CS(=O)(=O)Nc1cccc(c1)I 40a_100000211102_100000738038 [1,1,0,0,0,0|1,0,1]=4 198 B12R1.119 CS(=O)(=O)Nc1cccc(c1)O 271570a_203496583355_100000165606 [1,1,0,0,0,0|1,0,1]=4 199 B12R1.119 CS(=O)(=O)Nc1cccc(c1)O 40a_100000210217_100000738038 [1,1,0,0,0,0|1,0,1]=4 200 B12R1.119 Cc1cccc(c1)NS(=O)(=O)C 40a_100000188690_100000738038 [1,1,0,0,0,0|1,0,1]=4 201 B12R1.119 NS(=O)(=O)Cc1cccc(c1)O 271570a_203496583355_100000725052 [1,1,0,0,0,0|2,0,0]=4 202 B12R1.151 CS(=O)(=O)Cc1ccccc1O 271570a_203496583355_100009814642 [1,1,0,0,0,0|1,0,1]=4 203 B12R1.151 CS(=O)(=O)Nc1ccccc1I 40a_100000210053_100000738038 [1,1,0,0,0,0|1,0,1]=4 204 B12R1.151 CS(=O)(=O)Nc1ccccc1O 271570a_203496583355_100000165598 [1,1,0,0,0,0|1,0,1]=4 205 B12R1.9 CCS(=O)(=O)c1ccc(cc1)O 271570a_203496583355_100000765143 [0,1,0,0,1,0|0,0,2]=4 206 B12R1.9 CNS(=O)(=O)c1ccc(cc1)Br 270084a_100102657272_100000182491 [0,1,0,0,1,0|1,0,1]=4 207 B12R1.9 CNS(=O)(=O)c1ccc(cc1)Br 274078a_100102657272_100000182491 [0,1,0,0,1,0|1,0,1]=4 208 B12R1.9 CNS(=O)(=O)c1ccc(cc1)Br 40a_100102657272_100010306709 [0,1,0,0,1,0|1,0,1]=4 209 B12R1.9 CNS(=O)(=O)c1ccc(cc1)C 270084a_100102657272_100000211267 [0,1,0,0,1,0|1,0,1]=4 210 B12R1.9 CNS(=O)(=O)c1ccc(cc1)C 274078a_100102657272_100000211267 [0,1,0,0,1,0|1,0,1]=4 211 B12R1.9 CNS(=O)(=O)c1ccc(cc1)C 40a_100102657272_100000039673 [0,1,0,0,1,0|1,0,1]=4 212 B12R1.9 CNS(=O)(=O)c1ccc(cc1)Cl 270084a_100102657272_100000209962 [0,1,0,0,1,0|1,0,1]=4 213 B12R1.9 CNS(=O)(=O)c1ccc(cc1)Cl 274078a_100102657272_100000209962 [0,1,0,0,1,0|1,0,1]=4 214 B12R1.9 CNS(=O)(=O)c1ccc(cc1)Cl 40a_100102657272_100000077732 [0,1,0,0,1,0|1,0,1]=4 215 B12R1.9 CNS(=O)(=O)c1ccc(cc1)F 270084a_100102657272_100000184267 [0,1,0,0,1,0|1,0,1]=4 216 B12R1.9 CNS(=O)(=O)c1ccc(cc1)F 274078a_100102657272_100000184267 [0,1,0,0,1,0|1,0,1]=4 217 B12R1.9 CNS(=O)(=O)c1ccc(cc1)F 40a_100102657272_100000081159 [0,1,0,0,1,0|1,0,1]=4 218 B12R1.9 CNS(=O)(=O)c1ccc(cc1)I 270084a_100102657272_100011205396 [0,1,0,0,1,0|1,0,1]=4 219 B12R1.9 CNS(=O)(=O)c1ccc(cc1)I 274078a_100102657272_100011205396 [0,1,0,0,1,0|1,0,1]=4 220 B12R1.9 CNS(=O)(=O)c1ccc(cc1)N 40a_100102657272_100000054796 [0,1,0,0,1,0|1,0,1]=4 221 B12R1.9 CNS(=O)(=O)c1ccc(cc1)O 270084a_100102657272_100020667864 [0,1,0,0,1,0|1,0,1]=4 222 B12R1.9 CNS(=O)(=O)c1ccc(cc1)O 271570a_203496583355_100000754977 [0,1,0,0,1,0|1,0,1]=4 223 B12R1.9 CNS(=O)(=O)c1ccc(cc1)O 274078a_100102657272_100020667864 [0,1,0,0,1,0|1,0,1]=4 224 B12R1.9 COS(=O)(=O)c1ccc(cc1)O 271570a_203496583355_100000004522 [0,1,0,0,1,0|1,0,1]=4 225 B12R1.9 NNS(=O)(=O)c1ccc(cc1)O 271570a_203496583355_100000183514 [0,1,0,0,1,0|2,0,0]=4 226 B12R1.10 CCS(=O)(=O)c1cccc(c1)O 271570a_203496583355_100009815775 [0,1,0,0,1,0|0,0,2]=4 227 B12R1.10 CNS(=O)(=O)c1cccc(c1)Br 270084a_100102657272_100000184224 [0,1,0,0,1,0|1,0,1]=4 228 B12R1.10 CNS(=O)(=O)c1cccc(c1)Br 274078a_100102657272_100000184224 [0,1,0,0,1,0|1,0,1]=4 229 B12R1.10 CNS(=O)(=O)c1cccc(c1)Br 40a_100102657272_100010340488 [0,1,0,0,1,0|1,0,1]=4 230 B12R1.10 CNS(=O)(=O)c1cccc(c1)C 270084a_100102657272_100000182797 [0,1,0,0,1,0|1,0,1]=4 231 B12R1.10 CNS(=O)(=O)c1cccc(c1)C 274078a_100102657272_100000182797 [0,1,0,0,1,0|1,0,1]=4 232 B12R1.10 CNS(=O)(=O)c1cccc(c1)C 40a_100102657272_100010983817 [0,1,0,0,1,0|1,0,1]=4 233 B12R1.10 CNS(=O)(=O)c1cccc(c1)Cl 270084a_100102657272_100000182923 [0,1,0,0,1,0|1,0,1]=4 234 B12R1.10 CNS(=O)(=O)c1cccc(c1)Cl 274078a_100102657272_100000182923 [0,1,0,0,1,0|1,0,1]=4 235 B12R1.10 CNS(=O)(=O)c1cccc(c1)F 270084a_100102657272_100000184201 [0,1,0,0,1,0|1,0,1]=4 236 B12R1.10 CNS(=O)(=O)c1cccc(c1)F 274078a_100102657272_100000184201 [0,1,0,0,1,0|1,0,1]=4 237 B12R1.10 CNS(=O)(=O)c1cccc(c1)N 40a_100102657272_100000034547 [0,1,0,0,1,0|1,0,1]=4 238 B12R1.10 CNS(=O)(=O)c1cccc(c1)O 271570a_203496583355_100000165148 [0,1,0,0,1,0|1,0,1]=4 239 B12R1.39 CCNS(=O)(=O)c1ccccc1 270084a_100015525214_100000210345 [0,1,0,0,1,0|0,0,2]=4 240 B12R1.39 CCNS(=O)(=O)c1ccccc1 274078a_100015525214_100000210345 [0,1,0,0,1,0|0,0,2]=4 241 B12R1.39 CCNS(=O)(=O)c1ccccc1 40a_100015525214_100000032697 [0,1,0,0,1,0|0,0,2]=4 242 B12R1.39 CNCS(=O)(=O)c1ccccc1 34a_100102657272_200009813291 [0,1,0,0,1,0|0,0,2]=4 243 B12R1.39 CNNS(=O)(=O)c1ccccc1 40a_100016993582_100000032697 [0,1,0,0,1,0|1,0,1]=4 244 B12R1.39 COCS(=O)(=O)c1ccccc1 34a_100138415774_200009813291 [0,1,0,0,1,0|0,0,2]=4 245 B12R1.39 CSCS(=O)(=O)c1ccccc1 62a_100000240042_200000210301 [0,1,0,0,1,0|0,0,2]=4 246 B12R1.39 CSCS(=O)(=O)c1ccccc1 62a_200000210301_100000240042 [0,1,0,0,1,0|0,0,2]=4 247 B12R1.39 [13CH3]SCS(=O)(=O)c1ccccc1 62a_100000240042_200025704644 [0,1,0,0,1,0|0,0,2]=4 248 B12R1.39 [13CH3]SCS(=O)(=O)c1ccccc1 62a_200025704644_100000240042 [0,1,0,0,1,0|0,0,2]=4 249 B12R1.195 CNS(=O)(=O)c1ccccc1Br 270084a_100102657272_100000184729 [0,1,0,0,1,0|1,0,1]=4 250 B12R1.195 CNS(=O)(=O)c1ccccc1Br 274078a_100102657272_100000184729 [0,1,0,0,1,0|1,0,1]=4 251 B12R1.195 CNS(=O)(=O)c1ccccc1Br 40a_100102657272_100010380725 [0,1,0,0,1,0|1,0,1]=4 252 B12R1.195 CNS(=O)(=O)c1ccccc1C 270084a_100102657272_100000750907 [0,1,0,0,1,0|1,0,1]=4 253 B12R1.195 CNS(=O)(=O)c1ccccc1C 274078a_100102657272_100000750907 [0,1,0,0,1,0|1,0,1]=4 254 B12R1.195 CNS(=O)(=O)c1ccccc1C 40a_100102657272_100010269479 [0,1,0,0,1,0|1,0,1]=4 255 B12R1.195 CNS(=O)(=O)c1ccccc1Cl 270084a_100102657272_100000184199 [0,1,0,0,1,0|1,0,1]=4 256 B12R1.195 CNS(=O)(=O)c1ccccc1Cl 274078a_100102657272_100000184199 [0,1,0,0,1,0|1,0,1]=4 257 B12R1.195 CNS(=O)(=O)c1ccccc1F 270084a_100102657272_100000184916 [0,1,0,0,1,0|1,0,1]=4 258 B12R1.195 CNS(=O)(=O)c1ccccc1F 274078a_100102657272_100000184916 [0,1,0,0,1,0|1,0,1]=4 259 B12R1.195 CNS(=O)(=O)c1ccccc1I 270084a_100102657272_100011191325 [0,1,0,0,1,0|1,0,1]=4 260 B12R1.195 CNS(=O)(=O)c1ccccc1I 274078a_100102657272_100011191325 [0,1,0,0,1,0|1,0,1]=4 261 B12R1.195 CNS(=O)(=O)c1ccccc1N 40a_100102657272_100000703237 [0,1,0,0,1,0|1,0,1]=4 262 B12R1.195 CNS(=O)(=O)c1ccccc1O 271570a_203496583355_200000165157 [0,1,0,0,1,0|1,0,1]=4 263 B12R1.195 NNS(=O)(=O)c1ccccc1O 271570a_203496583355_200011248379 [0,1,0,0,1,0|2,0,0]=4 264 B12R1.253 CN(C)S(=O)(=O)c1ccccc1 270084a_100102631434_100000210345 [0,1,0,0,1,0|1,0,1]=4 265 B12R1.253 CN(C)S(=O)(=O)c1ccccc1 274078a_100102631434_100000210345 [0,1,0,0,1,0|1,0,1]=4 266 B12R1.253 CN(C)S(=O)(=O)c1ccccc1 40a_100102631434_100000032697 [0,1,0,0,1,0|1,0,1]=4 267 B14R1.6829 C=CCS(=O)(=O)NCc1ccccc1 270084a_100015324214_100000751117 [0,1,0,0,0,1|1,0,0]=3 268 B14R1.6829 C=CCS(=O)(=O)NCc1ccccc1 274078a_100015324214_100000751117 [0,1,0,0,0,1|1,0,0]=3 269 B14R1.6829 C=CCS(=O)(=O)NCc1ccccn1 270084a_100000210449_100000751117 [0,1,0,0,0,1|2,0,0]=4 270 B14R1.6829 C=CCS(=O)(=O)NCc1ccccn1 274078a_100000210449_100000751117 [0,1,0,0,0,1|2,0,0]=4 271 B14R1.6829 C=CCS(=O)(=O)NCc1cccnc1 270084a_100000210453_100000751117 [0,1,0,0,0,1|2,0,0]=4 272 B14R1.6829 C=CCS(=O)(=O)NCc1cccnc1 274078a_100000210453_100000751117 [0,1,0,0,0,1|2,0,0]=4 273 B14R1.6829 C=CCS(=O)(=O)NCc1ccncc1 270084a_100000210450_100000751117 [0,1,0,0,0,1|2,0,0]=4 274 B14R1.6829 C=CCS(=O)(=O)NCc1ccncc1 274078a_100000210450_100000751117 [0,1,0,0,0,1|2,0,0]=4 275 B14R1.1485 CC(=O)NS(=O)(=O)Cc1ccccc1 2740a_100000198533_100015343762 [0,2,0,0,0,0|1,0,1]=4 276 B14R1.4528 C=CCNS(=O)(=O)Cc1ccccc1 270084a_100020586998_100000211737 [0,2,0,0,0,0|1,0,0]=3 277 B14R1.4528 C=CCNS(=O)(=O)Cc1ccccc1 274078a_100020586998_100000211737 [0,2,0,0,0,0|1,0,0]=3 278 B14R1.4528 C=CCNS(=O)(=O)Cc1ccccc1 40a_100020586998_100000235865 [0,2,0,0,0,0|1,0,0]=3 279 B12R2.32 C=Cc1cc2ccccc2o1 271570a_100011290941_100010159458 [1,0,0,1,0,0|2,0,0]=4 280 B12R1.27 C=CC(=O)CCc1ccccc1 1458a_100000185746_100000765856 [1,0,0,0,0,1|2,0,0]=4 281 B12R1.27 C=CC(=O)NCc1ccccc1 1626a_100015324214_100000185746 [1,0,0,0,0,1|2,0,0]=4 282 B12R1.27 C=CC(=O)NCc1ccccc1 240690a_100015324214_200121576911 [1,0,0,0,0,1|2,0,0]=4 283 B12R1.27 C=CC(=O)NNc1ccccc1 22a_100015195140_100000185746 [1,0,0,0,0,1|2,0,0]=4 284 B12R1.27 C=CC(C)OCc1ccccc1 34a_100000695699_100015291786 [1,0,0,0,0,1|2,0,0]=4 285 B12R1.27 C=CC(O)COc1ccccc1 34a_100000210340_100000730141 [1,0,0,0,0,1|1,0,1]=4 286 B12R1.27 C=CC(O)COc1ccccc1 7a_100000210340_100000730141 [1,0,0,0,0,1|1,0,1]=4 287 B12R1.891 CS(=O)(=O)NCc1ccccc1 40a_100015324214_100000738038 [1,0,0,0,0,1|1,0,1]=4 288 B12R1.891 CS(=O)(=O)NNc1ccccc1 40a_100015195140_100000738038 [1,0,0,0,0,1|1,0,1]=4 289 B12R1.891 NS(=O)(=O)CSc1ccccc1 62a_100000719477_100000741382 [1,0,0,0,0,1|1,1,0]=4 290 B12R1.891 NS(=O)(=O)CSc1ccccc1 62a_100000741382_100000041952 [1,0,0,0,0,1|1,1,0]=4 291 B12R1.891 O=S(=O)([O-])CNc1ccccc1 34a_100000106764_100009817235 [1,0,0,0,0,1|2,0,0]=4 292 B12R1.891 O=S(=O)([O-])COc1ccccc1 34a_100000210340_100009817235 [1,0,0,0,0,1|1,0,0]=3 293 B12R1.891 O=S(=O)([O-])COc1cccnc1 34a_100000210849_100009817235 [1,0,0,0,0,1|2,0,0]=4 294 B12R1.891 O=S(=O)([O-])COc1ccncc1 34a_100000212176_100009817235 [1,0,0,0,0,1|2,0,0]=4 295 B12R1.891 O=S(=O)([O-])CSc1ccccc1 62a_100000719477_100009817235 [1,0,0,0,0,1|1,1,0]=4 296 B12R1.891 O=S(=O)([O-])CSc1ccccc1 62a_100009817235_100000041952 [1,0,0,0,0,1|1,1,0]=4 297 B14R1.292 CCS(=O)(=O)CCOc1ccccc1 34a_100000210340_100000756660 [0,0,0,0,0,2|0,0,2]=4 298 B14R1.292 CCS(=O)(=O)CCOc1ccccc1 7a_100000210340_100000756660 [0,0,0,0,0,2|0,0,2]=4 299 B14R1.292 CNS(=O)(=O)CCOc1ccccc1 270084a_100102657272_100000750344 [0,0,0,0,0,2|1,0,1]=4 300 B14R1.292 CNS(=O)(=O)CCOc1ccccc1 274078a_100102657272_100000750344 [0,0,0,0,0,2|1,0,1]=4